Geometry & MOs

Info

ID:	205206
PubChem CID:	80068046
Reduced:	SN2O2C14H18 (1)
Stoich.:	AB2C2D14E18 (1)
Weight, g/mol:	249.129969
ΔH_f, kcal/mol:	-66.62
Dipole, Da:	4.28
IP(EA), eV:	-8.28(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(dimethylamino)propyl]-5-methyl-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=S)N2C(C(C)C)C(=O)OC

DOS

IR

Vibrations