Geometry & MOs

Info

ID:	11323
PubChem CID:	114001
Reduced:	N2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-27.46
Dipole, Da:	5.32
IP(EA), eV:	-9.14(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCNC1=CC(=O)C2=C(C1=O)C=CC=N2

DOS

IR

Vibrations