Geometry & MOs

Info

ID:	10228
PubChem CID:	99132
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	284.152478
ΔH_f, kcal/mol:	-36.18
Dipole, Da:	5.45
IP(EA), eV:	-9.11(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(cyclooctylamino)quinoline-5,8-dione

Drug info:

PubChemData

Smile

C1CCCC(CCC1)NC2=CC(=O)C3=C(C2=O)C=CC=N3

DOS

IR

Vibrations