Geometry & MOs

Info

ID:	1605
PubChem CID:	4760
Reduced:	O2H10C15 (1)
Stoich.:	A2B10C15 (1)
Weight, g/mol:	222.06808
ΔH_f, kcal/mol:	-11.01
Dipole, Da:	2.85
IP(EA), eV:	-9.51(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenylindene-1,3-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations