Geometry & MOs

Info

ID:	8192
PubChem CID:	75257
Reduced:	ClOF3H4C8 (1)
Stoich.:	ABC3D4E8 (1)
Weight, g/mol:	207.990277
ΔH_f, kcal/mol:	-182.48
Dipole, Da:	3.7
IP(EA), eV:	-11.07(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(trifluoromethyl)benzoyl chloride

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(F)(F)F)C(=O)Cl

DOS

IR

Vibrations