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

Systemtic Name: 1,3-dimethylcyclopenta-1,3-diene; (diphenylmethylidene)zirconium(2+); dichloride Openeye Name: benzhydrylidenezirconium(2+); 1,3-dimethylcyclopenta-1,3-diene; dichloride CAS Name: 1,3-dimethylcyclopenta-1,3-diene; (diphenylmethylene)zirconium(2+); dichloride IUPAC Name: benzhydrylidenezirconium(2+); 1,3-dimethylcyclopenta-1,3-diene; dichloride Traditional Name: benzhydrylidenezirconium(2+); 1,3-dimethylcyclopenta-1,3-diene; dichloride Formula: C27H28Cl2Zr-2 MolecularWeight: 514.64122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10.2C7H9.2ClH.Zr/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;2*1-6-3-4-7(2)5-6;;;/h1-10H;2*5H,3H2,1-2H3;2*1H;/q;2*-1;;;+2/p-2