Geometry & MOs

Info

ID:	283201
PubChem CID:	103963944
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-27.8
Dipole, Da:	7.36
IP(EA), eV:	-9.35(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-nitro-N-pentan-2-ylquinolin-4-amine

Drug info:

PubChemData

Smile

C1CC(CCC1NC2=C(C=NC3=CC=CC=C32)[N+](=O)[O-])O

DOS

IR

Vibrations