Geometry & MOs

Info

ID:	23731
PubChem CID:	605680
Reduced:	ClOH3F4C8 (1)
Stoich.:	ABC3D4E8 (1)
Weight, g/mol:	225.980855
ΔH_f, kcal/mol:	-224.76
Dipole, Da:	4.18
IP(EA), eV:	-10.97(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-(trifluoromethyl)benzoyl chloride

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)C(F)(F)F)C(=O)Cl

DOS

IR

Vibrations