Geometry & MOs

Info

ID:	123916
PubChem CID:	50865455
Reduced:	FO2N3C22H24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	386.146427
ΔH_f, kcal/mol:	-56.19
Dipole, Da:	6.5
IP(EA), eV:	-8.22(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-3-but-3-en-2-yl-5-[(7-fluoro-1,2,2,4-tetramethylquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(N(C2=C1C=C(C(=C2)F)/C=N\NC(=O)C3=CC(=CC=C3)OC)C)(C)C

DOS

IR

Vibrations