2-butylcyclopenta-1,3-diene; 2,3-dimethylcyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 2-butylcyclopenta-1,3-diene; 2,3-dimethylcyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 2-butylcyclopenta-1,3-diene; 2,3-dimethylcyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 2-butylcyclopenta-1,3-diene; 2,3-dimethylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 2-butylcyclopenta-1,3-diene; 2,3-dimethylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 2-butylcyclopenta-1,3-diene; 2,3-dimethylcyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C32H44Cl2Zr2-2 MolecularWeight: 682.04576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CC1=CC[C-]=C1C.CC1=CC[C-]=C1C.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CC1=CC[C-]=C1C.CC1=CC[C-]=C1C.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C9H13.2C7H9.2ClH.2Zr/c2*1-2-3-6-9-7-4-5-8-9;2*1-6-4-3-5-7(6)2;;;;/h2*4,7H,2-3,5-6H2,1H3;2*4H,3H2,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2