ethane-1,2-diamine; methyl benzoate; ruthenium(2+); chloride; hexafluorophosphate

Systemtic Name: ethane-1,2-diamine; methyl benzoate; ruthenium(2+); chloride; hexafluorophosphate Openeye Name: ethane-1,2-diamine; methyl benzoate; ruthenium(2+); chloride; hexafluorophosphate CAS Name: benzoic acid methyl ester; ethane-1,2-diamine; ruthenium(2+); chloride; hexafluorophosphate IUPAC Name: ethane-1,2-diamine; methyl benzoate; ruthenium(2+); chloride; hexafluorophosphate Traditional Name: 2-aminoethylamine; benzoic acid methyl ester; ruthenium(2+); chloride; hexafluorophosphate Formula: C10H16ClF6N2O2PRu MolecularWeight: 477.73342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1.C(CN)N.F[P-](F)(F)(F)(F)F.[Cl-].[Ru+2]

Isomeric SMILES

COC(=O)C1=CC=CC=C1.C(CN)N.F[P-](F)(F)(F)(F)F.[Cl-].[Ru+2]

InChI

InChI=1S/C8H8O2.C2H8N2.ClH.F6P.Ru/c1-10-8(9)7-5-3-2-4-6-7;3-1-2-4;;1-7(2,3,4,5)6;/h2-6H,1H3;1-4H2;1H;;/q;;;-1;+2/p-1