Geometry & MOs

Info

ID:	435413
PubChem CID:	135191396
Reduced:	NC17H21 (1)
Stoich.:	AB17C21 (1)
Weight, g/mol:	238.062994
ΔH_f, kcal/mol:	78.43
Dipole, Da:	2.79
IP(EA), eV:	-8.2(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetyl-1H-cyclopenta[b]naphthalene-4,9-dione

Drug info:

PubChemData

Smile

CCN1C(=C(C(=C1/C=C\C=C)C=C)C)/C=C\C=C

DOS

IR

Vibrations