Geometry & MOs

Info

ID:	60324
PubChem CID:	26683802
Reduced:	ON3C24H26 (1)
Stoich.:	AB3C24D26 (1)
Weight, g/mol:	486.076469
ΔH_f, kcal/mol:	70.22
Dipole, Da:	4.96
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.130840
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-[(4-ethoxyphenyl)sulfamoyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide

Drug info:

PubChemData

Smile

C[C@@H](C[NH2+]CC1=CC=C(C=C1)OCC2=CN3C=CC=CC3=N2)C4=CC=CC=C4

DOS

IR

Vibrations