9-cyclopent-2-en-1-yl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride

Systemtic Name: 9-cyclopent-2-en-1-yl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Openeye Name: 9-cyclopent-2-en-1-yl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride CAS Name: 9-(1-cyclopent-2-enyl)-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride IUPAC Name: 9-cyclopent-2-en-1-yl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Traditional Name: 9-cyclopent-2-en-1-yl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Formula: C72H60Cl2Zr2-2 MolecularWeight: 1178.6008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.C1CC(C=C1)C2C3=CC=CC=C3C4=C2[C-]=CC=C4.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C18H15.2ClH.2Zr/c4*1-2-8-13(7-1)18-16-11-5-3-9-14(16)15-10-4-6-12-17(15)18;;;;/h4*1,3-7,9-11,13,18H,2,8H2;2*1H;;/q4*-1;;;2*+2/p-2