Geometry & MOs

Info

ID:	4663
PubChem CID:	11829
Reduced:	N2O2H6C9 (1)
Stoich.:	A2B2C6D9 (1)
Weight, g/mol:	174.042927
ΔH_f, kcal/mol:	47.75
Dipole, Da:	3.04
IP(EA), eV:	-10.18(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nitroquinoline

Drug info:

PubChemData

Smile

C1=CC2=C(C=CC=N2)C(=C1)[N+](=O)[O-]

DOS

IR

Vibrations