Geometry & MOs

Info

ID:	46204
PubChem CID:	10523129
Reduced:	O2S2N3H15C18 (1)
Stoich.:	A2B2C3D15E18 (1)
Weight, g/mol:	370.00007
ΔH_f, kcal/mol:	-7.47
Dipole, Da:	9.58
IP(EA), eV:	-8.68(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-2-(5-methylthiophen-2-yl)benzimidazol-3-ium;iodide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC3=C(C=C(C=C3)C)C(=O)S2

DOS

IR

Vibrations