Geometry & MOs

Info

ID:	5109
PubChem CID:	12607
Reduced:	ClN2F3H4C8 (1)
Stoich.:	AB2C3D4E8 (1)
Weight, g/mol:	220.00151
ΔH_f, kcal/mol:	-115.05
Dipole, Da:	2.99
IP(EA), eV:	-9.71(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-(trifluoromethyl)-1H-benzimidazole

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1Cl)NC(=N2)C(F)(F)F

DOS

IR

Vibrations