Dipole moment for 6aa8: CRYSTAL STRUCTURE OF (S)-3-HYDROXYBUTYRYL-COENZYMEA DEH CLOSTRIDIUM ACETOBUTYLICUM COMPLEXED WITH NA

show separated chains No. of Chains=6Spherical CRYSTAL STRUCTURE OF (S)-3-HYDROXYBUTYRYL-COENZYMEA DEH CLOSTRIDIUM ACETOBUTYLICUM COMPLEX
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value12749.1679.1407.58211.234.-23. 264. 12347.-0.0018 0.0207
No.Dev.Units 9.35 9.75 7.61 11.12 10.44 -2.58 -0.67 2.96 -0.07 -1.23
Dipole vector (in atomic units): 42.71 -30.65 -16.11
Mass Moments vector: 2410.69 2475.26 2427.57
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