Geometry & MOs

Info

ID:	20127
PubChem CID:	579829
Reduced:	ON2S3H8C9 (1)
Stoich.:	AB2C3D8E9 (1)
Weight, g/mol:	255.979876
ΔH_f, kcal/mol:	45.16
Dipole, Da:	1.18
IP(EA), eV:	-8.97(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-methylthiophen-2-yl)methylideneamino]-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C=NN2C(=O)CSC2=S

DOS

IR

Vibrations