Geometry & MOs

Info

ID:	171208
PubChem CID:	75344054
Reduced:	SCl2N2O4H28C29 (1)
Stoich.:	AB2C2D4E28F29 (1)
Weight, g/mol:	384.077993
ΔH_f, kcal/mol:	-109.23
Dipole, Da:	10.12
IP(EA), eV:	-8.39(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-methyl-3-nitrophenyl)methylidene]-3-(2-phenoxyethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)N(C(=O)S2)CCOC3=CC=CC=C3)OCC4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations