Geometry & MOs

Info

ID:	386757
PubChem CID:	134982817
Reduced:	O2H10C13 (2)
Stoich.:	A2B10C13 (2)
Weight, g/mol:	449.141579
ΔH_f, kcal/mol:	-1.04
Dipole, Da:	1.69
IP(EA), eV:	-8.87(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9,13-diphenylphenanthro[9,10-f]isoindole-10,12-dione

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=CC=CC=C2C3=CC=CC=C(C3=C1C(=O)OC)C4=CC=CC=C4

DOS

IR

Vibrations