Geometry & MOs

Info

ID:	87193
PubChem CID:	49892980
Reduced:	BrFNSCl2O2H9C17 (1)
Stoich.:	ABCDE2F2G9H17 (1)
Weight, g/mol:	564.93171
ΔH_f, kcal/mol:	-77.63
Dipole, Da:	3.31
IP(EA), eV:	-9.7(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-3-[(2,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)CN2C(=O)/C(=C/C3=C(C=CC(=C3)Br)F)/SC2=O

DOS

IR

Vibrations