2,7-ditert-butyl-9-(cyclopenta-1,3-dien-1-ylmethyl)-9H-fluorene; zirconium(2+); dichloride

Systemtic Name: 2,7-ditert-butyl-9-(cyclopenta-1,3-dien-1-ylmethyl)-9H-fluorene; zirconium(2+); dichloride Openeye Name: 2,7-ditert-butyl-9-(cyclopenta-1,3-dien-1-ylmethyl)-9H-fluorene; zirconium(2+); dichloride CAS Name: 2,7-ditert-butyl-9-(1-cyclopenta-1,3-dienylmethyl)-9H-fluorene; zirconium(2+); dichloride IUPAC Name: 2,7-ditert-butyl-9-(cyclopenta-1,3-dien-1-ylmethyl)-9H-fluorene; zirconium(2+); dichloride Traditional Name: 2,7-ditert-butyl-9-(cyclopenta-1,3-dien-1-ylmethyl)-9H-fluorene; zirconium(2+); dichloride Formula: C27H32Cl2Zr MolecularWeight: 518.67298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C3=C(C2CC4=CC=CC4)C=C(C=C3)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C3=C(C2CC4=CC=CC4)C=C(C=C3)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C27H32.2ClH.Zr/c1-26(2,3)19-11-13-21-22-14-12-20(27(4,5)6)17-25(22)23(24(21)16-19)15-18-9-7-8-10-18;;;/h7-9,11-14,16-17,23H,10,15H2,1-6H3;2*1H;/q;;;+2/p-2