Geometry & MOs

Info

ID:	191206
PubChem CID:	78117386
Reduced:	NO2C17H23 (1)
Stoich.:	AB2C17D23 (1)
Weight, g/mol:	392.27153
ΔH_f, kcal/mol:	2.39
Dipole, Da:	2.27
IP(EA), eV:	-9.31(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-heptadeca-8,11-dienylnaphthalene-1,4-dione

Drug info:

PubChemData

Smile

CC(CCOCC1=CC=CC=C1)(C=C)C2CC2C=NO

DOS

IR

Vibrations