## Abstract Finite perturbation calculations using CNDO/2 wave functions are presented for the determination of ^31^P^13^C and ^31^P^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
Theoretical calculation of carbon-13 NMR shielding constants and their tensors in hydrocarbons by the finite perturbation method
✍ Scribed by Masahiro Kondo; Isao Ando; Riichirô Chǔjô; Atsuo Nishioka
- Publisher
- Elsevier Science
- Year
- 1976
- Weight
- 754 KB
- Volume
- 24
- Category
- Article
- ISSN
- 0022-2364
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