Geometry & MOs

Info

ID:	171051
PubChem CID:	75317836
Reduced:	BrFNSCl2O4H19C26 (1)
Stoich.:	ABCDE2F4G19H26 (1)
Weight, g/mol:	559.02645
ΔH_f, kcal/mol:	-132.09
Dipole, Da:	2.17
IP(EA), eV:	-9.21(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3F)Br)OCC4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations