Dipole vector (in atomic units): 2.31 -3.14 -39.74
Mass Moments vector: 84.09 131.64 310.15
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| show separated chains | No. of Chains=2 | Elongated | PLI E20C IS ANTIPARALLEL | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 520. | 66. | 115.75 | 15. | 12. | 2. | 192. | 373. | 0.0038 | 0.3688 |
| No.Dev.Units | -1.06 | -1.07 | -0.97 | -0.58 | -0.81 | 0.69 | -0.84 | -0.62 | 0.92 | -0.00 |
| Dipole vector (in atomic units): 2.31 -3.14 -39.74 Mass Moments vector: 84.09 131.64 310.15
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