1,4-ditert-butyl-1-(cyclopenta-1,3-dien-1-ylmethyl)fluorene; zirconium(2+); dichloride

Systemtic Name: 1,4-ditert-butyl-1-(cyclopenta-1,3-dien-1-ylmethyl)fluorene; zirconium(2+); dichloride Openeye Name: 1,4-ditert-butyl-1-(cyclopenta-1,3-dien-1-ylmethyl)fluorene; zirconium(2+); dichloride CAS Name: 1,4-ditert-butyl-1-(1-cyclopenta-1,3-dienylmethyl)fluorene; zirconium(2+); dichloride IUPAC Name: 1,4-ditert-butyl-1-(cyclopenta-1,3-dien-1-ylmethyl)fluorene; zirconium(2+); dichloride Traditional Name: 1,4-ditert-butyl-1-(cyclopenta-1,3-dien-1-ylmethyl)fluorene; zirconium(2+); dichloride Formula: C27H32Cl2Zr MolecularWeight: 518.67298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C3=CC=CC=C3C=C2C(C=C1)(CC4=CC=CC4)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC(C)(C)C1=C2C3=CC=CC=C3C=C2C(C=C1)(CC4=CC=CC4)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

InChI

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