carbon monoxide; diphenylphosphane; 1,3-diphenylpropa-1,2-dienylbenzene; ruthenium; ruthenium(1+)

Systemtic Name: carbon monoxide; diphenylphosphane; 1,3-diphenylpropa-1,2-dienylbenzene; ruthenium; ruthenium(1+) Openeye Name: carbon monoxide; diphenylphosphane; 1,3-diphenylpropa-1,2-dienylbenzene; ruthenium; ruthenium(1+) CAS Name: carbon monoxide; diphenylphosphine; 1,3-diphenylpropa-1,2-dienylbenzene; ruthenium; ruthenium(1+) IUPAC Name: carbon monoxide; diphenylphosphane; 1,3-diphenylpropa-1,2-dienylbenzene; ruthenium; ruthenium(1+) Traditional Name: carbon monoxide; diphenylphosphine; 1,3-diphenylpropa-1,2-dienylbenzene; ruthenium; ruthenium(1+) Formula: C39H26O6PRu2 MolecularWeight: 823.733901

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[C-]=C=C(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)PC2=CC=CC=C2.[Ru].[Ru+]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[C-]=C=C(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)PC2=CC=CC=C2.[Ru].[Ru+]

InChI

InChI=1S/C21H15.C12H11P.6CO.2Ru/c1-4-10-18(11-5-1)16-17-21(19-12-6-2-7-13-19)20-14-8-3-9-15-20;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;6*1-2;;/h1-15H;1-10,13H;;;;;;;;/q-1;;;;;;;;;+1