2-tert-butylcyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 2-tert-butylcyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 2-tert-butylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 2-tert-butylcyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C18H26Cl2Zr2 MolecularWeight: 495.75304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C9H13.2ClH.2Zr/c2*1-9(2,3)8-6-4-5-7-8;;;;/h2*4,6H,5H2,1-3H3;2*1H;;/q2*-1;;;2*+2/p-2