Geometry & MOs

Info

ID:	62376
PubChem CID:	26719650
Reduced:	Cl2O4N5C22H29 (1)
Stoich.:	A2B4C5D22E29 (1)
Weight, g/mol:	454.063317
ΔH_f, kcal/mol:	-191.89
Dipole, Da:	10.87
IP(EA), eV:	-9.07(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dichlorophenyl)-3-(1-propyl-5-sulfamoylbenzimidazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)CCC(=O)NC2=CC(=C(C=C2)Cl)Cl)N

DOS

IR

Vibrations