Geometry & MOs

Info

ID:	263777
PubChem CID:	103397230
Reduced:	FNO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	265.030584
ΔH_f, kcal/mol:	-71.14
Dipole, Da:	6.73
IP(EA), eV:	-8.3(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloropyridin-4-yl)-(2-fluoro-4-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=C1)C(=O)C2=C(C=C(C=C2)OC)F

DOS

IR

Vibrations