Geometry & MOs

Info

ID:	273819
PubChem CID:	103805212
Reduced:	ClF2O2H11C15 (1)
Stoich.:	AB2C2D11E15 (1)
Weight, g/mol:	278.050986
ΔH_f, kcal/mol:	-131.05
Dipole, Da:	3.89
IP(EA), eV:	-9.45(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)CC2=CC(=C(C=C2)F)Cl)F

DOS

IR

Vibrations