9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 9H-fluoren-9-ide; 2-methylcyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C38H32Cl2Zr2-2 MolecularWeight: 742.01468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.CC1=[C-]CC=C1.[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-]CC=C1.CC1=[C-]CC=C1.[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/2C13H9.2C6H7.2ClH.2Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-6-4-2-3-5-6;;;;/h2*1-9H;2*2,4H,3H2,1H3;2*1H;;/q4*-1;;;2*+2/p-2