2-tert-butylcyclopenta-1,3-diene; 3-tert-butyl-1H-inden-1-ide; propane; zirconium(3+); dichloride

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butyl-1H-inden-1-ide; propane; zirconium(3+); dichloride Openeye Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butyl-1H-inden-1-ide; propane; zirconium(3+); dichloride CAS Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butyl-1H-inden-1-ide; propane; zirconium(3+); dichloride IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butyl-1H-inden-1-ide; propane; zirconium(3+); dichloride Traditional Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butyl-1H-inden-1-ide; propane; zirconium(3+); dichloride Formula: C25H35Cl2Zr-2 MolecularWeight: 497.6754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[CH-]C.CC(C)(C)C1=CC[C-]=C1.CC(C)(C)C1=C[CH-]C2=CC=CC=C21.[Cl-].[Cl-].[Zr+3]

Isomeric SMILES

C[CH-]C.CC(C)(C)C1=CC[C-]=C1.CC(C)(C)C1=C[CH-]C2=CC=CC=C21.[Cl-].[Cl-].[Zr+3]

InChI

InChI=1S/C13H15.C9H13.C3H7.2ClH.Zr/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)12;1-9(2,3)8-6-4-5-7-8;1-3-2;;;/h4-9H,1-3H3;6-7H,4H2,1-3H3;3H,1-2H3;2*1H;/q3*-1;;;+3/p-2