Geometry & MOs

Info

ID:	158089
PubChem CID:	56462809
Reduced:	SN5O5C24H29 (1)
Stoich.:	AB5C5D24E29 (1)
Weight, g/mol:	422.122418
ΔH_f, kcal/mol:	-152.77
Dipole, Da:	5.98
IP(EA), eV:	-9.79(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]-3H-benzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)CN1C2=C(C(=CC(=N2)C3CC3)C(=O)N(C)C(C)C4=CC(=CC=C4)S(=O)(=O)N)C(=O)NC1=O

DOS

IR

Vibrations