Geometry & MOs

Info

ID:	273818
PubChem CID:	103805210
Reduced:	ClFOH12C15 (1)
Stoich.:	ABCD12E15 (1)
Weight, g/mol:	296.041564
ΔH_f, kcal/mol:	-56.68
Dipole, Da:	4.25
IP(EA), eV:	-9.54(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)CC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations