4-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 4-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 4-isopropyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 4-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 4-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 4-isopropyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C48H52Cl2Zr2-2 MolecularWeight: 882.28048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C1C=C[CH-]2.CC(C)C1=CC=CC2=C1C=C[CH-]2.CC(C)C1=CC=CC2=C1C=C[CH-]2.CC(C)C1=CC=CC2=C1C=C[CH-]2.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC(C)C1=CC=CC2=C1C=C[CH-]2.CC(C)C1=CC=CC2=C1C=C[CH-]2.CC(C)C1=CC=CC2=C1C=C[CH-]2.CC(C)C1=CC=CC2=C1C=C[CH-]2.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C12H13.2ClH.2Zr/c4*1-9(2)11-7-3-5-10-6-4-8-12(10)11;;;;/h4*3-9H,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2