Geometry & MOs

Info

ID:	87228
PubChem CID:	49893385
Reduced:	BrNSCl2O4H14C19 (1)
Stoich.:	ABCD2E4F14G19 (1)
Weight, g/mol:	533.002212
ΔH_f, kcal/mol:	-121.59
Dipole, Da:	5.19
IP(EA), eV:	-9.12(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=C(C=C3)Cl)Cl)Br)O

DOS

IR

Vibrations