Geometry & MOs

Info

ID:	133342
PubChem CID:	51510864
Reduced:	SO2N5C19H33 (1)
Stoich.:	AB2C5D19E33 (1)
Weight, g/mol:	378.169191
ΔH_f, kcal/mol:	21.62
Dipole, Da:	36.68
IP(EA), eV:	-3.57(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2CN3CCN(CC3)C4=CC=CC=[NH+]4

DOS

IR

Vibrations