cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 2,6-dimethylheptan-4-ylidenezirconium(2+); dichloride

Systemtic Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 2,6-dimethylheptan-4-ylidenezirconium(2+); dichloride Openeye Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; (1-isobutyl-3-methyl-butylidene)zirconium(2+); dichloride CAS Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 2,6-dimethylheptan-4-ylidenezirconium(2+); dichloride IUPAC Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 2,6-dimethylheptan-4-ylidenezirconium(2+); dichloride Traditional Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; (1-isobutyl-3-methyl-butylidene)zirconium(2+); dichloride Formula: C27H32Cl2Zr-2 MolecularWeight: 518.67298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=[Zr+2])CC(C)C.C1C=CC=[C-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

CC(C)CC(=[Zr+2])CC(C)C.C1C=CC=[C-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C13H9.C9H18.C5H5.2ClH.Zr/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-8(2)6-5-7-9(3)4;1-2-4-5-3-1;;;/h1-5,7-8H,9H2;8-9H,6-7H2,1-4H3;1-3H,4H2;2*1H;/q-1;;-1;;;+2/p-2