Geometry & MOs

Info

ID:	72342
PubChem CID:	48416067
Reduced:	N4O4C19H20 (1)
Stoich.:	A4B4C19D20 (1)
Weight, g/mol:	391.200825
ΔH_f, kcal/mol:	-17.75
Dipole, Da:	5.73
IP(EA), eV:	-8.86(-1.55)
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-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

DOS

IR

Vibrations