The influence of torsional vibrations on the molecular configuration determined by gas electron diffraction

作者: L.V. Vilkov , N.P. Penionzhkevich , J. Brunvoll , I. Hargittai

DOI: 10.1016/0022-2860(78)85034-0

关键词:

摘要: Abstract As a consequence of intramolecular vibrations distorted apparent structures may result from an electron diffraction analysis molecules possessing symmetrical equilibrium configuration. The amount torsional distortion gives information concerning the barrier height to internal rotation. An approach is suggested estimate heights on basis average angles as determined diffraction, and expressions rotation-dependent distances obtained Taylor expansion by neglecting higher order terms.

参考文章(15)
D. A. Swick, I. L. Karle, J. Karle, The Structure and Internal Motion of Hexachloroethane The Journal of Chemical Physics. ,vol. 22, pp. 1242- 1245 ,(1954) , 10.1063/1.1740341
J. Karle, Electron Scattering and Internal Rotation The Journal of Chemical Physics. ,vol. 22, pp. 1246- 1250 ,(1954) , 10.1063/1.1740342
A. Almenningen, O. Bastiansen, M. Trætteberg, An Electron Diffraction Investigation of the Molecular Structure of Allene. Acta Chemica Scandinavica. ,vol. 13, pp. 1699- 1702 ,(1959) , 10.3891/ACTA.CHEM.SCAND.13-1699
N.I. Sadova, L.V. Vilkov, L. Hargittai, J. Brunvoll, Electron diffraction study on the molecular structure of benzyl chloride and benzyl bromide in the vapour phase Journal of Molecular Structure. ,vol. 31, pp. 131- 142 ,(1976) , 10.1016/0022-2860(76)80124-X
Béla Rozsondai, István Hargittai, Electron diffraction study of the molecular structure of bis(trimethylgermyl)ketene Journal of Molecular Structure. ,vol. 17, pp. 53- 64 ,(1973) , 10.1016/0022-2860(73)85042-2
D.W.H. Rankin, A. Robertson, The molecular structure of hexafluorodisilane, determined by gas phase electron diffraction Journal of Molecular Structure. ,vol. 27, pp. 438- 439 ,(1975) , 10.1016/0022-2860(75)87056-6
S. H. Bauer, A. L. Andreassen, Reduction of diffraction data for molecules with large amplitude motions. Approximate, general analysis The Journal of Physical Chemistry. ,vol. 76, pp. 3099- 3108 ,(1972) , 10.1021/J100666A001
E. Jean Jacob, L. S. Bartell, Electron Diffraction Study of Rhenium Fluorides. II. Structure, Pseudorotation, and Anharmonic Coupling of Modes in ReF7 Journal of Chemical Physics. ,vol. 53, pp. 2235- 2242 ,(1970) , 10.1063/1.1674318