Geometry & MOs

Info

ID:	88053
PubChem CID:	49900238
Reduced:	BrNSCl2O3H8C15 (1)
Stoich.:	ABCD2E3F8G15 (1)
Weight, g/mol:	380.979333
ΔH_f, kcal/mol:	-58.55
Dipole, Da:	2.54
IP(EA), eV:	-9.21(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2,6-dichlorophenyl)methyl]-5-[(3-fluorophenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CN2C(=O)/C(=C/C3=CC=C(O3)Br)/SC2=O)Cl

DOS

IR

Vibrations