3H-cyclopenta[a]naphthalen-3-ide; cyclopenta-1,3-diene; propan-2-ylidenezirconium(2+); dichloride

Systemtic Name: 3H-cyclopenta[a]naphthalen-3-ide; cyclopenta-1,3-diene; propan-2-ylidenezirconium(2+); dichloride Openeye Name: 3H-cyclopenta[a]naphthalen-3-ide; cyclopenta-1,3-diene; isopropylidenezirconium(2+); dichloride CAS Name: 3H-cyclopenta[a]naphthalen-3-ide; cyclopenta-1,3-diene; propan-2-ylidenezirconium(2+); dichloride IUPAC Name: 3H-cyclopenta[a]naphthalen-3-ide; cyclopenta-1,3-diene; propan-2-ylidenezirconium(2+); dichloride Traditional Name: 3H-benz[e]inden-3-ide; cyclopenta-1,3-diene; isopropylidenezirconium(2+); dichloride Formula: C21H20Cl2Zr-2 MolecularWeight: 434.5135

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[Zr+2])C.C1C=CC=[C-]1.[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[Cl-].[Cl-]

Isomeric SMILES

CC(=[Zr+2])C.C1C=CC=[C-]1.[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[Cl-].[Cl-]

InChI

InChI=1S/C13H9.C5H5.C3H6.2ClH.Zr/c1-2-6-12-10(4-1)8-9-11-5-3-7-13(11)12;1-2-4-5-3-1;1-3-2;;;/h1-9H;1-3H,4H2;1-2H3;2*1H;/q2*-1;;;;+2/p-2