9H-fluoren-9-ide; 3-methyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 9H-fluoren-9-ide; 3-methyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 9H-fluoren-9-ide; 3-methyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 9H-fluoren-9-ide; 3-methyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 9H-fluoren-9-ide; 3-methyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 9H-fluoren-9-ide; 3-methyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C46H36Cl2Zr2-2 MolecularWeight: 842.13204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[CH-]C2=CC=CC=C12.CC1=C[CH-]C2=CC=CC=C12.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=C[CH-]C2=CC=CC=C12.CC1=C[CH-]C2=CC=CC=C12.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C13H9.2C10H9.2ClH.2Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-8-6-7-9-4-2-3-5-10(8)9;;;;/h2*1-9H;2*2-7H,1H3;2*1H;;/q4*-1;;;2*+2/p-2