carbon monoxide; cyclopenta-1,3-diene; diphenylphosphane; ruthenium(1+); triphenylphosphanium; hexafluorophosphate

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; diphenylphosphane; ruthenium(1+); triphenylphosphanium; hexafluorophosphate Openeye Name: carbon monoxide; cyclopenta-1,3-diene; diphenylphosphane; ruthenium(1+); triphenylphosphonium; hexafluorophosphate CAS Name: carbon monoxide; cyclopenta-1,3-diene; diphenylphosphine; ruthenium(1+); triphenylphosphonium; hexafluorophosphate IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; diphenylphosphane; ruthenium(1+); triphenylphosphanium; hexafluorophosphate Traditional Name: carbon monoxide; cyclopenta-1,3-diene; diphenylphosphine; ruthenium(1+); triphenylphosphonium; hexafluorophosphate Formula: C36H28F6OP3Ru+ MolecularWeight: 784.588622

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].C1=CC=C(C=C1)PC2=CC=CC=C2.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[C]=[C][C]=[C]1.F[P-](F)(F)(F)(F)F.[Ru+]

Isomeric SMILES

[C-]#[O+].C1=CC=C(C=C1)PC2=CC=CC=C2.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[C]=[C][C]=[C]1.F[P-](F)(F)(F)(F)F.[Ru+]

InChI

InChI=1S/C18H15P.C12H11P.C5H.CO.F6P.Ru/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-4-5-3-1;1-2;1-7(2,3,4,5)6;/h1-15H;1-10,13H;1H;;;/q;;;;-1;+1/p+1