Geometry & MOs

Info

ID:	87514
PubChem CID:	49895160
Reduced:	SN2O2H20C22 (1)
Stoich.:	AB2C2D20E22 (1)
Weight, g/mol:	449.085242
ΔH_f, kcal/mol:	-25.83
Dipole, Da:	5.7
IP(EA), eV:	-8.62(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]-3-[(3-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCC1=C2C(=CC=C1)C(=CN2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC(=C4)C

DOS

IR

Vibrations