Geometry & MOs

Info

ID:	29729
PubChem CID:	836758
Reduced:	NSO3C7H9 (1)
Stoich.:	ABC3D7E9 (1)
Weight, g/mol:	223.123523
ΔH_f, kcal/mol:	-108.81
Dipole, Da:	4.19
IP(EA), eV:	-8.96(0.02)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1,2-dimethyl-3-phenylbenzimidazol-1-ium

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC(=CC=C1)O

DOS

IR

Vibrations