carbon monoxide; ruthenium(2+); triphenylphosphane; dichloride

Systemtic Name: carbon monoxide; ruthenium(2+); triphenylphosphane; dichloride Openeye Name: carbon monoxide; ruthenium(2+); triphenylphosphane; dichloride CAS Name: carbon monoxide; ruthenium(2+); triphenylphosphine; dichloride IUPAC Name: carbon monoxide; ruthenium(2+); triphenylphosphane; dichloride Traditional Name: carbon monoxide; ruthenium(2+); triphenylphosphine; dichloride Formula: C38H30Cl2O2P2Ru MolecularWeight: 752.567122

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[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.[Cl-].[Cl-].[Ru+2]

Isomeric SMILES

[C-]#[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.[Cl-].[Cl-].[Ru+2]

InChI

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