Geometry & MOs

Info

ID:	183329
PubChem CID:	77008457
Reduced:	N3O3H13C14 (1)
Stoich.:	A3B3C13D14 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	-12.35
Dipole, Da:	2.94
IP(EA), eV:	-8.88(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-5-propyl-2-quinolin-4-yl-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

COC1=CC(=O)C(=C2NC(NO2)C3=CN=CC=C3)C=C1

DOS

IR

Vibrations