Geometry & MOs

Info

ID:	245539
PubChem CID:	99453767
Reduced:	SO2N4H24C28 (1)
Stoich.:	AB2C4D24E28 (1)
Weight, g/mol:	418.167477
ΔH_f, kcal/mol:	49.03
Dipole, Da:	2.77
IP(EA), eV:	-8.58(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-(furan-2-yl)propan-2-yl]-3-(1-propyl-5-sulfamoylbenzimidazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)/C=C\C(=O)NC3=CC=CC=C3N4CCC5=CC=CC=C54

DOS

IR

Vibrations