Dipole moment for 2dfp: X-RAY STRUCTURE OF AGED DI-ISOPROPYL-PHOSPHORO-FLUORIDA TO ACETYLCHOLINESTERASE

No. of Chains=1Spherical X-RAY STRUCTURE OF AGED DI-ISOPROPYL-PHOSPHORO-FLUORIDA TO ACETYLCHOLINESTERASE
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 4257. 533. 494.19 49. 58.-10. 1703. 1472.-0.0023 0.4000
No.Dev.Units 2.12 2.06 1.54 1.45 1.52 -0.88 2.78 -0.30 -0.17 0.11
Dipole vector (in atomic units): 10.71 3.88 -354.38
Mass Moments vector: 909.72 829.15 826.38
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