Geometry & MOs

Info

ID:	392058
PubChem CID:	135012447
Reduced:	NO4C6H9 (1)
Stoich.:	AB4C6D9 (1)
Weight, g/mol:	314.094294
ΔH_f, kcal/mol:	-91.06
Dipole, Da:	5.1
IP(EA), eV:	-11.29(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxynaphthalen-1-yl)naphthalene-1,4-dione

Drug info:

PubChemData

Smile

COC(=O)CC/C=C/[N+](=O)[O-]

DOS

IR

Vibrations