Geometry & MOs

Info

ID:	86936
PubChem CID:	49890042
Reduced:	BrClFNSO4H14C24 (1)
Stoich.:	ABCDEF4G14H24 (1)
Weight, g/mol:	458.013949
ΔH_f, kcal/mol:	-123.23
Dipole, Da:	1.12
IP(EA), eV:	-9.54(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene]-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C(=O)/C(=C/C3=C(C=CC(=C3)Br)OC(=O)C4=CC=C(C=C4)Cl)/SC2=O)F

DOS

IR

Vibrations