dicyclohexyl-[2-(2-dicyclohexylphosphanyl-6-methyl-phenyl)-3-methyl-phenyl]phosphane; iodanylruthenium(1+); 1-methyl-4-propan-2-yl-benzene; iodide

Systemtic Name: dicyclohexyl-[2-(2-dicyclohexylphosphanyl-6-methyl-phenyl)-3-methyl-phenyl]phosphane; iodanylruthenium(1+); 1-methyl-4-propan-2-yl-benzene; iodide Openeye Name: dicyclohexyl-[2-(2-dicyclohexylphosphanyl-6-methyl-phenyl)-3-methyl-phenyl]phosphane; iodoruthenium(1+); 1-isopropyl-4-methyl-benzene; iodide CAS Name: dicyclohexyl-[2-(2-dicyclohexylphosphino-6-methylphenyl)-3-methylphenyl]phosphine; iodoruthenium(1+); 1-methyl-4-propan-2-ylbenzene; iodide IUPAC Name: dicyclohexyl-[2-(2-dicyclohexylphosphanyl-6-methylphenyl)-3-methylphenyl]phosphane; iodoruthenium(1+); 1-methyl-4-propan-2-ylbenzene; iodide Traditional Name: dicyclohexyl-[2-(2-dicyclohexylphosphino-6-methyl-phenyl)-3-methyl-phenyl]phosphine; iodoruthenium(1+); p-cymene; iodide Formula: C48H70I2P2Ru MolecularWeight: 1063.895862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)C.CC1=C(C(=CC=C1)P(C2CCCCC2)C3CCCCC3)C4=C(C=CC=C4P(C5CCCCC5)C6CCCCC6)C.[Ru+]I.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C.CC1=C(C(=CC=C1)P(C2CCCCC2)C3CCCCC3)C4=C(C=CC=C4P(C5CCCCC5)C6CCCCC6)C.[Ru+]I.[I-]

InChI

InChI=1S/C38H56P2.C10H14.2HI.Ru/c1-29-17-15-27-35(39(31-19-7-3-8-20-31)32-21-9-4-10-22-32)37(29)38-30(2)18-16-28-36(38)40(33-23-11-5-12-24-33)34-25-13-6-14-26-34;1-8(2)10-6-4-9(3)5-7-10;;;/h15-18,27-28,31-34H,3-14,19-26H2,1-2H3;4-8H,1-3H3;2*1H;/q;;;;+2/p-2