cyclopentane; ethanenitrile; ruthenium(2+); triphenylphosphane; hexafluorophosphate

Systemtic Name: cyclopentane; ethanenitrile; ruthenium(2+); triphenylphosphane; hexafluorophosphate Openeye Name: acetonitrile; cyclopentane; ruthenium(2+); triphenylphosphane; hexafluorophosphate CAS Name: acetonitrile; cyclopentane; ruthenium(2+); triphenylphosphine; hexafluorophosphate IUPAC Name: acetonitrile; cyclopentane; ruthenium(2+); triphenylphosphane; hexafluorophosphate Traditional Name: acetonitrile; cyclopentane; ruthenium(2+); triphenylphosphine; hexafluorophosphate Formula: C43H38F6NP3Ru+ MolecularWeight: 876.750222

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.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.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Ru+2]

Isomeric SMILES

CC#N.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.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Ru+2]

InChI

InChI=1S/2C18H15P.C5H5.C2H3N.F6P.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-5-3-1;1-2-3;1-7(2,3,4,5)6;/h2*1-15H;1-5H;1H3;;/q;;;;-1;+2