127229-15-6

Basic information

• Product Name: 2P(C₆H₅)3CH₃⁽¹⁺⁾*(C₂B₁₀H₁₁)2^(2-)={P(C₆H₅)3CH₃}2(C₂B₁₀H₁₁)2
• Synonyms: 2P(C₆H₅)3CH₃⁽¹⁺⁾*(C₂B₁₀H₁₁)2^(2-)={P(C₆H₅)3CH₃}2(C₂B₁₀H₁₁)2
• CAS NO: 127229-15-6
• Molecular Weight: 841.09
• Mol File: 127229-15-6.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 2P(C₆H₅)3CH₃⁽¹⁺⁾*(C₂B₁₀H₁₁)2^(2-)={P(C₆H₅)3CH₃}2(C₂B₁₀H₁₁)2(CAS DataBase Reference)
• NIST Chemistry Reference: 2P(C₆H₅)3CH₃⁽¹⁺⁾*(C₂B₁₀H₁₁)2^(2-)={P(C₆H₅)3CH₃}2(C₂B₁₀H₁₁)2(127229-15-6)
• EPA Substance Registry System: 2P(C₆H₅)3CH₃⁽¹⁺⁾*(C₂B₁₀H₁₁)2^(2-)={P(C₆H₅)3CH₃}2(C₂B₁₀H₁₁)2(127229-15-6)

Safety Data

• Hazardous Substances Data: 127229-15-6(Hazardous Substances Data)

Upstream product

• 12075-02-4 1,1'-bis(o-carborane) 
• 1779-49-3 Methyltriphenylphosphonium bromide 

Relevant articles and documents

Reduction of biscarborane: Molecular structures of [(15-crown-5)3Na2](C2B10H 11)2 and [P(C6H5)3CH3] 2[μ-9,10-CH-(μ-9′,10′-CH-nido-7′-CB 10H11)-nido-7-CB10H11]

The synthesis, characterization, and elucidation of the structures of [(15-crown-5)3Na2](C2B10H 11)2 ([(15-crown-5)3Na2](1)) and [P(C6H5)3CH3] 2[μ-9,10,-CH-(μ-9′,10′-CH-nido-7′-CB 10H11)-nido-7-CB10H11] ([P(C6H5)3CH3]2(2)) are described. A comparison is made between the solid-state structures of the anion, 1, in [(15-crown-5)3Na2](1) and [P(C6H5)3CH3]2(1). The structure of the cation [(15-crown-5)3Na2]2+, described in detail, represents the first structural characterization of a 3:2 15-crown-5:Na club sandwich complex. [(15-crown-5)3Na2](C2B10H 11)2 crystallized in th triclinic space group P1 with a = 12.411 (1), b = 14.676 (2), and c = 14.988 (2) A?, α = 101.371 (3), β = 96.222 (3), and γ = 91.549 (4)°, V = 2657 A?3, and Z = 2. Data were collected at 128 K on a modified Picker FACS-1 diffractometer using Mo Kα radiation, to a maximum 2θ = 56°, giving 12832 unique reflections. The structure was solved by direct methods. The final discrepancy indices were R = 0.057 and Rw = 0.062 for 5012 independent reflections with I > 3σ(I). The protonation of the species formed by the reduction of biscarborane by 4 equiv or an excess of sodium naphthalide resulted in the formation of Na2(2). [P(C6H5)3CH3]2(2) crystallized in the monoclinic space group P21/n with a = 11.429 (3), b = 15.075 (4), and c = 16.520 (4) A?, β = 119.648 (8)°, V = 2474 A?3, and Z = 2. Data were collected on a Huber diffractomer (constructed at UCLA) using Mo Kα radiation, to a maximum 2θ = 50°, giving 4368 unique reflections. The structure was solved by direct methods (MULTAN80). The final discrepancy indices were R = 0.070 and Rw = 0.101 for 3264 independent reflections with I > 3σ(I).