1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride

Systemtic Name: 1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride Openeye Name: 1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; isopropylidenezirconium; dichloride CAS Name: 1-tert-butyl-3-methylcyclopenta-1,3-diene; 2-tert-butyl-5-methylcyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride IUPAC Name: 1-tert-butyl-3-methylcyclopenta-1,3-diene; 2-tert-butyl-5-methylcyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride Traditional Name: 1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; isopropylidenezirconium; dichloride Formula: C33H51Cl2Zr-5 MolecularWeight: 609.88804

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C=[C-]1)C(C)(C)C.CC1=[C-]CC(=C1)C(C)(C)C.CC1=[C-]CC(=C1)C(C)(C)C.CC(=[Zr])C.[Cl-].[Cl-]

Isomeric SMILES

CC1C=C(C=[C-]1)C(C)(C)C.CC1=[C-]CC(=C1)C(C)(C)C.CC1=[C-]CC(=C1)C(C)(C)C.CC(=[Zr])C.[Cl-].[Cl-]

InChI

InChI=1S/3C10H15.C3H6.2ClH.Zr/c3*1-8-5-6-9(7-8)10(2,3)4;1-3-2;;;/h2*7H,6H2,1-4H3;6-8H,1-4H3;1-2H3;2*1H;/q3*-1;;;;/p-2