Geometry & MOs

Info

ID:	51829
PubChem CID:	12014581
Reduced:	O2H12C17 (1)
Stoich.:	A2B12C17 (1)
Weight, g/mol:	262.09938
ΔH_f, kcal/mol:	5.52
Dipole, Da:	5.84
IP(EA), eV:	-9.21(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methylphenyl)-3-phenylcyclopent-3-ene-1,2-dione

Drug info:

PubChemData

Smile

C1C(=C(C(=O)C1=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations