1-(1H-inden-1-id-2-yl)pyrrole; zirconium(2+); dichloride

Systemtic Name: 1-(1H-inden-1-id-2-yl)pyrrole; zirconium(2+); dichloride Openeye Name: 1-(1H-inden-1-id-2-yl)pyrrole; zirconium(2+); dichloride CAS Name: 1-(1H-inden-1-id-2-yl)pyrrole; zirconium(2+); dichloride IUPAC Name: 1-(1H-inden-1-id-2-yl)pyrrole; zirconium(2+); dichloride Traditional Name: 1-(1H-inden-1-id-2-yl)pyrrole; zirconium(2+); dichloride Formula: C52H40Cl2N4Zr2-2 MolecularWeight: 974.2548

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[CH-]1C2=CC=CC=C2C=C1N3C=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C13H10N.2ClH.2Zr/c4*1-2-6-12-10-13(9-11(12)5-1)14-7-3-4-8-14;;;;/h4*1-10H;2*1H;;/q4*-1;;;2*+2/p-2