Geometry & MOs

Info

ID:	203259
PubChem CID:	79803104
Reduced:	ClFOSH10C13 (1)
Stoich.:	ABCDE10F13 (1)
Weight, g/mol:	222.017307
ΔH_f, kcal/mol:	-49.28
Dipole, Da:	3.47
IP(EA), eV:	-9.08(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylthiophen-3-yl)-2-thiophen-2-ylethanone

Drug info:

PubChemData

Smile

CC1=CSC=C1C(=O)CC2=C(C=CC=C2Cl)F

DOS

IR

Vibrations