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Structure of (Me2Cu)Li • 3DME and its oligomers [(Me2Cu)Li • 3DME]n (n = 2-5): a theoretical study

Dem’yanov, P. I. and Polestshuk, P. M. and Petrosyan, V. S. and Gschwind, R. M. (2008) Structure of (Me2Cu)Li • 3DME and its oligomers [(Me2Cu)Li • 3DME]n (n = 2-5): a theoretical study. Russian Chemical Bulletin 57 (3), pp. 480-492.

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Abstract

The structures of monomeric lithium dimethylcuprate solvated by three 1,2-dimethoxyethane (DME) molecules (Me2Cu)Li · 3DME and its oligomers [(Me2Cu)Li · 3DME] n (n = 2–5) in the gas phase were studied using the density functional theory. The structures of these systems are compared with that of (Me2Cu)Li · 3DME in the crystal. It is shown that numerous C-H…Cu and C-H…C hydrogen bonds, as well ...

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Item Type:Article
Date:2008
Institutions:Chemistry and Pharmacy > Institut für Organische Chemie > Arbeitskreis Prof. Dr. Ruth Gschwind
Identification Number:
ValueType
10.1007/s11172-008-0075-yDOI
Subjects:500 Science > 540 Chemistry & allied sciences
Status:Published
Refereed:Yes, this version has been refereed
Created at the University of Regensburg:Partially
Owner: Nikola Kastner-Pustet
Deposited On:10 Nov 2009 17:16
Last Modified:10 Nov 2009 17:16
Item ID:10625
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