trichloranium; 1-(pyrazol-1-ium-2-id-1-ylmethyl)pyrazol-1-ium-2-ide; ruthenium; ruthenium(2+); triphenylphosphanium

Systemtic Name: trichloranium; 1-(pyrazol-1-ium-2-id-1-ylmethyl)pyrazol-1-ium-2-ide; ruthenium; ruthenium(2+); triphenylphosphanium Openeye Name: trichloronium; 1-(pyrazol-1-ium-2-id-1-ylmethyl)pyrazol-1-ium-2-ide; ruthenium; ruthenium(2+); triphenylphosphonium CAS Name: trichloronium; 1-(1-pyrazol-1-ium-2-idylmethyl)pyrazol-1-ium-2-ide; ruthenium; ruthenium(2+); triphenylphosphonium IUPAC Name: trichloranium; 1-(pyrazol-1-ium-2-id-1-ylmethyl)pyrazol-1-ium-2-ide; ruthenium; ruthenium(2+); triphenylphosphanium Traditional Name: trichloronium; 1-(pyrazol-1-ium-2-id-1-ylmethyl)pyrazol-1-ium-2-ide; ruthenium; ruthenium(2+); triphenylphosphonium Formula: C50H54Cl3N8P2Ru2+7 MolecularWeight: 1137.463882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=C[N-][N+](=C1)C[N+]2=CC=C[N-]2.C1=C[N-][N+](=C1)C[N+]2=CC=C[N-]2.[ClH2+].[ClH2+].[ClH2+].[Ru].[Ru+2]

Isomeric SMILES

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=C[N-][N+](=C1)C[N+]2=CC=C[N-]2.C1=C[N-][N+](=C1)C[N+]2=CC=C[N-]2.[ClH2+].[ClH2+].[ClH2+].[Ru].[Ru+2]

InChI

InChI=1S/2C18H15P.2C7H8N4.3ClH2.2Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-3-8-10(5-1)7-11-6-2-4-9-11;;;;;/h2*1-15H;2*1-6H,7H2;3*1H2;;/q;;;;3*+1;;+2/p+2