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A quantum-chemical analysis of the influence of outer-sphere replacements on the magnetic shielding of the fluorine nuclei in M2GeF6

โœ Scribed by V. I. Sergienko; L. N. Ignat'eva

Publisher
SP MAIK Nauka/Interperiodica
Year
1984
Tongue
English
Weight
162 KB
Volume
25
Category
Article
ISSN
0022-4766

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The chemical shift anisotropy and the isotropic magnetic shielding constant of the hydrogen nuclei in the (H,O),. (H20)3, (H,O), and H,O systems have been calculated using ab initio quantum-mechanical techniques. The results show that secondary hydrogen bonding has a significant effect on these two