Geometry & MOs

Info

ID:	24332
PubChem CID:	609356
Reduced:	OH12C17 (1)
Stoich.:	AB12C17 (1)
Weight, g/mol:	232.088815
ΔH_f, kcal/mol:	46.58
Dipole, Da:	3.6
IP(EA), eV:	-9.27(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-phenylbenzo[7]annulen-7-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=CC=CC=C3C=CC2=O

DOS

IR

Vibrations