Theoretical calculations of nuclear spin
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Thomas A. Albright
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Article
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1976
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John Wiley and Sons
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English
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## Abstract Finite perturbation calculations using CNDO/2 wave functions are presented for the determination of ^31^P๏ฃฟ^13^C and ^31^P๏ฃฟ^1^H couplings. The calculations were carried out on 46 molecules and a comparison with experimental values is given. The groups of compounds considered were phospho