Geometry & MOs

Info

ID:	142595
PubChem CID:	53063888
Reduced:	N3O4C18H23 (1)
Stoich.:	A3B4C18D23 (1)
Weight, g/mol:	412.156912
ΔH_f, kcal/mol:	-135.28
Dipole, Da:	6.4
IP(EA), eV:	-9.43(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-3-(5-pyrrolidin-1-ylsulfonylbenzimidazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2CCN(C(=O)C2=O)CC(=O)N3CCOCC3

DOS

IR

Vibrations