Geometry & MOs

Info

ID:	246186
PubChem CID:	103048092
Reduced:	FNOCl2H8C13 (1)
Stoich.:	ABCD2E8F13 (1)
Weight, g/mol:	296.041564
ΔH_f, kcal/mol:	-41.5
Dipole, Da:	2.13
IP(EA), eV:	-9.58(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloro-2-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CC(=O)C2=NC=C(C=C2)Cl)F

DOS

IR

Vibrations