Geometry & MOs

Info

ID:	13895
PubChem CID:	399680
Reduced:	SN2O3C21H22 (1)
Stoich.:	AB2C3D21E22 (1)
Weight, g/mol:	382.135114
ΔH_f, kcal/mol:	-36.66
Dipole, Da:	1.08
IP(EA), eV:	-8.46(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3,4-dimethoxyphenyl)methylidene]-3-phenyl-2-propylimino-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCCN=C1N(C(=O)C(=CC2=CC(=C(C=C2)OC)OC)S1)C3=CC=CC=C3

DOS

IR

Vibrations