Geometry & MOs

Info

ID:	206377
PubChem CID:	80241306
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	274.059841
ΔH_f, kcal/mol:	-50.73
Dipole, Da:	5.05
IP(EA), eV:	-9.09(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-3-[(4-methylthiophen-3-yl)methyl]-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CC(C)CC1(CCCC1)CNC(=O)C2=CN=C(C=C2)N

DOS

IR

Vibrations