Geometry & MOs

Info

ID:	6537
PubChem CID:	68830
Reduced:	N2O3H8C13 (1)
Stoich.:	A2B3C8D13 (1)
Weight, g/mol:	240.053492
ΔH_f, kcal/mol:	-56.91
Dipole, Da:	7.63
IP(EA), eV:	-9.34(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-oxopyrido[2,1-b]quinazoline-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=NC3=C(C=C(C=C3)C(=O)O)C(=O)N2C=C1

DOS

IR

Vibrations