cyclopenta-1,3-diene; 1-prop-2-enyl-1,2-dihydroinden-2-ide; zirconium(4+); dichloride

Systemtic Name: cyclopenta-1,3-diene; 1-prop-2-enyl-1,2-dihydroinden-2-ide; zirconium(4+); dichloride Openeye Name: 1-allyl-1,2-dihydroinden-2-ide; cyclopenta-1,3-diene; zirconium(4+); dichloride CAS Name: cyclopenta-1,3-diene; 1-prop-2-enyl-1,2-dihydroinden-2-ide; zirconium(4+); dichloride IUPAC Name: cyclopenta-1,3-diene; 1-prop-2-enyl-1,2-dihydroinden-2-ide; zirconium(4+); dichloride Traditional Name: 1-allyl-1,2-dihydroinden-2-ide; cyclopenta-1,3-diene; zirconium(4+); dichloride Formula: C17H16Cl2Zr MolecularWeight: 382.43894

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1[C-]=CC2=CC=CC=C12.C1C=CC=[C-]1.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C=CCC1[C-]=CC2=CC=CC=C12.C1C=CC=[C-]1.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C12H11.C5H5.2ClH.Zr/c1-2-5-10-8-9-11-6-3-4-7-12(10)11;1-2-4-5-3-1;;;/h2-4,6-7,9-10H,1,5H2;1-3H,4H2;2*1H;/q2*-1;;;+4/p-2