Geometry & MOs

Info

ID:	123668
PubChem CID:	50858408
Reduced:	ClON3C24H26 (1)
Stoich.:	ABC3D24E26 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	5.23
Dipole, Da:	8.94
IP(EA), eV:	-8.27(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1,2,2,4,7-pentamethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)C)/C=C(\C#N)/C(=O)NC3=CC(=CC=C3)Cl)C)(C)C

DOS

IR

Vibrations