The equilibrium geometry of linear CXO has been calculated with high precision ( ~0.0005 8, accuracy) by combining experimental ground-state rotational constants and theoretical vibration-rotation coupling constants. The results are R,,( C,-C,) = 1.27 I7 A, R2e(C2-C3) = 1.2965 A and R,,(C3-0) = 1.14
β¦ LIBER β¦
Molecular PO2Cl: matrix IR investigations and ab initio SCF calculations
β Scribed by Ahlrichs, R.; Ehrhardt, C.; Lakenbrink, M.; Schunck, S.; Schnoeckel, H.
- Book ID
- 120078683
- Publisher
- American Chemical Society
- Year
- 1986
- Tongue
- English
- Weight
- 915 KB
- Volume
- 108
- Category
- Article
- ISSN
- 0002-7863
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