Geometry & MOs

Info

ID:	80735
PubChem CID:	49836564
Reduced:	ClOSC6H9 (1)
Stoich.:	ABCD6E9 (1)
Weight, g/mol:	381.108897
ΔH_f, kcal/mol:	-45.89
Dipole, Da:	1.86
IP(EA), eV:	-9.41(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)phenyl]-2-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CCSC(=O)/C=C/CCl

DOS

IR

Vibrations