2-tert-butylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); dichloride

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); dichloride Openeye Name: 2-tert-butylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; isopropylidenezirconium(2+); dichloride CAS Name: 2-tert-butylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); dichloride IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); dichloride Traditional Name: 2-tert-butylcyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; isopropylidenezirconium(2+); dichloride Formula: C25H28Cl2Zr-2 MolecularWeight: 490.61982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[Zr+2])C.CC(C)(C)C1=[C-]CC=C1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

CC(=[Zr+2])C.CC(C)(C)C1=[C-]CC=C1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C13H9.C9H13.C3H6.2ClH.Zr/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-9(2,3)8-6-4-5-7-8;1-3-2;;;/h1-5,7-8H,9H2;4,6H,5H2,1-3H3;1-2H3;2*1H;/q2*-1;;;;+2/p-2