Geometry & MOs

Info

ID:	87261
PubChem CID:	49893490
Reduced:	SN3O6H23C27 (1)
Stoich.:	AB3C6D23E27 (1)
Weight, g/mol:	351.1293
ΔH_f, kcal/mol:	-141.52
Dipole, Da:	4.42
IP(EA), eV:	-9.0(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC(=O)NC3=CC=CC=C3)OCC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations