Geometry & MOs

Info

ID:	237717
PubChem CID:	92721053
Reduced:	SN3O3C11H13 (1)
Stoich.:	AB3C3D11E13 (1)
Weight, g/mol:	333.184112
ΔH_f, kcal/mol:	-72.51
Dipole, Da:	5.0
IP(EA), eV:	-8.93(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-[1-(2-phenylethyl)benzimidazol-2-yl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(O1)[C@@H]2N(N=C(S2)NC(=O)C)C(=O)C

DOS

IR

Vibrations