Geometry & MOs

Info

ID:	2742
PubChem CID:	8433
Reduced:	O2H12C15 (1)
Stoich.:	A2B12C15 (1)
Weight, g/mol:	224.08373
ΔH_f, kcal/mol:	-22.71
Dipole, Da:	0.64
IP(EA), eV:	-9.98(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-diphenylpropane-1,3-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2

DOS

IR

Vibrations