Geometry & MOs

Info

ID:	8375
PubChem CID:	76927
Reduced:	H2N2Cl3F3C8 (1)
Stoich.:	A2B2C3D3E8 (1)
Weight, g/mol:	287.923566
ΔH_f, kcal/mol:	-125.43
Dipole, Da:	2.92
IP(EA), eV:	-9.6(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6,7-trichloro-2-(trifluoromethyl)-1H-benzimidazole

Drug info:

PubChemData

Smile

C1=C(C2=C(C(=C1Cl)Cl)NC(=N2)C(F)(F)F)Cl

DOS

IR

Vibrations