Geometry & MOs

Info

ID:	123964
PubChem CID:	50868003
Reduced:	ClO2N3C25H26 (1)
Stoich.:	AB2C3D25E26 (1)
Weight, g/mol:	475.210721
ΔH_f, kcal/mol:	-18.26
Dipole, Da:	10.3
IP(EA), eV:	-8.31(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(1-ethyl-7-methoxy-2,2,4-trimethylquinolin-6-yl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)OC)/C=C(\C#N)/C(=O)NC3=CC(=CC=C3)Cl)C(=CC1(C)C)C

DOS

IR

Vibrations