2-butyl-3-ethyl-cyclopenta-1,3-diene; zirconium(4+); dichloride

Systemtic Name: 2-butyl-3-ethyl-cyclopenta-1,3-diene; zirconium(4+); dichloride Openeye Name: 2-butyl-3-ethyl-cyclopenta-1,3-diene; zirconium(4+); dichloride CAS Name: 2-butyl-3-ethylcyclopenta-1,3-diene; zirconium(4+); dichloride IUPAC Name: 2-butyl-3-ethylcyclopenta-1,3-diene; zirconium(4+); dichloride Traditional Name: 2-butyl-3-ethyl-cyclopenta-1,3-diene; zirconium(4+); dichloride Formula: C22H34Cl2Zr MolecularWeight: 460.63536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC[C-]=C1CC.CCCCC1=CC[C-]=C1CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCC1=CC[C-]=C1CC.CCCCC1=CC[C-]=C1CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C11H17.2ClH.Zr/c2*1-3-5-7-11-9-6-8-10(11)4-2;;;/h2*9H,3-7H2,1-2H3;2*1H;/q2*-1;;;+4/p-2