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Structure and bonding in 1-methylsilatrane and 1-fluorosilatrane

✍ Scribed by James E. Boggs; Chunyang Peng; Vadim A. Pestunovich; Valerij F. Sidorkin

Book ID
113258701
Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
587 KB
Volume
357
Category
Article
ISSN
0166-1280

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## Abstract The molecular geometry of 1‐fluorosilatrane was optimized fully by restricted Hartree–Fock (HF) calculations using the 3‐21G, 3‐21G(__d__) and 6‐31G(__d__) basis sets, with the aim of locating the positions of the local minima on the energy hypersurface. The optimized geometries were co