cyclopenta-1,3-diene; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: cyclopenta-1,3-diene; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: cyclopenta-1,3-diene; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: cyclopenta-1,3-diene; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: cyclopenta-1,3-diene; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: cyclopenta-1,3-diene; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C40H32Cl2Zr2-2 MolecularWeight: 766.03608

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1C=CC=[C-]1.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

C1C=CC=[C-]1.C1C=CC=[C-]1.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C15H11.2C5H5.2ClH.2Zr/c2*1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;2*1-2-4-5-3-1;;;;/h2*1-11H;2*1-3H,4H2;2*1H;;/q4*-1;;;2*+2/p-2