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The molecular orbital constrained electron diffraction (moced) structural model of quadricyclane determined by electron diffraction combined with ab initio calculations of potential and geometrical parameters

✍ Scribed by L. Doms; H.J. Geise; C. Van Alsenoy; L. Van Den Enden; L. Schäfer


Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
957 KB
Volume
129
Category
Article
ISSN
0022-2860

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The gas-phase molecular structures of bis(dichlorosily1)amine, (HSiCl,),NH, and bis(dichlorosilyl)methylamine, (SiHCl,),NMe, have been investigated by electron diffraction and ab initio calculations on a MP2/6-31G\* level. Because the latter suggest the presence of a mixture of two conformers for ea