chloranylruthenium(1+); methanone; triphenylphosphane

Systemtic Name: chloranylruthenium(1+); methanone; triphenylphosphane Openeye Name: chlororuthenium(1+); methanone; triphenylphosphane CAS Name: chlororuthenium(1+); methanone; triphenylphosphine IUPAC Name: chlororuthenium(1+); methanone; triphenylphosphane Traditional Name: chlororuthenium(1+); methanone; triphenylphosphine Formula: C55H46ClOP3Ru MolecularWeight: 952.397423

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]=O.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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]

Isomeric SMILES

[CH-]=O.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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]

InChI

InChI=1S/3C18H15P.CHO.ClH.Ru/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;;/h3*1-15H;1H;1H;/q;;;-1;;+2/p-1