2-hexan-3-ylcyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 2-hexan-3-ylcyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 2-(1-ethylbutyl)cyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 2-hexan-3-ylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 2-hexan-3-ylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 2-(1-ethylbutyl)cyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C44H68Cl2Zr2-2 MolecularWeight: 850.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)C1=[C-]CC=C1.CCCC(CC)C1=[C-]CC=C1.CCCC(CC)C1=[C-]CC=C1.CCCC(CC)C1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCC(CC)C1=[C-]CC=C1.CCCC(CC)C1=[C-]CC=C1.CCCC(CC)C1=[C-]CC=C1.CCCC(CC)C1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C11H17.2ClH.2Zr/c4*1-3-7-10(4-2)11-8-5-6-9-11;;;;/h4*5,8,10H,3-4,6-7H2,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2