Dipole vector (in atomic units): -39.85 37.96 -27.59
Mass Moments vector: 418.16 308.93 278.09
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| No. of Chains=1 | Elongated | STRUCTURE OF BET V 1, NMR, 20 STRUCTURES | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 1515. | 159. | 196.53 | 18. | 23. | -5. | 296. | 945. | -0.0033 | 0.1952 |
| No.Dev.Units | -0.21 | -0.44 | -0.43 | -0.40 | -0.25 | -0.23 | -0.59 | -0.45 | -0.33 | -0.62 |
| Dipole vector (in atomic units): -39.85 37.96 -27.59 Mass Moments vector: 418.16 308.93 278.09
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