Geometry & MOs

Info

ID:	182516
PubChem CID:	76899184
Reduced:	OSN2H10C14 (1)
Stoich.:	ABC2D10E14 (1)
Weight, g/mol:	336.92307
ΔH_f, kcal/mol:	41.32
Dipole, Da:	2.76
IP(EA), eV:	-8.56(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(5-bromothiophen-2-yl)-3H-1,3-thiazol-2-ylidene]cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

C1=CC(=C2NC(=CS2)C3=CC=NC=C3)C(=O)C=C1

DOS

IR

Vibrations