Geometry & MOs

Info

ID:	25691
PubChem CID:	629192
Reduced:	N2O6H12C19 (1)
Stoich.:	A2B6C12D19 (1)
Weight, g/mol:	320.125988
ΔH_f, kcal/mol:	-61.85
Dipole, Da:	4.23
IP(EA), eV:	-10.62(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1,3,6,8-tetramethoxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C#N)C1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations