disodium; 6-diphenylphosphanyl-5-(2-diphenylphosphanyl-5-sulfonato-naphthalen-1-yl)naphthalene-1-sulfonate; iodanylruthenium(1+); 1-methyl-4-propan-2-yl-benzene; iodide

Systemtic Name: disodium; 6-diphenylphosphanyl-5-(2-diphenylphosphanyl-5-sulfonato-naphthalen-1-yl)naphthalene-1-sulfonate; iodanylruthenium(1+); 1-methyl-4-propan-2-yl-benzene; iodide Openeye Name: disodium; 6-diphenylphosphanyl-5-(2-diphenylphosphanyl-5-sulfonato-1-naphthyl)naphthalene-1-sulfonate; iodoruthenium(1+); 1-isopropyl-4-methyl-benzene; iodide CAS Name: disodium; 6-diphenylphosphino-5-(2-diphenylphosphino-5-sulfonato-1-naphthalenyl)-1-naphthalenesulfonate; iodoruthenium(1+); 1-methyl-4-propan-2-ylbenzene; iodide IUPAC Name: disodium; 6-diphenylphosphanyl-5-(2-diphenylphosphanyl-5-sulfonatonaphthalen-1-yl)naphthalene-1-sulfonate; iodoruthenium(1+); 1-methyl-4-propan-2-ylbenzene; iodide Traditional Name: disodium; 6-diphenylphosphino-5-(2-diphenylphosphino-5-sulfonato-1-naphthyl)naphthalene-1-sulfonate; iodoruthenium(1+); p-cymene; iodide Formula: C54H44I2Na2O6P2RuS2 MolecularWeight: 1315.859562

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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=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])C5=C(C=CC6=C5C=CC=C6S(=O)(=O)[O-])P(C7=CC=CC=C7)C8=CC=CC=C8.[Na+].[Na+].[Ru+]I.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])C5=C(C=CC6=C5C=CC=C6S(=O)(=O)[O-])P(C7=CC=CC=C7)C8=CC=CC=C8.[Na+].[Na+].[Ru+]I.[I-]

InChI

InChI=1S/C44H32O6P2S2.C10H14.2HI.2Na.Ru/c45-53(46,47)41-25-13-23-37-35(41)27-29-39(51(31-15-5-1-6-16-31)32-17-7-2-8-18-32)43(37)44-38-24-14-26-42(54(48,49)50)36(38)28-30-40(44)52(33-19-9-3-10-20-33)34-21-11-4-12-22-34;1-8(2)10-6-4-9(3)5-7-10;;;;;/h1-30H,(H,45,46,47)(H,48,49,50);4-8H,1-3H3;2*1H;;;/q;;;;2*+1;+2/p-4