Geometry & MOs

Info

ID:	62741
PubChem CID:	26736539
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	456.183127
ΔH_f, kcal/mol:	-133.02
Dipole, Da:	4.64
IP(EA), eV:	-8.82(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethylphenyl)-3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations