Geometry & MOs

Info

ID:	156664
PubChem CID:	56371598
Reduced:	O3N4C28H32 (1)
Stoich.:	A3B4C28D32 (1)
Weight, g/mol:	477.27399
ΔH_f, kcal/mol:	-89.8
Dipole, Da:	0.83
IP(EA), eV:	-8.02(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2-oxo-3-propylbenzimidazol-1-yl)propanoylamino]-N-(3-pyrrolidin-1-ylphenyl)butanamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=CC(=CC=C1)N2CCCC2)NC(=O)CCNC(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations