Geometry & MOs

Info

ID:	123838
PubChem CID:	50862933
Reduced:	ClON3C27H30 (1)
Stoich.:	ABC3D27E30 (1)
Weight, g/mol:	473.267842
ΔH_f, kcal/mol:	9.22
Dipole, Da:	6.94
IP(EA), eV:	-8.18(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-1-(2-ethylphenyl)-5-[(2,2,4,7-tetramethyl-1-propyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C(=C2)Cl)/C=N\NC(=O)C3=CC4=CC=CC=C4C=C3)C(CC1(C)C)C

DOS

IR

Vibrations