Geometry & MOs

Info

ID:	88172
PubChem CID:	49902154
Reduced:	SN2O5H14C18 (1)
Stoich.:	AB2C5D14E18 (1)
Weight, g/mol:	407.973833
ΔH_f, kcal/mol:	-46.4
Dipole, Da:	6.6
IP(EA), eV:	-9.12(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C/C(=C\C1=CC=CO1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations