1H-inden-1-ide; 7-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride

Systemtic Name: 1H-inden-1-ide; 7-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Openeye Name: 1H-inden-1-ide; 7-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride CAS Name: 1H-inden-1-ide; 7-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride IUPAC Name: 1H-inden-1-ide; 7-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Traditional Name: 1H-inden-1-ide; 7-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Formula: C46H36Cl2Zr2-2 MolecularWeight: 842.13204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C(C2)[C-]=CC=C3.CC1=CC2=C(C=C1)C3=C(C2)[C-]=CC=C3.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C(C2)[C-]=CC=C3.CC1=CC2=C(C=C1)C3=C(C2)[C-]=CC=C3.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C14H11.2C9H7.2ClH.2Zr/c2*1-10-6-7-14-12(8-10)9-11-4-2-3-5-13(11)14;2*1-2-5-9-7-3-6-8(9)4-1;;;;/h2*2-3,5-8H,9H2,1H3;2*1-7H;2*1H;;/q4*-1;;;2*+2/p-2