Geometry & MOs

Info

ID:	392301
PubChem CID:	135014308
Reduced:	NO2C18H19 (2)
Stoich.:	AB2C18D19 (2)
Weight, g/mol:	552.20893
ΔH_f, kcal/mol:	-113.78
Dipole, Da:	8.38
IP(EA), eV:	-9.15(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-hydroxy-2-phenylphenanthren-3-yl)-5-methyl-2-phenylphenanthren-4-ol

Drug info:

PubChemData

Smile

C1CC2=CC=C(CC(CC3=CC=C(CCC4=CC=C(CC(CC5=CC=C1C=C5)(C(=O)O)N)C=C4)C=C3)(C(=O)O)N)C=C2

DOS

IR

Vibrations