Geometry & MOs

Info

ID:	71826
PubChem CID:	48415511
Reduced:	N3O3C22H25 (1)
Stoich.:	A3B3C22D25 (1)
Weight, g/mol:	402.136176
ΔH_f, kcal/mol:	-36.82
Dipole, Da:	5.74
IP(EA), eV:	-8.69(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-methoxy-N-methyl-5-sulfamoylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)OCC=C)OC

DOS

IR

Vibrations