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Quantum-chemical calculation of spin-spin coupling constants1J(13CH) and3J(13CH) by the finite perturbations method as the NDDO approximation

✍ Scribed by V. N. Solkan; N. B. Leonidov


Book ID
112449910
Publisher
Springer
Year
1979
Tongue
English
Weight
214 KB
Volume
28
Category
Article
ISSN
1573-9171

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## Abstract ^13^C chemical shifts and ^13^CH coupling constants for classical and non‐classical structures of some typical carbonium ions have been calculated by the method of summation over excited states in the INDO approximation using a special parameterization. Comparison of the data obtained w