Geometry & MOs

Info

ID:	7167
PubChem CID:	71448
Reduced:	NO3H8C9 (2)
Stoich.:	AB3C8D9 (2)
Weight, g/mol:	356.100836
ΔH_f, kcal/mol:	-183.07
Dipole, Da:	4.31
IP(EA), eV:	-9.29(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(methylamino)-4-oxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylic acid

Drug info:

PubChemData

Smile

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)O)C(=CC(=N2)C(=O)O)NC

DOS

IR

Vibrations