Geometry & MOs

Info

ID:	26644
PubChem CID:	794419
Reduced:	SN2O2C13H20 (1)
Stoich.:	AB2C2D13E20 (1)
Weight, g/mol:	286.077599
ΔH_f, kcal/mol:	-67.06
Dipole, Da:	8.26
IP(EA), eV:	-8.71(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethylphenyl)sulfonylbenzimidazole

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C

DOS

IR

Vibrations