chloranylruthenium(1+); triphenylphosphane; tri(pyrazol-1-yl)boron(1-)

Systemtic Name: chloranylruthenium(1+); triphenylphosphane; tri(pyrazol-1-yl)boron(1-) Openeye Name: chlororuthenium(1+); triphenylphosphane; tri(pyrazol-1-yl)boron(1-) CAS Name: chlororuthenium(1+); triphenylphosphine; tris(1-pyrazolyl)boron(1-) IUPAC Name: chlororuthenium(1+); triphenylphosphane; tri(pyrazol-1-yl)boron(1-) Traditional Name: chlororuthenium(1+); triphenylphosphine; tri(pyrazol-1-yl)boron(1-) Formula: C45H39BClN6P2Ru MolecularWeight: 873.112882

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Descriptors Computed from Structure

Canonical SMILES:

[B-](N1C=CC=N1)(N2C=CC=N2)N3C=CC=N3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]

Isomeric SMILES

[B-](N1C=CC=N1)(N2C=CC=N2)N3C=CC=N3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]

InChI

InChI=1S/2C18H15P.C9H9BN6.ClH.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;;/h2*1-15H;1-9H;1H;/q;;-1;;+2/p-1