1-cyclopenta-1,3-dien-1-yl-2,3-dimethyl-cyclopenta-1,3-diene; (diphenylmethylidene)zirconium; dichloride

Systemtic Name: 1-cyclopenta-1,3-dien-1-yl-2,3-dimethyl-cyclopenta-1,3-diene; (diphenylmethylidene)zirconium; dichloride Openeye Name: benzhydrylidenezirconium; 1-cyclopenta-1,3-dien-1-yl-2,3-dimethyl-cyclopenta-1,3-diene; dichloride CAS Name: 1-(1-cyclopenta-1,3-dienyl)-2,3-dimethylcyclopenta-1,3-diene; (diphenylmethylene)zirconium; dichloride IUPAC Name: benzhydrylidenezirconium; 1-cyclopenta-1,3-dien-1-yl-2,3-dimethylcyclopenta-1,3-diene; dichloride Traditional Name: benzhydrylidenezirconium; 1-cyclopenta-1,3-dien-1-yl-2,3-dimethyl-cyclopenta-1,3-diene; dichloride Formula: C25H23Cl2Zr-3 MolecularWeight: 485.58012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC(=C1C)C2=CC=CC2.C1=CC=C(C=C1)C(=[Zr])C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CC1=[C-]CC(=C1C)C2=CC=CC2.C1=CC=C(C=C1)C(=[Zr])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/C13H10.C12H13.2ClH.Zr/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-9-7-8-12(10(9)2)11-5-3-4-6-11;;;/h1-10H;3-5H,6,8H2,1-2H3;2*1H;/q;-1;;;/p-2