[1]
|
Buck, H.M. (2008) A Combined Experimental, Theoretical, and Van’t Hoff Model Study for Identity Methyl, Proton, Hydrogen Atom, and Hydride Exchange Reactions. Correlation with Three-Center Four-, Three-, and Two-Electron Systems. International Journal of Quantum Chemistry, 108, 1601-1614. http://dx.doi.org/10.1002/qua.21683
|
[2]
|
Buck, H.M. (2010) A Linear Three-Center Four Electron Bonding Identity Nucleophilic Substitution at Carbon, Boron, and Phosphorus. A Theoretical Study in Combination with Van’t Hoff Modeling. International Journal of Quantum Chemistry, 110, 1412-1424. http://dx.doi.org/10.1002/qua.22252
|
[3]
|
Buck, H.M. (2011) A Model Investigation of ab Initio Geometries for Identity and Nonidentity Substitution with Three-Center Four- and Three-Electron Transition States. International Journal of Quantum Chemistry, 111, 2242- 2250. http://dx.doi.org/10.1002/qua.22529
|
[4]
|
Buck, H.M. (2012) Mechanistic Models for the Intramolecular Hydroxycarbene-Formaldehyde Conversion and Their Intermolecular Interactions: Theory and Chemistry of Radicals, Mono-, and Dications of Hydroxycarbene and Related Configurations. International Journal of Quantum Chemistry, 112, 3711-3719. http://dx.doi.org/10.1002/qua.24127
|
[5]
|
Buck, H.M. (2013) An Adjusted Model for Simple 1,2-Dyotropic Reactions. Ab Initio MO and VB Considerations. Open Journal of Physical Chemistry, 3, 119-125. http://dx.doi.org/10.4236/ojpc.2013.33015
|
[6]
|
Buck, H.M. (2014) Three-Center Configuration with Four, Three, and Two Electrons for Carbon, Hydrogen, and Halogen Exchange. A Model and Theoretical Study with Experimental Evidence. Open Journal of Physical Chemistry, 4, 33-43. http://dx.doi.org/10.4236/ojpc.2014.42006
|
[7]
|
Yamashita, M., Yamamoto, Y., Akiba, K., Hashizume, D., Iwasaki, F., Takagi, N. and Nagase, S. (2005) Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton. Elucidation of Hypervalent Interaction Based on X-Ray Analysis and DFT Calculation. Journal of the American Chemical Society, 127, 4354-4371. http://dx.doi.org/10.1021/ja0438011
|
[8]
|
Bento, A.P. and Bickelhaupt, F.M. (2008) Nucleophilicity and Leaving Group Ability in Frontside and Backside SN2 Reactions. Journal of Organic Chemistry, 73, 7290-7299. http://dx.doi.org/10.1021/jo801215z
|
[9]
|
Bento, A.P. and Bickelhaupt, F.M. (2008) Frontside versus Backside SN2 Substitution of Group 14 Atoms. Origin of Reaction Barriers and Reasons for Their Absence. Chemistry—An Asian Journal, 3, 1783-1792.
http://dx.doi.org/10.1002/asia.200800065
|
[10]
|
Glukhovtsev, M.N., Pross, A. and Radom, L. (1995) Gas-Phase Identity SN2 Reactions of Halide Anions with Methyl Halides: A High-Level Computational Study. Journal of the American Chemical Society, 117, 2024-2032.
http://dx.doi.org/10.1021/ja00112a016
|
[11]
|
Edwards, T., Endo, T., Walton, J.H. and Sen, S. (2014) Observation of the Transition State for Pressure-Induced BO3 → BO4 Conversion in Glass. Science, 345, 1027-1029. http://dx.doi.org/10.1126/science.1256224
|
[12]
|
Taylor, M.J., Grigg, J.A. and Rickard, C.E.F. (1992) The Structure of the Cage-Like Complex Anion Formed by Sodium Borate and 1,1,1-Tris(Hydroxymethyl)Ethane. Polyhedron, 11, 889-892.
http://dx.doi.org/10.1016/S0277-5387(00)83337-9
|
[13]
|
Dewar, M.J.S. (1969) The Molecular Orbital Theory of Organic Chemistry. Chapter 8, McGraw Hill Book Company, New York.
|
[14]
|
Fitzgibbons, T.C., Guthrie, M., Xu, E.S., Crespi, V.H., Davidowski, S.K., Cody, G.D., Alem, N. and Badding, J.V. (2014) Benzene-Derived Carbon Nanothreads. Nature Materials, 14, 43-47. http://dx.doi.org/10.1038/nmat4088
|
[15]
|
Jung, M.E. and Lee, G.S. (2014) Synthesis of Highly Substituted Adamantanones from Bicyclo[3.3.1]Nonanes. Journal of Organic Chemistry, 79, 10547-10552. http://dx.doi.org/10.1021/jo501368d
|
[16]
|
Harding, M.E., Gauss, J. and von Ragué Schleyer, P. (2011) Why Benchmark-Quality Computations Are Needed to Reproduce 1-Adamantyl Cation NMR Chemical Shifts Accurately. Journal of Physical Chemistry A, 115, 2340-2344.
http://dx.doi.org/10.1021/jp1103356
|
[17]
|
Rasul, G., Olah, G.A. and Prakash, G.K.S. (2010) Density Functional Theory Study of Adamantanediyl Dications and Protio-Adamantyl Dications . Proceedings of the National Academy of Sciences of the United States of America, 101, 10868-10871. http://dx.doi.org/10.1073/pnas.0404137101
|
[18]
|
Schreiner, P.R., Chernish, L.V., Gunchenko, P.A., Tikhonchuk, E.Y., Hausmann, H., Serafin, M., Schlecht, S., Dahl, J.E.P., Carlson, R.M.K. and Fokin, A.A. (2011) Overcoming Lability of Extremely Long Alkane Carbon-Carbon Bonds through Dispersion Forces. Nature, 477, 308-311. http://dx.doi.org/10.1038/nature10367
|
[19]
|
Buck, H.M. (2000) Symmetry Restrictions as Starting Point for the Determination of Geometric Representations and the Dynamics of Cyclic π Systems. International Journal of Quantum Chemistry, 77, 641-650.
http://dx.doi.org/10.1002/(SICI)1097-461X(2000)77:3<641::AID-QUA5>3.0.CO;2-R
|
[20]
|
Buck, H.M. (2011) DNA Systems for B-Z Transition and Their Significance as Epigenetic Model: The Fundamental Role of the Methyl Group. Nucleosides, Nucleotides and Nucleic Acids, 30, 918-944.
http://dx.doi.org/10.1080/15257770.2011.620580
|
[21]
|
Buck, H.M. (2013) A Conformational B-Z DNA Study Monitored with Phosphatemethylated DNA as a Model for Epi- Genetic Dynamics Focused on 5-(Hydroxy)Methylcytosine. Journal of Biophysical Chemistry, 4, 37-46.
http://dx.doi.org/10.4236/jbpc.2013.42005
|