Geometry & MOs

Info

ID:	217367
PubChem CID:	85087704
Reduced:	NO3H19C23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	367.247107
ΔH_f, kcal/mol:	-23.0
Dipole, Da:	3.69
IP(EA), eV:	-9.04(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-hexyl-8,9-dimethoxy-1,4a,5,5a,6,7,8,9,9a,10a-decahydropyrimido[4,5-b]quinoline-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)C(=CC1=CC2=C(C=C1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC

DOS

IR

Vibrations