Geometry & MOs

Info

ID:	123698
PubChem CID:	50859498
Reduced:	FN5C26H26 (1)
Stoich.:	AB5C26D26 (1)
Weight, g/mol:	334.115127
ΔH_f, kcal/mol:	57.47
Dipole, Da:	10.1
IP(EA), eV:	-8.43(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(7-fluoro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)F)/C=C/3\C(=C(C4=C3C(=C(C(=N4)N)C#N)C)C#N)C)C)(C)C

DOS

IR

Vibrations