Conformational analysis of 1,2-dimethoxyethane by ab initio molecular orbital and molecular mechanics calculations: stabilization of the TGG' rotamer by the 1,5 CH3/O nonbonding attractive interaction

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Published in:Journal of physical chemistry (1952) 1993-02, Vol.97 (7), p.1346-1350
Main Authors: Tsuzuki, Seiji, Uchimaru, Tadafumi, Tanabe, Kazutoshi, Hirano, Tsuneo
Format: Article
Language:English
Subjects:
Atomic and molecular physics
Electron correlation calculations for atoms and molecules
Electronic structure of atoms, molecules and their ions: theory
Exact sciences and technology
Physics
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container_end_page 1350
container_issue 7
container_start_page 1346
container_title Journal of physical chemistry (1952)
container_volume 97
creator Tsuzuki, Seiji
Uchimaru, Tadafumi
Tanabe, Kazutoshi
Hirano, Tsuneo
description
doi_str_mv 10.1021/j100109a016
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ispartof Journal of physical chemistry (1952), 1993-02, Vol.97 (7), p.1346-1350
issn 0022-3654
1541-5740
language eng
recordid cdi_crossref_primary_10_1021_j100109a016
source ACS CRKN Legacy Archives
subjects Atomic and molecular physics
Electron correlation calculations for atoms and molecules
Electronic structure of atoms, molecules and their ions: theory
Exact sciences and technology
Physics
title Conformational analysis of 1,2-dimethoxyethane by ab initio molecular orbital and molecular mechanics calculations: stabilization of the TGG' rotamer by the 1,5 CH3/O nonbonding attractive interaction
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