Read e-book online Advances in Molecular Structure Research PDF

By Jeffrey M. Lemm

ISBN-10: 0762300256

ISBN-13: 9780762300259

The research of the constitution of molecular structures is an everlasting quarter of analysis. This sequence is dedicated to bringing jointly articles from prime employees within the box that draw jointly fresh theoretical and experimental effects and advances in realizing.

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19811,82, 559. (j) Creighton, T. E. J. Phys. Chem. 1985, 89, 2452. (k) Sanders, G. ; Koning, G. ; van der Plas, H. C. Rec. Trav. Chim. Pays-Bas 1985, 104, 243. ; Toth, G. J. Chem. , Perla'n Trans. 2 1986, 111. " Buss, V. Angew. Chem. Int. Ed. Engl. 1988, 27, 422. (n) Grunewald, G. ; Creese, M. ; Weintraub, H. J. R. J. Comput. Chem. 1988, 9, 315. (o) Loncharich, R. " Ferguson, S. ; Diederich, E" Houk, K. m E 22 EIJI i~SAWA N. J. Org. Chem. 1988, 53, 3479. (p) Stevens, E. S 9Sathyanarayana, B. K.

Simonsen, S. H. J. Chem. , Perkin Trans. H 1976, 1126. 46. Vishwanadhan, V. ; Mattice, W. L. J. Chem. , Perkin Trans. H 1987, 739. 47. ; Zoltewicz, J. ; Kem, W. R. Tetrahedron 1994, 50, 9909. 48. Further examples of reinforced stabilization of e-par conformation of arylcycloalkanes: (a) Earley, J. ; Todaro, L. J. J. Am. Chem. Soc. 19911, 112, 3969. ; Konar, S. K. J. Chem. , Perkin Trans. 2 1979, 269. ; Feliz, M. Can. J. Chem. 1985, 63, 3186. (d) Colebrook, L. D. Can. J. Chem. 1991, 69, 1957. ; Ragazzi, M.

Theochem) 1989, 61, 11" 1988, 50, 1. " Oberhammer, H. J. Mol. Struct. (Theochem) 1992, 258, 197. 19. Among the easiest are the gross electronic properties like dipole moments, while the hardest are the absolute energies like heat of formation. For the latter problem, see McGrath, M. ; Radom, L. J. Chem. Phys. 1991, 94, 511. 20. Sch~ifer has performed extensive ab initio calculations at higher levels of theory to obtain still larger stabilization energy for the GG interaction (private communication).

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Advances in Molecular Structure Research by Jeffrey M. Lemm

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