Geometry & MOs

Info

ID:	124104
PubChem CID:	50872759
Reduced:	FNBr2O2S2H16C24 (1)
Stoich.:	ABC2D2E2F16G24 (1)
Weight, g/mol:	524.934075
ΔH_f, kcal/mol:	-3.45
Dipole, Da:	1.89
IP(EA), eV:	-9.12(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-3-(3,4-dichlorophenyl)-5-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC(=C(C(=C3)Br)OCC4=CC=C(C=C4)F)Br)/SC2=S

DOS

IR

Vibrations