Geometry & MOs

Info

ID:	123903
PubChem CID:	50864942
Reduced:	ClON3H24C25 (1)
Stoich.:	ABC3D24E25 (1)
Weight, g/mol:	463.166269
ΔH_f, kcal/mol:	38.2
Dipole, Da:	5.39
IP(EA), eV:	-8.18(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(7-chloro-1,2,2,4-tetramethylquinolin-6-yl)methylidene]-1-(2,3-dimethylphenyl)-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CC1=CC(N(C2=C1C=C(C(=C2)Cl)/C=N\NC(=O)C3=CC4=CC=CC=C4C=C3)C)(C)C

DOS

IR

Vibrations