Geometry & MOs

Info

ID:	142181
PubChem CID:	52997649
Reduced:	INOC22H34 (1)
Stoich.:	ABCD22E34 (1)
Weight, g/mol:	359.06332
ΔH_f, kcal/mol:	-1.07
Dipole, Da:	11.87
IP(EA), eV:	-7.32(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-imino-3-methylbenzimidazol-1-yl)-1-(4-methylphenyl)ethanone;hydrobromide

Drug info:

PubChemData

Smile

CCC(C)(CC)C(C#CC[N+]1(CCCCC1)C)(C2=CC=CC=C2)O.[I-]

DOS

IR

Vibrations