Geometry & MOs

Info

ID:	273823
PubChem CID:	103805235
Reduced:	ClFOH14C16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	314.032142
ΔH_f, kcal/mol:	-64.77
Dipole, Da:	4.12
IP(EA), eV:	-9.51(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-fluorophenyl)-1-[2-(difluoromethoxy)phenyl]ethanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations