Geometry & MOs

Info

ID:	87114
PubChem CID:	49892239
Reduced:	BrFNSO4H15C21 (1)
Stoich.:	ABCDE4F15G21 (1)
Weight, g/mol:	477.141008
ΔH_f, kcal/mol:	-73.33
Dipole, Da:	4.4
IP(EA), eV:	-8.9(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC=C3F)Br)OCC#C

DOS

IR

Vibrations