Geometry & MOs

Info

ID:	24039
PubChem CID:	607512
Reduced:	NO2H7C12 (1)
Stoich.:	AB2C7D12 (1)
Weight, g/mol:	197.047678
ΔH_f, kcal/mol:	-12.09
Dipole, Da:	4.61
IP(EA), eV:	-9.31(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrano[2,3-f]isoquinolin-2-one

Drug info:

PubChemData

Smile

C1=CC2=C(C=CN=C2)C3=C1C=CC(=O)O3

DOS

IR

Vibrations