1-(3-tert-butylcyclopenta-1,3-dien-1-yl)-9H-fluoren-9-ide; propane; zirconium(4+); dichloride

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[CH-]C.CC(C)(C)C1=CCC(=C1)C2=CC=CC3=C2[CH-]C4=CC=CC=C43.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C[CH-]C.CC(C)(C)C1=CCC(=C1)C2=CC=CC3=C2[CH-]C4=CC=CC=C43.[Cl-].[Cl-].[Zr+4]

InChI

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