2-tert-butyl-3,5-dimethyl-cyclopenta-1,3-diene; cyclopenta-1,3-diene; zirconium(2+); chloride

Systemtic Name: 2-tert-butyl-3,5-dimethyl-cyclopenta-1,3-diene; cyclopenta-1,3-diene; zirconium(2+); chloride Openeye Name: 2-tert-butyl-3,5-dimethyl-cyclopenta-1,3-diene; cyclopenta-1,3-diene; zirconium(2+); chloride CAS Name: 2-tert-butyl-3,5-dimethylcyclopenta-1,3-diene; cyclopenta-1,3-diene; zirconium(2+); chloride IUPAC Name: 2-tert-butyl-3,5-dimethylcyclopenta-1,3-diene; cyclopenta-1,3-diene; zirconium(2+); chloride Traditional Name: 2-tert-butyl-3,5-dimethyl-cyclopenta-1,3-diene; cyclopenta-1,3-diene; zirconium(2+); chloride Formula: C16H22ClZr- MolecularWeight: 341.02288

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(=[C-]1)C)C(C)(C)C.C1C=CC=[C-]1.[Cl-].[Zr+2]

Isomeric SMILES

CC1C=C(C(=[C-]1)C)C(C)(C)C.C1C=CC=[C-]1.[Cl-].[Zr+2]

InChI

InChI=1S/C11H17.C5H5.ClH.Zr/c1-8-6-9(2)10(7-8)11(3,4)5;1-2-4-5-3-1;;/h7-8H,1-5H3;1-3H,4H2;1H;/q2*-1;;+2/p-1