carbon monoxide; 2-methylpropanoate; ruthenium(1+); triphenylphosphane

Systemtic Name: carbon monoxide; 2-methylpropanoate; ruthenium(1+); triphenylphosphane Openeye Name: carbon monoxide; 2-methylpropanoate; ruthenium(1+); triphenylphosphane CAS Name: carbon monoxide; 2-methylpropanoate; ruthenium(1+); triphenylphosphine IUPAC Name: carbon monoxide; 2-methylpropanoate; ruthenium(1+); triphenylphosphane Traditional Name: carbon monoxide; ruthenium(1+); triphenylphosphine; isobutyrate Formula: C41H37O3P2Ru MolecularWeight: 740.748202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)[O-].[C-]#[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.[Ru+]

Isomeric SMILES

CC(C)C(=O)[O-].[C-]#[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.[Ru+]

InChI

InChI=1S/2C18H15P.C4H8O2.CO.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3(2)4(5)6;1-2;/h2*1-15H;3H,1-2H3,(H,5,6);;/q;;;;+1/p-1