chloranylruthenium(1+); (2-diphenylphosphanylphenyl)-diphenyl-phosphane; 1-methyl-4-propan-2-yl-benzene; hexafluorophosphate

Systemtic Name: chloranylruthenium(1+); (2-diphenylphosphanylphenyl)-diphenyl-phosphane; 1-methyl-4-propan-2-yl-benzene; hexafluorophosphate Openeye Name: chlororuthenium(1+); (2-diphenylphosphanylphenyl)-diphenyl-phosphane; 1-isopropyl-4-methyl-benzene; hexafluorophosphate CAS Name: chlororuthenium(1+); (2-diphenylphosphinophenyl)-diphenylphosphine; 1-methyl-4-propan-2-ylbenzene; hexafluorophosphate IUPAC Name: chlororuthenium(1+); (2-diphenylphosphanylphenyl)-diphenylphosphane; 1-methyl-4-propan-2-ylbenzene; hexafluorophosphate Traditional Name: chlororuthenium(1+); (2-diphenylphosphinophenyl)-diphenyl-phosphine; p-cymene; hexafluorophosphate Formula: C40H38ClF6P3Ru MolecularWeight: 862.164422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5.F[P-](F)(F)(F)(F)F.Cl[Ru+]

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5.F[P-](F)(F)(F)(F)F.Cl[Ru+]

InChI

InChI=1S/C30H24P2.C10H14.ClH.F6P.Ru/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-8(2)10-6-4-9(3)5-7-10;;1-7(2,3,4,5)6;/h1-24H;4-8H,1-3H3;1H;;/q;;;-1;+2/p-1