Geometry & MOs

Info

ID:	203258
PubChem CID:	79803103
Reduced:	OSH14C17 (1)
Stoich.:	ABC14D17 (1)
Weight, g/mol:	268.012492
ΔH_f, kcal/mol:	24.28
Dipole, Da:	2.43
IP(EA), eV:	-8.78(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-6-fluorophenyl)-1-(4-methylthiophen-3-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CSC=C1C(=O)CC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations