Geometry & MOs

Info

ID:	172871
PubChem CID:	75562682
Reduced:	OSCl2N3C24H25 (1)
Stoich.:	ABC2D3E24F25 (1)
Weight, g/mol:	481.176834
ΔH_f, kcal/mol:	2.51
Dipole, Da:	5.59
IP(EA), eV:	-8.1(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-5-[(1-ethyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)Cl)C=C3C(=O)N=C(S3)NC4=CC(=CC=C4)Cl)C(CC1(C)C)C

DOS

IR

Vibrations