2-butylcyclopenta-1,3-diene; 1-methyl-3-propyl-cyclopenta-1,3-diene; zirconium; zirconium(2+); dichloride

Systemtic Name: 2-butylcyclopenta-1,3-diene; 1-methyl-3-propyl-cyclopenta-1,3-diene; zirconium; zirconium(2+); dichloride Openeye Name: 2-butylcyclopenta-1,3-diene; 1-methyl-3-propyl-cyclopenta-1,3-diene; zirconium; zirconium(2+); dichloride CAS Name: 2-butylcyclopenta-1,3-diene; 1-methyl-3-propylcyclopenta-1,3-diene; zirconium; zirconium(2+); dichloride IUPAC Name: 2-butylcyclopenta-1,3-diene; 1-methyl-3-propylcyclopenta-1,3-diene; zirconium; zirconium(2+); dichloride Traditional Name: 2-butylcyclopenta-1,3-diene; 1-methyl-3-propyl-cyclopenta-1,3-diene; zirconium; zirconium(2+); dichloride Formula: C36H54Cl2Zr2-2 MolecularWeight: 740.16796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CCCC1=CCC(=C1)C.CCCC1=CCC(=C1)C.[Cl-].[Cl-].[Zr].[Zr+2]

Isomeric SMILES

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CCCC1=CCC(=C1)C.CCCC1=CCC(=C1)C.[Cl-].[Cl-].[Zr].[Zr+2]

InChI

InChI=1S/2C9H14.2C9H13.2ClH.2Zr/c2*1-3-4-9-6-5-8(2)7-9;2*1-2-3-6-9-7-4-5-8-9;;;;/h2*6-7H,3-5H2,1-2H3;2*4,7H,2-3,5-6H2,1H3;2*1H;;/q;;2*-1;;;;+2/p-2