Adsorption/Desorption Behavior of Ethanol Steam Reforming Reaction Products and Intermediates over Supported Cobalt Catalysts
Song, H.; Bao, X.; Hadad, C. M.; Ozkan, U. S.
J. Phys. Chem. C, submitted.

An ab Initio Study of the Ground and Excited State Chemistry of Phenyldiazirine and Phenyldiazomethane
Zhang, Y.; Vyas, S.; Hadad, C. M.; Platz, M. S.
J. Phys. Chem. A, submitted.

Right- and Left- Handed Helices, What is in between? Interconversion of Helical Structures of Alternating Pyridinedicarboxamide/m-(phenylazo)azobenzene Oligomers
Tao, P.; Parquette, J. R.; Hadad, C. M.
J. Am. Chem. Soc., submitted.

Butyrylcholinesterase as a Drug for Protection against Organophosphorus Poisons: Therapeutic Successes and Oxime Reactivation Challenges
Lenz, D. E.; Reeves, T. E.; Broomfield, C. A.; Clarkson, E. D.; Schulz, S. M.; Beck, J. M.; Vyas, S.; Hadad, C. M.; Cerasoli, D. M.
Chemico-Biological Interactions, submitted.

Molecular Determinants of TRPC6 Channel Recognition by FKBP12
Tao, P.; Hackett, J. C; Kim, J. Y.; Saffen, D.; Hayes, C. J.; Hadad, C. M.
J. Phys. Chem. B, submitted.

Mechanistic Insights into the Hydrolysis of Organophosphorus Compounds by Paraoxonase 1: Exploring the Limits of Selectivity of a Promiscuous Enzyme
Muthukrishnan, S.; Shete, V. S.; Sanan, T. T.; Porter, L. M.; Magliery, T. J.; Hadad, C. M.
Biochemistry, submitted.

Molecular Recognition of a Transition State
Bao, X.; Rieth, S.; Stojanovic, S.; Hadad, C. M.; Badjic, J. D.
Angew. Chem., Int. Ed. Engl., submitted.

Ultrafast Spectroscopy and Computational Study of the Photochemistry of Diphenylphosphoryl Azide: Direct Spectroscopic Observation of a Singlet Phosphorylnitrene
Vyas, S.; Muthukrishnan, S.; Kubicki, J.; McCulla, R. D.; Platz, M. S.; Hadad, C. M.
J. Am. Chem. Soc., submitted.

Butyrylcholinesterase and G116H, G116S, G117H, G117N, E197Q and G117H/E197Q Mutants: A Molecular Dynamics Study
Vyas S.; Xia, S.; Zhang, J.; Hadad, C. M.
Chemico-Biological Interactions, submitted.

Theory and computation in the study of nitrenes and their excited state photoprecursors
Vyas S.; Winter, A. H.; Hadad, C. M.
Nitrenes and Nitrenium Ions, Wiley Interscience, submitted.

Mechanism and Stereoselection in a Y-Catalyzed Transacylation Reaction. A Computational Modeling Study
Sanan, T. T.; RajanBabu, T. V.; Hadad, C. M.
J. Org. Chem., submitted.

Difference Between alpha-Tocotrienol and alpha-Tocopherol in Binding Alkali and Alkaline-Earth Metal Cations: ESI Mass Spectrometric Study and Computational Rationales
Bao, X.; Muthukrishnan, S.; Parthasarathy, S.; Sen, C. K.; Hadad, C. M.
J. Phys. Chem. A, submitted.

Ionization Potential as a Tool to Predict the Reactivity of Persistent Carbon-Centered Radicals with Oxygen
Muthukrishnan, S.; Hadad, C. M.; Gudmundsdottir, A. D.
Org. Lett., submitted.

Substituent Effects On The Bond Dissociation Enthalpies And Hydroxyl Radical Addition At Unsaturated Carbon Centers
Merle, J. K.; Broughton, P. S.; Hadad, C. M.
J. Phys. Chem. A, submitted.

159. Reaction Profiles of the Interaction between Sarin and Acetylcholinesterase and the S203C Mutant: Model Nucleophiles and QM/MM Potential Energy Surfaces
Beck, J. M.; Hadad, C. M.
Chemico-Biological Interactions, in press (accepted).

158. The Ability of Triplet Nitrenes to Abstract Hydrogen Atoms
Sankaranarayanan, J.; Rajam, S.; Hadad, C. M.; Gudmundsdottir, A. D.
J. Phys. Org. Chem. in press (accepted).

157. Computational Modeling of Human Paraoxonase 1: Preparation of Protein Models, Binding Studies, and Mechanistic Insights
Sanan, T. T.; Muthukrishnan, S.; Beck, J. M.; Tao, P.; Hayes, C. J.; Otto, T. C.; Cerasoli, D. M.; Lenz, D. E.; Hadad, C. M.
J. Phys. Org. Chem. in press (accepted).

156. Gated Molecular Recognition and Dynamic Discrimination of Guests
Rieth, S.; Bao, X.; Wang, B.-Y.; Hadad, C. M.; Badjic, J. D.
J. Am. Chem. Soc. 2010, 132, 773 - 776.

155. Photochemical Fate of Sulfadimethoxine in Aquaculture Waters
Guerard, J. J.; Chin, Y.-C.; Mash, H.; Hadad, C. M.
Environ. Sci. Technol. 2009, 43, 8587 - 8592.

154. A Study of the S₁ Excited State of para-Methoxy 3-Phenyl-3-Methyl Diazirine by Ultrafast Time Resolved UV-Vis and IR Spectroscopies and Theory
Zhang, Y.; Burdzinski, G.; Kubicki, J.; Vyas, S.; Hadad, C. M.; Sliwa, M.; Poizat, O.; Buntinx, G.; Platz, M. S.
J. Am. Chem. Soc. 2009, 131, 13784 - 13790.

153. Pinpointing the Extent of Electronic Delocalization in the Re(I)-to-Tetrazine Charge-Separated Excited State Using Time-Resolved Infrared Spectroscopy
Li, G.; Parimal, K.; Vyas, S.; Hadad, C. M.; Flood, A. H.; Glusac, K. D.
J. Am. Chem. Soc. 2009, 131, 11656 - 11657.

152. Chemical Synthesis of Two Series of Nerve Agent Model Compounds and Their Stereoselective Interaction with Human Acetylcholinesterase and Human Butyrylcholinesterase
Barakat, N. H.; Zheng, X.; Gilley, C. B.; MacDonald, M.; Okolotowicz, K.; Cashman, J. R.; Vyas, S.; Beck, J. M.; Hadad, C. M.; Zhang, J.
Chem. Res. Toxicol. 2009, 22, 1669 - 1679.

151. Photoaffinity Labeling via Nitrenium Ion Chemistry: Protonation of the Nitrene Derived from 4-Amino-3-nitrophenyl Azide to Afford Reactive Nitrenium Ion Pairs
Voskresenska, V.; Wilson, R. M.; Panov, M.; Tarnovsky, A. N.; Krause, J. A.; Vyas, S.; Winter, A. H.; Hadad, C. M.
J. Am. Chem. Soc. 2009, 131, 11535 - 11547.

150. Optical Spectroscopic Studies of Mononitrated Benzo[a]pyrenes
Vyas, S.; Onchoke, K. K.; Rajesh, C. S.; Hadad, C. M.; Dutta, P. K.
J. Phys. Chem. A 2009, 113, 12558 - 12565.

149. Electronic Properties of 4-Substituted Naphthalimides
Kucheryavy, P.; Li, Guifeng; Vyas, S.; Hadad, C. M.; Glusac, K.
J. Phys. Chem. A 2009, 113, 6453 - 6461.

148. Direct Aldol Reactions Catalyzed by Intramolecularly Folded Prolinamide Dendrons: Dendrimer Effects on Stereoselectivity
Mitsui, K.; Hyatt, S. A.; Turner, D. A.; Hadad, C. M.; Parquette, J. R.
Chem. Commun. 2009, 3261 - 3263.

147. Water-Free Rare Earth-Prussian Blue Type Analogs: Synthesis, Structure, Computational Analysis, and Magnetic Data of {Ln^III(DMF)₆Fe^III(CN)₆}_∞ (Ln = Rare Earths Excluding Pm)
Wilson, D. C.; Liu, S.; Chen, X.; Meyers, E. A.; Bao, X.; Prosvirin, A. V.; Dunbar, K. R.; Hadad, C. M.; Shore, S. G.
Inorg. Chem. 2009, 48, 5725 - 5735.

146. Combustion Pathways of the Alkylated Heteroaromatics: Bond Dissociation Enthalpies and Alkyl-Group Fragmentations
Hayes, C. J.; Hadad, C. M.
J. Phys. Chem. A 2009, 113, 12370 - 12379.

145. Encapsulation of Guests within a Gated Molecular Basket - Thermodynamics and Selectivity
Wang, B.; Bao, X.; Stojanovic, S.; Hadad, C. M.; Badjic, J. D.
Org. Lett. 2008, 10, 5361 - 5364.

144. A 3-fold "Butterfly Valve" in Command of the Encapsulation's Kinetic Stability. Molecular Baskets at Work
Wang, B.; Bao, X.; Yan, Z.; Maslak, V.; Hadad, C. M.; Badjic, J. D.
J. Am. Chem. Soc. 2008, 130, 15127 - 15133.

143. A Close Inspection of Ag(I) Coordination to Molecular Baskets. A Study of Guest Encapsulation in Solution and the Solid State
Gardlik, M.; Yan, Z.; Xia, S.; Hadad, C. M.; Badjic, J. D.
Tetrahedron 2009, 65, 7213 - 7219.

142. Stereoselectivity in the Epoxidation of Carbohydrate-based Oxepines
Markad, S. D.; Xia, S.; Snyder, N. L.; Hadad, C. M.; Peczuh, M. W.
J. Org. Chem. 2008, 73, 6341 - 6354.

141. Synthesis and Characterization of Amino Derivatives of Persistent Trityl Radicals as Dual Function pH and Oxygen Paramagnetic Probes
Dhimitruka, I.; Bobko, A. A.; Hadad, C. M.; Zweier, J. L.; Khramtsov, V. V.
J. Am. Chem. Soc. 2008, 130, 10780 - 10787.

140. A Computational Study of the Ground and Excited State Structure and Absorption Spectra of Free-Base N-Confused Porphine and Free-Base N-Confused Tetraphenylporphyrin
Vyas, S.; Hadad, C. M.; Modarelli, D. A.
J. Phys. Chem. A 2008, 112, 6533 - 6549.

139. Molecular Encapsulation via Metal-to-Ligand Coordination in a Cu(I)-Folded Molecular Basket
Rieth, S.; Yan, Z.; Xia, S.; Gardlik, M.; Chow, A.; Fraenkel, G.; Hadad, C. M.; Badjic, J. D.
J. Org. Chem. 2008, 73, 5100 - 5109.

138. Photomodulated Chiral Induction in Helical Azobenzene Oligomers
King, E. D.; Tao, P.; Sanan, T. T.; Hadad, C. M.; Parquette, J. R.
Org. Lett. 2008, 10, 1671 - 1674.

137. Chemistry of Reactive Radical Intermediates in Combustion and the Atmosphere
Hayes, C. J.; Merle, J. K.; Hadad, C. M.
Adv. Phys. Org. Chem. 2009, 43, 79 - 134.

136. Reactivation of Model Cholinesterases by Oximes and Intermediate Phosphyloximes: A Computational Study
Vyas, S.; Hadad, C. M.
Chemico-Biological Interactions 2008, 175, 187 - 191.

135. Hydrolysis of Nerve Agents by Model Nucleophiles: A Computational Study
Beck, J. M.; Hadad, C. M.
Chemico-Biological Interactions 2008, 175, 200 - 203.

134. Time-Resolved Resonance Raman Observation of the Dimerization of Didehydroazepines in Solution
Xue, J.; Du, Y.; Chuang, Y. P.; Phillips, D. L.; Wang, J.; Luk, C.; Hadad, C. M.; Platz, M. S.
J. Phys. Chem. A 2008, 112, 1502 - 1510.

133. [Bis(trispivalatodimolybdenum (II))-m-bis(4'-carboxylato-2,2':6',2"-terpyridine) ruthenium (II)] (2+) tetrafluoroborate. Preparation, Electronic Structure and Physical Properties
Chisholm, M. C.; Hadad, C. M.; Heinze, K.; Hempel, K.; Singh, N.; Vyas, S.
J. Cluster Sci. 2008, 19, 209 - 218.

132. Large Scale Synthesis and Characterization of a Persistent Trityl Radical for Use in Biomedical EPR Applications and Imaging
Dhimitruka, I.; Velayutham, M.; Bobko, A. A.; Khramtsov, V. V.; Villamena, F. A.; Hadad, C. M.; Zweier, J. L.
Bioorg. Med. Chem. Lett. 2007, 17, 6801 - 6805.

131. Computational study of the Curtius-like rearrangements of phosphoryl, phosphinyl, and phosphinoyl azides and their corresponding nitrenes
McCulla, R. D.; Gohar, G. A.; Hadad, C. M.; Platz, M. S.
J. Org. Chem. 2007, 72, 9426 - 9438.

130. Supramolecular Catalysis at Work. Diastereoselective Synthesis of a Molecular Bowl with Dynamic Inner Space
Yan, Z.; McCracken, T.; Xia, S.; Maslak, V.; Gallucci, J.; Hadad, C. M.; Badjic, J. D.
J. Org. Chem. 2008, 73, 355 - 363.

129. Rate Constants of Hydroperoxyl Radical Addition to Cyclic Nitrones: A DFT Study
Villamena, F. A.; Merle, J. K.; Hadad, C. M.; Zweier, J. L.
J. Phys. Chem. A 2007, 111, 9995 - 10001.

128. Early Events in the Photochemistry of 2-Naphthyl Azide from Femtosecond UV/Vis Spectroscopy and Quantum Chemical Calculations: Direct Observation of a Very Short Lived Singlet Nitrene
Wang, J.; Kubicki, J.; Burdzinski, G.; Hackett, J. C; Gustafson, T. L.; Hadad, C. M.; Platz, M. S.
J. Org. Chem. 2007, 72, 7581 - 7586.

127. Silver(I) Mediated Folding of a Molecular Basket
Yan, Z.; Xia, S.; Gardlik, M.; Seo, W.; Hadad, C. M.; Badjic, J. D.
Org. Lett. 2007, 9, 2301 - 2304.

126. Reactivity of Superoxide Radical Anion with Cyclic Nitrones: Role of Intramolecular H Bond and Electrostatic Effects
Villamena, F. A.; Xia, S.; Merle, J. K.; Lauricella, R.; Tuccio, R.; Hadad, C. M.; Zweier, J. L.
J. Am. Chem. Soc. 2007 129, 8177 - 8191.

125. Oxidative Dehalogenation of Perhalogenated Benzenes by Cytochrome P450 Compound I
Hackett, J. C; Sanan, T. T.; Hadad, C. M.
Biochemistry 2007, 46, 5924 - 5940.

124. Competition between a-Cleavage and Energy Transfer in a-Azidoacetophenones
Muthukrishnan, S.; Mandel, S. M.; Hackett, J. C.; Singh, P. N. D.; Hadad, C. M.; Krause, J. A.; Gudmundsdöttir, A. D.
J. Org. Chem. 2007, 72, 2757 - 2768.

123. Concerning the Electronic Coupling of MoMo Quadruple Bonds linked by 4,4'- Azodibenzoate and Comparison with t_2g⁶-Ru(II) Centers by 4,4'-Azodiphenylcyanamido Ligands
Chisholm, M. H.; D'Acchioli, J. S.; Hadad, C. M.; Patmore, N. J.
Inorg. Chem. 2006, 45, 11035 - 11042.

122. Surface Complexes of Phthalic Acid at the Hematite/Water Interface
Hwang, Y. S.; Liu, J.; Lenhart, J. J.; Hadad, C. M.
J. Colloid Interface Sci 2007, 307, 124 - 134.

121. Theoretical and Experimental Studies of the Spin Trapping of Inorganic Radicals by 5,5-Dimethyl-1-Pyrroline N-oxide (DMPO). 2. Carbonate Radical Anion
Villamena, F. A.; Locigno, E. J.; Rockenbauer, A.; Hadad, C. M.; Zweier, J. L.
J. Phys. Chem. A 2007, 111, 384 - 391.

120. Oxidation of Oleic Acid at Air/Liquid Interfaces
Voss, L. F.; Bazerbaski, M. F.; Beekman, C. P.; Hadad, C. M.; Allen, H. C.
J. Geophys. Res. 2007, 112, D06209.

119. Theoretical and Experimental Studies of the Spin Trapping of Inorganic Radicals by 5,5-Dimethyl-1-Pyrroline N-oxide (DMPO). 1. Carbon Dioxide Radical Anion
Villamena, F. A.; Locigno, E. J.; Rockenbauer, A.; Hadad, C. M.; Zweier, J. L.
J. Phys. Chem. A 2006, 110, 13253 - 13258.

118. Conformational Analysis of Methyl 5-O-Methyl Septanosides: Effect of Glycosylation on Conformer Populations
DeMatteo, M. P.; Mei, S.; Fenton, R.; Morton, M.; Baldisseri, D. M.; Hadad, C. M.; Peczuh, M. W.
Carbohyd. Res. 2006, 341, 2927 - 2945.

117. A Comparison of the Hydrodynamic and Conformational Properties of 2-Methoxy Isophthalamide and Pyridine-2,6-dicarboxamide Dendrons
Gabriel, C. J.; DeMatteo, M. P.; Paul, N. M.; Hadad, C. M.; Parquette, J. R.
J. Org. Chem. 2006, 71, 9035 - 9044.

116. Generation and Experimental Confirmation of the Triplet Ground State of Oxynitrenes
Wasylenko, W. A.; Kebede, N.; Showalter, B. M.; Matsunaga, N.; Miceli, A. P.; Liu, Y.; Ryzhkov, L. R.; Hadad, C. M.; Toscano, J. P.
J. Am. Chem. Soc. 2006, 128, 13142 - 13150.

115. Synthesis of L-Daunosamine and L-Ristosamine Glycosides via Photoinduced Aziridination. Conversion to Thioglycosides for use in Glycosylation Reactions
Mendlik, M. T.; Tao, P.; Hadad, C. M.; Coleman, R. S.; Lowary, T. L.
J. Org. Chem. 2006, 71, 8059 - 8070.

114. Early Events in the Photochemistry of Aryl Azides from Femtosecond UV/Vis Spectroscopy and Quantum Chemical Calculations
Burdzinski, G.; Hackett, J. C; Wang, J.; Gustafson, T. L.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 2006, 128, 13402 - 13411.

113. The Physical and Electronic Structure of M₂ Complexes: A Density Functional Theory Study
Chisholm, M. H.; D'Acchioli, J. S.; Hadad, C. M.
J. Cluster Sci. 2007, 18, 27 - 49.

112. Reactive Intermediates in Combustion
Merle, J. K.; Hadad, C. M.
Reviews of Reactive Intermediate Chemistry, Volume 2; Platz, M. S.; Moss, R. A.; Jones, M., Jr., Eds.; Wiley Interscience, 2007, pp. 247 - 270.

111. Reactivity of Molecular Oxygen with Ethoxycarbonyl Derivatives of Tetrathiatriarylmethyl Radicals
Xia, S.; Villamena, F. A.; Hadad, C. M.; Kuppusamy, P.; Li, Y.; Zhu, H.; Zweier, J. L.
J. Org. Chem. 2006, 71, 7268 - 7279.

110. Competition between Atmospherically Relevant Fatty Acid Monolayers at the Air/Water Interface
Voss, L. F.; Hadad, C. M.; Allen, H. C.
J. Phys. Chem. B 2006, 110, 19487 - 19490.

109. Design, Synthesis and Conformational Dynamics of a Gated Molecular Basket
Maslak, V.; Yan, Z.; Xia, S.; Gallucci, J.; Hadad, C. M.; Badjic, J. D.
J. Am. Chem. Soc. 2006, 128, 5887 - 5894.

108. A pi-Stacking Interaction in the n-B₁₈H₂₂-Benzene System
Hamilton, E. J. M.; Kultyshev, R. G.; Du, B.; Meyers, E. A.; Liu, S.; Hadad, C. M.; Shore, S. G.
Eur. J. Chem. 2006, 12, 2571 - 2578.

107. Spectroscopic and Computational Studies of the Non-Aqueous Solvation of n-Octanol and Ethanol
Levering, L. M.; Hayes, C. J.; Callahan, K.; Hadad, C. M.; Allen, H. C.
J. Phys. Chem. B 2006, 110, 6325 - 6331.

106. Structure and Vibrational Spectra of Mononitrated Benzo[a]pyrenes
Onchoke, K. K.; Hadad, C. M.; Dutta, P. K.
J. Phys. Chem. A 2006, 110, 76 - 84.

105. Electronically Coupled MM Quadruply-Bonded Complexes, (M=Mo or W). Employing Functionalized Terephthlalate Bridges: Toward Molecular Rheostats and Switches
Chisholm, M.H.; Feil, F.; Hadad, C. M.; Patmore, N. J.
J. Am. Chem. Soc. 2005, 127, 18150 - 18158.

104. The Direct Detection of an Aryl Azide Excited State: An Ultrafast Study of the Photochemistry of para and ortho-Biphenyl Azide
Burdzinski, G. T.; Gustafson, T. L.; Hackett, J. C.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 2005, 127, 13764 - 13765.

103. Superoxide Radical Adduct of 5,5-Dimethyl-1-pyrroline N-oxide (DMPO). 2. The Thermodynamics of Decay and EPR Spectral Properties
Villamena, F. A.; Merle, J. K.; Hadad, C. M.; Zweier, J. L.
J. Phys. Chem. A 2005, 109, 6089 - 6098.

102. Superoxide Radical Adduct of 5,5-Dimethyl-1-pyrroline N-oxide (DMPO). 1. The Thermodynamics of Formation and Its Acidity
Villamena, F. A.; Merle, J. K.; Hadad, C. M.; Zweier, J. L.
J. Phys. Chem. A 2005, 109, 6083 - 6088.

101. The Gas-Phase Acidity of 2(3H)-Oxepinone: A Step Towards an Experimental Heat of Formation for the 2-Oxepinoxy Radical
Kroner, S. M.; DeMatteo, M. P.; Hadad, C. M.; Carpenter, B. K.
J. Am. Chem. Soc. 2005, 127, 7466 - 7473.

100. On the Electrophilicity of Hydroxyl Radical: A Laser Flash Photolysis and Computational Study
DeMatteo, M. P.; Poole, J. S.; Shi, X.; Sachdeva, R.; Hatcher, P. G.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 2005, 127, 7094 - 7109.

99. Studies of Oxalate-bridged MM Quadruple Bonds and their Radical Cations (M = Mo or W): On the Matter of Linkage Isomers
Chisholm, M. H.; D'Acchioli, J. S.; Hadad, C. M.; Patmore, N. J.
Dalton Trans. 2005, 1852 - 1857.

98. Theoretical Determinations of the Ambient Conformational Distribution and Unimolecular Decomposition of n-Propylperoxy Radical
Merle, J. K.; Hayes, C. J.; Zalyubovsky, S. J.; Glover, B. G.; Miller, T. A.; Hadad, C. M.
J. Phys. Chem. A 2005, 109, 3637 - 3646.

97. The Final Catalytic Step of Cytochrome P450 Aromatase: A Density Functional Theory Study
Hackett, J. C.; Brueggemeier, R. W.; Hadad, C. M.
J. Am. Chem. Soc. 2005, 127, 5224 - 5237.

96. Insights into the Structure of Cutin and Cutan from Agave americana leaf cuticle using HR-MAS NMR Spectroscopy
Deshmukh, A. P.; Simpson, A. J.; Hadad, C. M.; Hatcher, P. G.
Organic Geochemistry 2005, 36, 1072 - 1085.

95. A Study of Singlet and Triplet 2,6-Difluorophenylnitrene by Time Resolved Infrared Spectroscopy
Mandel, S.; Liu, J.; Hadad, C. M.; Platz, M. S.
J. Phys. Chem. A 2005, 109, 2816 - 2821.

94. Reaction of Hydroxyl Radical with Aromatic Hydrocarbons in Non-Aqueous Solutions - A Laser Flash Photolysis Study in Acetonitrile
Poole, J. S.; Shi, X.; Hadad, C. M.; Platz, M. S.
J. Phys. Chem. A 2005, 109, 2547 - 2551.

93. The Reaction of Triplet Nitrenes with Oxygen: A Computational Study
Liu, J.; Hadad, C. M.; Platz, M. S.
Org. Lett. 2005, 7, 549 - 552.

92. Observation of the A - X Electronic Transition of the 1-C₃H₇O₂ and 2-C₃H₇O₂ Radicals using Cavity Ringdown Spectroscopy
Zalyubovsky, S. J.; Glover, B. G.; Miller, T. A.; Hayes, C.; Merle, J. K.; Hadad, C. M.
J. Phys. Chem. A 2005, 109, 1308 - 1315.

91. Comparative DFT Study of the Spin Trapping of Methyl, Mercapto, Hydroperoxy, Superoxide and Nitric Oxide Radicals by Various Substituted Cyclic Nitrones
Villamena, F. A.; Hadad, C. M., Zweier, J. L.
J. Phys. Chem. A 2005, 109, 1662 - 1674.

90. Spectroscopic and Computational Studies of Aqueous Ethylene Glycol Solution Surfaces
Hommel, E. L.; Merle, J. K.; Ma, G.; Hadad, C. M.; Allen, H. C.
J. Phys. Chem. B 2005, 109, 811 - 818.

89. Septanose Carbohydrates: Synthesis and Conformational Studies of Methyl a-D-Glycero-D-idoseptanoside and Methyl b-D-Glycero-D-guloseptanoside
DeMatteo, M. P.; Snyder, N. L.; Morton, M.; Baldisseri, D. M.; Hadad, C. M.; Peczuh, M. W.
J. Org. Chem. 2005, 70, 24 - 38.

88. A Comparison of Acetyl and Methoxycarbonylnitrenes by Computational Methods and a Laser Flash Photolysis Study of Benzoylnitrene
Liu, J.; Mandel, S.; Hadad, C. M.; Platz, M. S.
J. Org. Chem. 2004, 69, 8583 - 8593.

87. Spin Trapping by 5-Carbamoyl-5-methyl-1-pyrroline N-oxide (AMPO): Theoretical and Experimental Studies
Villamena, F. A.; Gallucci, J.; Velayutham, M.; Hadad, C. M., Zweier, J. L.
J. Org. Chem. 2004, 69, 7994 - 8004.

86. Computational Study of the Oxygen Initiated Decomposition of 2-Oxepinoxy Radical: A Key Intermediate in the Oxidation of Benzene
Merle, J. K.; Hadad, C. M
J. Phys. Chem. A 2004, 108, 8419 - 8433.

85. Thienyl Carboxylate Ligands Bound to and Bridging MM Quadruple Bonds, M = Mo or W: Models for Polythiophenes Incorporating MM Quadruple Bonds
Byrnes, M. J.; Chisholm, M. H.; Clark, R. J. H.; Gallucci, J. C.; Hadad, C. M.; Patmore, N. J.
Inorg. Chem. 2004, 43, 6334 - 6344.

84. Electronically-Coupled Tungsten-Tungsten Quadruple Bonds: Comparisons of Electron Delocalization in 3,6-Dioxypyridazine and Oxalate-Bridged Compounds
Chisholm, M. H.; Clark, R. J. H.; Gallucci, J.; Hadad, C. M.; Patmore, N. J.
J. Am. Chem. Soc. 2004, 126, 8303 - 8313.

83. Regioregular and Regioirregular Oligoether Carbonates: A ¹³C{¹H} NMR Investigation
Byrnes, M. J.; Chisholm, M. H.; Hadad, C. M.; Zhou, Z.
Macromolecules 2004, 37, 4139 - 4145.

82. 9,10-Anthracene Dicarboxylate Bridged Complexes with M₂ Quadruply Bonded Tungsten Dimetal Units: [{M₂(O₂C^tBu)₃}₂(m-9,10-An(CO₂)₂)], where M = Mo or W
Byrnes, M. J.; Chisholm, M. H.; Dye, D. F.; Hadad, C. M.; Wilson, P. J.; Zaleski, J. M.
Dalton Trans. 2004, 523 - 529.

81. 3,6-Dioxypyridazine Bridged Tungsten-Tungsten Quadruple Bonds. Comparisons of Electron Delocalisation with Oxalate Bridged Compounds
Chisholm, M. H.; Clark, R. J. H.; Hadad, C. M.; Patmore, N. J.
Chem. Commun. 2004, 80 - 82.

80. Theoretical Study of the Spin Trapping of Hydroxyl Radical by Cyclic Nitrones: A Density Functional Theory Approach
Villamena, F. A.; Hadad, C. M., Zweier, J. L.
J. Am. Chem. Soc. 2004, 126, 1816 - 1829.

79. M₂(hpp)₄Cl₂ and M₂(hpp)₄, where M=Mo and W: Preparations, Structure and Bonding and Comparisons with C₂, C₂H₂ and C₂Cl₂ and the Hypothetical Molecules M₂(hpp)₄(H)₂
Chisholm, M. H.; Gallucci, J.; Hadad, C. M.; Huffman, J. C.; Wilson, P. J.
J. Am. Chem. Soc. 2003, 125, 16040 - 16049.

78. A Density Functional Theory Study of Nitrated Polycyclic Aromatic Hydrocarbons: Examining the Correlation between Nitro Group Orientation and Biological Activity
Onchoke, K. K.; Hadad, C. M.; Dutta, P. K.
Polycyclic Aromatic Compounds 2004, 24, 37 - 64.

77. Alkyne Adducts of [W₂(OCH₂^tBu)₈]. Cases of Perpendicular and Skewed Bridges in Equilibrium with Terminal Bonded Isomers
Chisholm, M. H.; Click, D. R.; Gallucci, J. C.; Hadad, C. M.; Wilson, P. J.
Organometallics 2003, 22, 4725 - 4733.

76. Photochemistry of 1-(N,N-Diethylamino)diazen-1-ium-1,2-diolate: An Experimental and Computational Investigation
Pavlos, C. M.; Cohen, A. D.; D'Sa, R. A.; Sunoj, R. B.; Wasylenko, W. A.; Kapur, P.; Relyea, H. A.; Kumar, N. A.; Hadad. C. M.; Toscano, J. P.
J. Am. Chem. Soc. 2003, 25, 14934 - 14940.

75. Regioselectivity in Alkylation Reactions of 1,2-O-Stannylene Acetals of D-Arabinofuranose
Darwish, O. S.; Callam, C. S.; Hadad, C. M.; Lowary, T. L.
J. Carbohyd. Chem. 2003, 22, 963 - 981.

74. A New Approach to Evaluating the Extent of Michael Adduct Formation to PAH Quinones: Tetramethylammonium Hydroxide (TMAH) Thermochemolysis with GC/MS
Briggs, M. K.; Desavis, E.; Mazzer, P. A.; Sunoj, R. B.; Hatcher, S. A.; Hadad, C. M.; Hatcher, P. G.
Chem. Res. Toxicol. 2003, 16, 1484 - 1492.

73. Mechanistic Studies of the Copolymerization of Propylene Oxide and Carbon Dioxide: A Microstructural Approach
Byrnes, M. J.; Chisholm, M. H.; Hadad, C. M.; Zhou, Z.
Polymer Preprints 2003, 44, 695 - 696.

72. Conformational Properties of Folded Metallodendrimers
Rauckhorst, M. R.; Wilson, P. J.; Hatcher, S. A.; Hadad, C. M.; Preston, A. J.; Parquette, J. R.
Polymer Preprints 2003, 44, 470 - 471.

71. Reactions of [W₂(OCH₂^tBu)₈] (M=M) with Diazobenzene and Trimethylsilyldiazomethane. Preparation and Structures of W₂(OCH₂^tBu)₈(NPh) and W₂(OCH₂^tBu)₈(N₂C(H)SiMe₃)
Chisholm, M. H.; Click, D. R.; Gallucci, J. C.; Hadad, C. M.
Dalton Trans. 2003, 3205 - 3210.

70. A Computational Study of the Halogen Atom-Benzene Complexes
Tsao, M.-L.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 2003, 125, 8390 - 8399.

69. Gas and Solution Phase Energetics of the Methyl a- and b-D-Aldopentofuranosides
Houseknecht, J. B.; Lowary, T. L.; Hadad, C. M.
J. Phys. Chem. A 2003, 107, 5763 - 5777.

68. Kinetic Study and Theoretical Analysis of Hydroxyl Radical Trapping and Spin Adduct Decay of Alkoxycarbonyl- and Dialkyloxyphosphoryl-nitrones in Aqueous Media
Villamena, F. A.; Hadad, C. M., Zweier, J. L.
J. Phys. Chem. A 2003, 107, 4407 - 4414.

67. "Locking" Dendrimer Confromation through Metal Coordination
Rauckhorst, M. R.; Wilson, P. J.; Hatcher, S. A.; Hadad, C. M.; Parquette, J. R.
Tetrahedron 2003, 59, 3917 - 3923.

66. Improved Karplus Equations for ³J_C1,H4 in Aldopentofuranosides. Application to the Conformational Preferences of the Methyl Aldopentofuranosides
Houseknecht, J. B.; Lowary, T. L.; Hadad, C. M.
J. Phys. Chem. A 2003, 107, 372 - 378.

65. Alkyne Adducts of [W₂(OCH₂^tBu)₈]_n (M=M). Comparisons of Bridging and Terminal Addition Products
Chisholm, M. H.; Click, D. R.; Galluci, J. C.; Hadad, C. M.; Wilson, P. J.
J. Am. Chem. Soc. 2002, 124, 14518 - 14519.

64. Substituent Effects on the Electronic Structure and pKa of Benzoic Acid
Hollingsworth, C. A.; Seybold, P. G.; Hadad, C. M.
Int. J. Quantum Chem. 2002, 90, 1396 - 1403.

63. Perfluoroterephthalate Bridged Complexes with M-M Quadruple Bonds: (^tBuCO₂)₃M₂(m-O₂CC₆F₄CO₂)M₂(O₂C^tBu)₃, where M = Mo or W. Studies of Solid-State, Molecular and Electronic Structure and Correlations with Electronic and Raman Spectral Data
Bursten, B. E.; Chisholm, M. H.; Clark, R. J. H.; Firth, S.; Hadad, C. M.; Wilson, P. J.; Woodward, P. W.; Zaleski, J. M.
J. Am. Chem. Soc. 2002, 124, 12244 - 12254.

62. Photoelectron Spectroscopy of HCCN^- and HCNC^- reveals the Quasilinear Triplet Carbenes, HCCN and HCNC
Nimlos, M. R.; Davico, G.; Geise, C. M.; Wenthold, P. G.; Lineberger, W. C.; Blanksby, S. J.; Hadad, C. M.; Petersson, G. A.; Ellison, G. B.
J. Chem. Phys. 2002, 117, 4323 - 4339.

61. The Photochemistry of Riboflavin Tetraacetate and Nucleosides. A Study using Density Functional Theory, Laser Flash Photolysis, Fluorescence, UV-Vis, and Time Resolved Infrared Spectroscopy
Martin, C. B.; Shi, X.; Tsao, M.-L.; Karweik, D.; Brooke, J.; Hadad, C. M.; Platz, M.S.
J. Phys. Chem. B 2002, 106, 10263 - 10271.

60. Electronic Coupling Between Molybdenum and Tungsten Quadruple Bonds in Molecular Squares and Extended Chains Linked by Oxalate, Acetylenedicarboxylate and Perfluoroterephthalate Bridges.
Bursten, B. E.; Chisholm, M. H.; Hadad, C. M.; Li, J.; Wilson, P. J.
Isr. J. Chem. 2001, 41, 187 - 195.

59. Conformational Analysis of Furanose Rings with PSEUROT: Parameterization for Rings Possessing the Arabino-, Lyxo-, Ribo- and Xylo- Stereochemistry and Application to Arabinofuranosides
Houseknecht, J. B.; Altona, C.; Hadad, C. M.; Lowary, T. L.
J. Org. Chem. 2002, 67, 4647 - 4651.

58. The Reaction of Triplet Flavin with Indole. A Study using Density Functional Theory and Time Resolved Infrared Spectroscopy
Martin, C. B.; Tsao, M.-L.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 2002, 124, 7226 - 7234.

57. Bystander Effects on Carbene Rearrangements: A Computational Study
Hill, B.; Zhu, Z.; Boeder, A.; Hadad, C. M.; Platz, M. S.
J. Phys. Chem. A 2002, 106, 4970 - 4979.

56. The Rearrangement Pathways of 2-Hydroxy-2-methylpropylidene: An Experimental and Computational Study
Farlow, R. A.; Thamattoor, D. M.; Sunoj, R. B.; Hadad, C. M.
J. Org. Chem. 2002, 67, 3257 - 3265.

55. Computational and Experimental Studies of the Effect of Substituents on the Singlet-Triplet Energy Gap in Phenyl(carbomethoxy)carbene
Geise, C. M.; Wang, Y.; Mykhaylova, O.; Frink, B. T.; Toscano, J. P.; Hadad, C. M.
J. Org. Chem. 2002, 67, 3079 - 3088.

54. Substituent Effects in the Interconversion of Phenylcarbene, Bicyclo[4.1.0]hepta-2,4,6-triene and 1,2,4,6-Cycloheptatetraene
Geise, C. M.; Hadad, C. M.
J. Org. Chem. 2002, 67, 2532 - 2540.

53. Photochemical Electron Transfer Reactions of Tirapazamine
Poole, J. S.; Hadad, C. M.; Platz, M. S.; Fredin, Z. P.; Pickard, L.; Chowdhury, G.; Kotandeniya, D.; Gates, K. S.
Photochem. Photobiol., 2002, 75, 339 - 345.

52. Oxalate-Bridged Complexes of Dimolybdenum and Ditungsten Supported by Pivalate Ligands: (^tBuCO₂)₃M₂(m-O₂C₂O₂)M₂(O₂C^tBu)₃. Correlation of the Solid State, Molecular and Electronic Structures with Raman, Resonance Raman and Electronic Spectral Data
Bursten, B. E.; Chisholm, M. H.; Clark, R. J. H.; Firth, S.; Hadad, C. M.; Macintosh, A. M.; Wilson, P. J.; Woodward, P. W.; Zaleski, J. M.
J. Am. Chem. Soc. 2002, 124, 3050 - 3063.

51. Comparison of Different Atomic Charge Schemes for Predicting pKa Variations in Substituted Anilines and Phenols
Gross, K. C.; Seybold, P. G.; Hadad, C. M.
Int. J. Quantum Chem. 2002, 90, 445 - 458.

50. A Computational Study of Cyclopropylnitrene
Tsao, M.-L.; Hadad, C. M.; Platz, M. S.
Tetrahedron Lett. 2002, 43, 745 - 748.

49. Solvent Dependence of the 2-Naphthyl(carbomethoxy)carbene Singlet/Triplet Energy Gap
Wang, Y.; Hadad, C. M.; Toscano, J. P.
J. Am. Chem. Soc. 2002, 124, 1761 - 1767.

48. An Experimental and Computational Evaluation of the Energetics of the Isomeric Methoxyphenylcarbenes Generated in Carbon Atom Reactions
Geise, C. M.; Hadad, C. M.; Zheng, F.; Shevlin, P. B.
J. Am. Chem. Soc. 2002, 124, 355 - 364.

47. Computational Analysis of the Potential Energy Surfaces of Glycerol in the Gas and Aqueous Phases. Effects of Level of Theory, Basis Set, and Solvation on Strongly Intramolecularly Hydrogen-Bonded Systems
Callam, C. S.; Singer, S. J.; Lowary, T. L.; Hadad, C. M.
J. Am. Chem. Soc. 2001, 123, 11743 - 11754.

46. M₂ d-to-Oxalate p* Conjugation in Oxalate-Bridged Complexes Containing M-M Quadruple Bonds
Bursten, B. E.; Chisholm, M. H.; Hadad, C. M.; Wilson, P. J.
Chem. Commun. 2001, 2382 - 2383.

45. Chalcogenide-Bridged Ditungsten (M-M) Complexes: An Experimental and Theoretical Study of the Electronic Structure and Bonding in W₂(m-E)(m-OCH₂^tBu)₂(OCH₂^tBu)₆, where E = O, S, Se or Te
Bollinger, J. C.; Chisholm, M. H.; Click, D. R.; Folting, K.; Hadad, C. M.; Tiedtke, D. B.; Wilson, P. J.
J. Chem. Soc., Dalton Trans. 2001, 2074 - 2082.

44. Computational Studies of the Arabinofuranose Ring: Conformational Preferences of Fully Relaxed Methyl a-D-Arabinofuranoside
McCarren, P. R.; Gordon, M. T.; Lowary, T. L.; Hadad, C. M.
J. Phys. Chem. A 2001, 105, 5911 - 5922.

43. Conformational Studies of Methyl 3-O-Methyl-a-D-Arabinofuranoside: An Approach for Studying the Conformation of Furanose Rings
Houseknecht, J. B.; McCarren, P. R.; Lowary, T. L.; Hadad, C. M.
J. Am. Chem. Soc. 2001, 123, 8811 - 8824.

42. A Laser Flash Photolysis and Quantum Chemical Study of the Fluorinated Derivatives of Singlet Phenylnitrene
Gritsan, N. P.; Gudmundsdottir, A. D.; Tigelaar, D.; Zhu, Z.; Karney, W. L.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 2001, 123, 1951 - 1962.

41. Reactions of Ar⁺ with Selected Volatile Organic Compounds. A Flowing Afterglow and Selected Ion Flow Tube Study
Cohen, M. H.; Barckholtz, C.; Frink, B. T.; Bond, J. J.; Geise, C. M.; Hoff, J.; Herlinger, J.; Hickey, T.; Hadad, C. M.
J. Phys. Chem. A 2000, 104, 11318 - 11327.

40. Computational Study of the Electronic Structure of Substituted Phenylcarbene in the Gas Phase
Geise, C. M.; Hadad, C. M.
J. Org. Chem. 2000, 65, 8348 - 8356.

39. A Mechanistic Study of the Reactions of H, O (³P), and OH with Monocyclic Aromatic Hydrocarbons by Density Functional Theory
Barckholtz, C.; Barckholtz, T. A.; Hadad, C. M.
J. Phys. Chem. A 2001, 105, 140 - 152.

38. Unimolecular Decomposition of 2-Oxepinoxy Radical: A Key 7-Membered Ring Intermediate in the Thermal Oxidation of Benzene
Fadden, M. J.; Hadad, C. M.
J. Phys. Chem. A 2000, 104, 8121 - 8130.

37. The Rearrangement Pathways of Arylperoxy Radicals. 2. The Five-Membered Heterocycles
Fadden, M. J.; Hadad, C. M.
J. Phys. Chem. A 2000, 104, 6324 - 6331.

36. The Gas Phase Reactivity of Nucleophiles with Thioesters: A Flowing Afterglow Study
D'Aurora, L. B.; Frink, B. T.; Geise, C. M.; Cohen, M. H.; Hadad, C. M.
J. Am. Chem. Soc., submitted.

35. The Rearrangement Pathways of Arylperoxy Radicals. 1. The Azabenzenes
Fadden, M. J.; Hadad, C. M.
J. Phys. Chem. A 2000, 104, 6088 - 6094.

34. The Fragmentation Pathways of Protonated Glycine. A Computational Study
O'Hair, R. A. J.; Broughton, P. S.; Styles, M. L.; Frink, B. T.; Hadad, C. M.
J. Am. Soc. Mass Spectrom. 2000, 11, 687 - 696.

33. Formation of Anti-Bredt Olefins from Bridgehead Carbene Precursors: A Computational Study
Geise, C. M.; Hadad, C. M.
J. Am. Chem. Soc. 2000, 122, 5861 - 5865.

32. Solvation Effects on Rearrangements of Alkyl and Dialkyl Carbenes: Continuum Dielectric Methods and Explicit Solvent Molecules
Sulzbach, H. M.; Geise, C. M.; Hadad, C. M.
J. Am. Chem. Soc., submitted.

31. Zero-field Splitting of the Triplet Ground and Excited States of 7H-Benz[de]anthracen-7-ylidene in n-hexane at 1.7 K. A Hole Burning Study.
Kozankiewicz, B.; Aloshyna, M.; Sienkiewicz, A.; Orrit, M.; Tamarat, Ph.; Hadad, C. M.; Snoonian, J. R.; Platz, M. S.
J. Phys. Chem. A 2000, 104, 5213 - 5218.

30. Spectroscopic studies of 12-oxo-5(12H)-naphthacenylidene and 7H-Benz[de]anthracen-7-ylidene in Shpolskii matrixes at 5 K
Aloshyna, M.; Kozankiewicz, B.; Hadad, C. M.; Snoonian, J. R.; Platz, M. S.
J. Phys. Chem. A 2000, 104, 3391 - 3397.

29. The Interplay of Theory and Experiment in the Study of Phenylnitrene
Borden, W. T.; Gritsan, N. P.; Hadad, C. M.; Karney, W. L.; Kemnitz, C. R.; Platz, M. S.
Acc. Chem. Res. 2000, 33, 765 - 771.

28. Computational Study of the Unimolecular Decomposition Pathways of Phenylperoxy Radical
Fadden, M. J.; Barckholtz, C.; Hadad, C. M.
J. Phys. Chem. A 2000, 104, 3004 - 3011.

27. Probing Furanose Ring Conformation by Gas-Phase Computational Methods: Energy Profile and Structural Parameters in Methyl b-D-Arabinofuranoside as a Function of Ring Conformation
Gordon, M. T.; Lowary, T. L.; Hadad, C. M.
J. Org. Chem. 2000, 65, 4954 - 4963.

26. Time-Resolved IR Studies of Triplet 1,3-Cyclopentanediyl
Showalter, B. M.; Bentz, T. C.; Ryzhkov, L. R.; Hadad, C. M.; Toscano, J. P.
J. Phys. Org. Chem. 2000, 13, 309 - 312.

25. Flowing Afterglow Study of the Gas Phase Nucleophilic Reactions of Some Formyl, Acetyl and Cyclic Esters
Frink, B. T.; Hadad, C. M.
J. Chem. Soc., Perkin Trans. 2 1999, 11, 2397 - 2408.
(Memorial issue for the late Professor Robert R. Squires.)

24. A Computational Study of Methyl-a-D-Arabinofuranoside: Effect of Ring Conformation on Structural Parameters and Energy Profile
Gordon, M. T.; Lowary, T. L.; Hadad, C. M.
J. Am. Chem. Soc. 1999, 121, 9682 - 9692.

23. Computational Study of the Mechanisms for the Reaction of O₂ with Aromatic Radicals
Barckholtz, C.; Fadden, M. J.; Hadad, C. M.
J. Phys. Chem. A 1999, 103, 8108 - 8117.

22. Experimental and Theoretical Investigations of Ring-Expansion in 1-Methylcyclopropylcarbene
Thamattoor, D. M.; Snoonian, J. R.; Sulzbach, H. M.; Hadad, C. M.
J. Org. Chem. 1999, 64, 5886 - 5895.

21. Spectroscopic and Computational Studies of Perfluorophenyl and Perfluoro-2-Naphthyl Nitrenes in Shpolskii Matrices
Kozankiewicz, B.; Deperasinska, I.; Zhai, H. B.; Zhu, Z.; Hadad, C. M.
J. Phys. Chem. A 1999, 103, 5003 - 5010.

20. A Laser Flash Photolysis and Computational Study of Singlet Phenylnitrene
Gritsan, N. P.; Zhu, Z.; Hadad, C. M.; Platz, M. S.
J. Am. Chem. Soc. 1999, 121, 1202 - 1207.

19. C-H and N-H Bond Dissociation Energies of Small Aromatic Hydrocarbons
Barckholtz, C.; Barckholtz, T. A.; Hadad, C. M.
J. Am. Chem. Soc. 1999, 121, 491 - 500.

18. Computational Studies of Halonium Ions of Cyclohexane and Cyclopentane
Damrauer, R.; Leavell, M. D.; Hadad, C. M.
J. Org. Chem. 1998, 63, 9476 - 9485.

17. C-O and C-S Bonds: Stability, Bond Dissociation Energies and Resonance Stabilization
Hadad, C. M.; Rablen, P. R.; Wiberg, K. B.
J. Org. Chem. 1998, 63, 8668 - 8681.

16. The Structure of Psoralen Triplet States: Time-Resolved Infrared Spectra and Quantum Chemical Calculations
Toscano, J. P.; Hadad, C. M.; Platz, M. S.; Gustafson, T. L. ; Yuzawa, T.; Hamaguchi, H. Time-Resolved Vibrational Spectroscopy VII, Dyer, R. B.; Martinez, M. A. D.; Shreve, A.; Woodruff, W. H. Eds. (Los Alamos Conference Proceedings, LA-13290, 1997), pp. 311-312.

15. Hydrogen Migration vs Carbon Migration in Dialkylcarbenes. A Study of the Preferred Product in the Carbene Rearrangements of Ethylmethylcarbene, Cyclobutylidene, 2-Norbornylidene and 2-Bicyclo[2.1.1]hexylidene
Sulzbach, H. M.; Platz, M. S.; Schaefer, H. F., III; Hadad, C. M.
J. Am. Chem. Soc. 1997, 119, 5682 - 5689.

14. Fluorescence Lifetime Measurements and Spectral Analysis of Adamantyl Diazirine
Buterbaugh, J. S.; Toscano, J. T.; Weaver, W. L.; Gord, J. R.; Hadad, C. M.; Gustafson, T. L.; Platz, M. S.
J. Am. Chem. Soc. 1997, 119, 3580 - 3591.

13. Butadiene. 3. Charge Distribution in Electronically Excited States
Wiberg, K. B.; Hadad, C. M.; Ellison, G. B.; Foresman, J. B.
J. Phys. Chem. 1993, 97, 13586 - 13597.

12. Tricyclo[2.1.0.01,3]pentane
Wiberg, K. B.; McMurdie, N.; McClusky, J. V.; Hadad, C. M.
J. Am. Chem. Soc. 1993, 115, 10653 - 10657.

11. A Theoretical and Experimental Investigation of Vicinal Tricarbonyl Systems and Their Hydrates
Henke, S. L.; Hadad, C. M.; Morgan, K. M.; Wiberg, K. B.; Wasserman, H. H.
J. Org. Chem. 1993, 58, 2830 - 2839.

10. Excited States of Carbonyl Compounds. I. Formaldehyde and Acetaldehyde
Hadad, C. M.; Foresman, J. B.; Wiberg, K. B.
J. Phys. Chem. 1993, 97, 4293 - 4312.

9. Electronically Excited States of Ethylene
Wiberg, K. B.; Hadad, C. M.; Foresman, J. B.; Chupka, W. A.
J. Phys. Chem. 1992, 96, 10756 - 10768.

8. Substituent Effects. 4. Nature of Substituent Effects at Carbonyl Groups
Wiberg, K. B.; Hadad, C. M.; Rablen, P. R.; Cioslowski, J.
J. Am. Chem. Soc. 1992, 114, 8644 - 8654.

7. Structures and Energies of Ions Derived from Bicyclo[1.1.1]pentane
Wiberg, K. B.; Hadad, C. M.; Sieber, S.; Schleyer, P. v. R.
J. Am. Chem. Soc. 1992, 114, 5820 - 5828.

6. An Analysis of the Effect of Electron Correlation on Charge Density Distributions
Wiberg, K. B.; Hadad, C. M.; LePage, T. J.; Breneman, C. M.; Frisch, M. J.
J. Phys. Chem. 1992, 96, 671 - 679.

5. Stereochemistry of Metalated Aldimines. 2. A Theoretical Study of Dimeric Ion-Pair Aggregates of Isomeric Lithioacetaldimines and of their Kinetically Controlled Reactions with Formaldehyde
Glaser, R.; Hadad, C. M.; Wiberg, K. B.; Streitweiser, A.
J. Org. Chem. 1991, 56, 6625 - 6637.

4. How do Electrons Respond to Structural Changes?
Wiberg, K. B.; Hadad, C. M.; Breneman, C. M.; Laidig, K. E.; Murcko, M. A.; LePage, T. J.
Science 1991, 252, 1266 - 1272.

3. Assignment of the A State in Bicyclobutane. The Multiphoton Ionization Spectrum and Calculations of the Transition Energies
Walters, V. A.; Hadad, C. M.; Thiel, Y.; Colson, S. D.; Wiberg, K. B.; Johnson, P. M.; Foresman, J. B.
J. Am. Chem. Soc. 1991, 113, 4782 - 4791.

2. Interrelationships among Heats of Formation and Molecular Mechanics Steric Energies
Hadad, C. M.; Damewood, J. R., Jr.; Liebman, J. F.
Tetrahedron 1989, 45, 1623 - 1632.

1. Pyramidal Inversion in Silyl Anions
Damewood, J. R., Jr.; Hadad, C. M.
J. Phys. Chem. 1988, 92, 33 - 36.