azanide; benzene; 1H-inden-1-ide; zirconium(4+); dichloride

Systemtic Name: azanide; benzene; 1H-inden-1-ide; zirconium(4+); dichloride Openeye Name: azanide; benzene; 1H-inden-1-ide; zirconium(4+); dichloride CAS Name: azanide; benzene; 1H-inden-1-ide; zirconium(4+); dichloride IUPAC Name: azanide; benzene; 1H-inden-1-ide; zirconium(4+); dichloride Traditional Name: azanide; benzene; 1H-inden-1-ide; zirconium(4+); dichloride Formula: C48H42Cl2N2Zr2-2 MolecularWeight: 900.21448

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[NH2-].[NH2-].[Cl-].[Cl-].[Zr+4].[Zr+4]

Isomeric SMILES

[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[NH2-].[NH2-].[Cl-].[Cl-].[Zr+4].[Zr+4]

InChI

InChI=1S/4C9H7.2C6H5.2ClH.2H2N.2Zr/c4*1-2-5-9-7-3-6-8(9)4-1;2*1-2-4-6-5-3-1;;;;;;/h4*1-7H;2*1-5H;2*1H;2*1H2;;/q6*-1;;;2*-1;2*+4/p-2