Geometry & MOs

Info

ID:	123686
PubChem CID:	50858567
Reduced:	ON3C22H27 (1)
Stoich.:	AB3C22D27 (1)
Weight, g/mol:	464.213364
ΔH_f, kcal/mol:	-6.33
Dipole, Da:	2.19
IP(EA), eV:	-7.82(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-3-[2-(4-methylphenoxy)ethyl]-5-[(1,2,2,4,7-pentamethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C=C2)C=NC3=CC=C(C=C3)NC(=O)C)C)(C)C

DOS

IR

Vibrations