Geometry & MOs

Info

ID:	414050
PubChem CID:	135087003
Reduced:	O4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	338.042436
ΔH_f, kcal/mol:	-168.18
Dipole, Da:	2.74
IP(EA), eV:	-8.7(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfonylethanone

Drug info:

PubChemData

Smile

CCOC(=O)CC1CCCC(C1=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations