Geometry & MOs

Info

ID:	72227
PubChem CID:	48415946
Reduced:	O3N4C20H24 (1)
Stoich.:	A3B4C20D24 (1)
Weight, g/mol:	404.221226
ΔH_f, kcal/mol:	-85.15
Dipole, Da:	5.94
IP(EA), eV:	-9.04(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)OC)C)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations