Geometry & MOs

Info

ID:	263749
PubChem CID:	103395114
Reduced:	NF2O2C15H15 (1)
Stoich.:	AB2C2D15E15 (1)
Weight, g/mol:	310.023057
ΔH_f, kcal/mol:	-134.25
Dipole, Da:	2.6
IP(EA), eV:	-9.1(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenyl)sulfanyl-1-(2-fluoro-4-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

CCC(C1=C(C=C(C=C1)OC)F)(C2=NC=C(C=C2)F)O

DOS

IR

Vibrations