Geometry & MOs

Info

ID:	88431
PubChem CID:	49903501
Reduced:	FNSBr2O2H10C17 (1)
Stoich.:	ABCD2E2F10G17 (1)
Weight, g/mol:	440.89927
ΔH_f, kcal/mol:	-59.18
Dipole, Da:	2.08
IP(EA), eV:	-9.62(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations