Geometry & MOs

Info

ID:	433
PubChem CID:	2762
Reduced:	N2O5H10C12 (1)
Stoich.:	A2B5C10D12 (1)
Weight, g/mol:	262.058971
ΔH_f, kcal/mol:	-132.17
Dipole, Da:	10.57
IP(EA), eV:	-9.39(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)O)OCO3

DOS

IR

Vibrations