3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride

Systemtic Name: 3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride Openeye Name: 3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride CAS Name: 3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride IUPAC Name: 3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride Traditional Name: 3H-benz[e]inden-3-ide; zirconium(4+); dichloride Formula: C26H18Cl2Zr MolecularWeight: 492.55112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C13H9.2ClH.Zr/c2*1-2-6-12-10(4-1)8-9-11-5-3-7-13(11)12;;;/h2*1-9H;2*1H;/q2*-1;;;+4/p-2