1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; (diphenylmethylidene)zirconium(2+); dichloride

Systemtic Name: 1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; (diphenylmethylidene)zirconium(2+); dichloride Openeye Name: benzhydrylidenezirconium(2+); 1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; dichloride CAS Name: 1-tert-butyl-3-methylcyclopenta-1,3-diene; 2-tert-butyl-5-methylcyclopenta-1,3-diene; (diphenylmethylene)zirconium(2+); dichloride IUPAC Name: benzhydrylidenezirconium(2+); 1-tert-butyl-3-methylcyclopenta-1,3-diene; 2-tert-butyl-5-methylcyclopenta-1,3-diene; dichloride Traditional Name: benzhydrylidenezirconium(2+); 1-tert-butyl-3-methyl-cyclopenta-1,3-diene; 2-tert-butyl-5-methyl-cyclopenta-1,3-diene; dichloride Formula: C33H40Cl2Zr-2 MolecularWeight: 598.8007

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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.C1=CC=C(C=C1)C(=[Zr+2])C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CC1C=C(C=[C-]1)C(C)(C)C.CC1=[C-]CC(=C1)C(C)(C)C.C1=CC=C(C=C1)C(=[Zr+2])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/C13H10.2C10H15.2ClH.Zr/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;2*1-8-5-6-9(7-8)10(2,3)4;;;/h1-10H;7H,6H2,1-4H3;6-8H,1-4H3;2*1H;/q;2*-1;;;+2/p-2