3-tert-butyl-9-cyclopenta-1,3-dien-1-yl-1,9-dihydrofluoren-1-ide; propane; zirconium(4+); dichloride

Systemtic Name: 3-tert-butyl-9-cyclopenta-1,3-dien-1-yl-1,9-dihydrofluoren-1-ide; propane; zirconium(4+); dichloride Openeye Name: 3-tert-butyl-9-cyclopenta-1,3-dien-1-yl-1,9-dihydrofluoren-1-ide; propane; zirconium(4+); dichloride CAS Name: 3-tert-butyl-9-(1-cyclopenta-1,3-dienyl)-1,9-dihydrofluoren-1-ide; propane; zirconium(4+); dichloride IUPAC Name: 3-tert-butyl-9-cyclopenta-1,3-dien-1-yl-1,9-dihydrofluoren-1-ide; propane; zirconium(4+); dichloride Traditional Name: 3-tert-butyl-9-cyclopenta-1,3-dien-1-yl-1,9-dihydrofluoren-1-ide; propane; zirconium(4+); dichloride Formula: C25H28Cl2Zr MolecularWeight: 490.61982

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Descriptors Computed from Structure

Canonical SMILES:

C[CH-]C.CC(C)(C)C1=CC2=C([C-]=C1)C(C3=CC=CC=C32)C4=CC=CC4.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C[CH-]C.CC(C)(C)C1=CC2=C([C-]=C1)C(C3=CC=CC=C32)C4=CC=CC4.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C22H21.C3H7.2ClH.Zr/c1-22(2,3)16-12-13-19-20(14-16)17-10-6-7-11-18(17)21(19)15-8-4-5-9-15;1-3-2;;;/h4-8,10-12,14,21H,9H2,1-3H3;3H,1-2H3;2*1H;/q2*-1;;;+4/p-2