Geometry & MOs

Info

ID:	6235
PubChem CID:	67578
Reduced:	ClOF3H4C8 (1)
Stoich.:	ABC3D4E8 (1)
Weight, g/mol:	207.990277
ΔH_f, kcal/mol:	-171.16
Dipole, Da:	2.71
IP(EA), eV:	-10.31(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-2,2,2-trifluoroethanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)C(F)(F)F)Cl

DOS

IR

Vibrations