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Copper(I) complexes of 1,2-bis(diphenylphosphino)ethane (dppe) with a stoichiometry Cu2(dppe)3(X)2 [X – = CN- (1), SCN- (2), NO3- (3)] are obtained from direct reactions of CuX and dppe. The complexes are structurally and spectroscopically (NMR and IR) characterized. The structure of the [Cu2(dppe)3]2+ dication is similar to the structural motif observed in many other complexes with a chelating dppe and a bridging dppe connecting two copper centers. In complexes 1-3, the anions are confined to the cavity formed by the phosphines which force a monodentate coordination mode despite the predominant bidentate/bridging character of the anions. The coordination angles rather than the thermochemical radii dictate the steric requirement of anions. While the solution behavior of 3, with nitrate, is similar to complexes studied earlier, complexes with pseudohalides exhibit new solution behavior.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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Chemistry is an experimental science, and the best way to enjoy it and learn about it is performing experiments. COA of Formula: CCuNS. Introducing a new discovery about 1111-67-7, Name is Cuprous thiocyanate

A mask is provided that can inactivate viruses adhering thereto even in the presence of lipids and proteins regardless of whether or not the viruses have an envelope. The mask can inactivate viruses adhering thereto and includes a mask body provided with a member used when the mask is worn and virus inactivating fine particles having a virus inactivating ability and held by the mask body. The virus inactivating fine particles are particles of at least one selected from the group consisting of platinium(II) iodide, palladium(II) iodided, silver(I) iodide, copper(I) iodide, and copper(I) thiocyanate.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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An efficient one-pot cascade methodology for the synthesis of (ethoxycarbonyl)difluoromethyl thioethers is described. Benzyl, allyl, alkyl halides or diazonium salts as the starting materials together with thiocyanate sodium and TMS-CF2CO2Et in the presence of CsF or NaOAc afford a variety of the fluoroalkylthiolated products in moderate to good yields.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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Two novel cation-induced complexes, {(Phen-dq) [Cu2(SCN) 4]}n (1) and {(Phen-dzp) [Cu2(SCN) 4]}n (2) [Phen-dq = (C14H12N 2)2+, 5,6-dihydropyrazino[1, 2, 3, 4-lmn]-1, 10-phenanthrolinium, Phen-dzp = (C15H14N2) 2+, 6,7-dihydro-5H-[1, 4]diazepino[1, 2, 3, 4-lmn][1,10] phenanthroline-4, 8-diium], have been synthesized via the self-assembly reaction in solution. The compound 1 possesses a two-dimensional supramolecular network linked by bridging thiocyanate groups. Complex 2 is also a two-dimensional polymeric architecture with the organic cation Phen-dzp trapped in it. Each Cu(I) atom is coordinated by two N atoms and two S atoms from four NCS groups to form a Cu2(NCS)2 rectangular dimer unit. In these two compounds, thanks to the difference from organic cations, the simple modification from Phen-dq to Phen-dzp leads to distinct structures between 1 and 2, and these “planar” cations are effective guests to manipulate the aggregate structure of thiocyanatocuprates.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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Related Products of 1317-39-1, Chemistry is the science of change. But why do chemical reactions take place? Why do chemicals react with each other? The answer is in thermodynamics and kinetics.In a document type is Article, and a compound is mentioned, 1317-39-1, Copper(I) oxide, introducing its new discovery.

Ab initio theoretical study of Cu2S, CuS, Cu2O and CuO lead to the determination of their geometrical parameters.These molecules were showed to be strongly polarized.CuS and Cu2S normal modes wavenumbers were also calculated.Theoretical study of Cu2S electronic spectrum showed that all allowed transitions lead to ultraviolet radiations.The determination of the first and the second Cu2X ionization potentials (verticals and adiabatics) as well as the calculation of Cu2X(+) and Cu2X(2+) geometries allowed us to state accurately the Cu2S and Cu2O molecular orbital diagrams.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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Several new complexes of the type [Cu(NO3)(PPh3)2(L)m] (L=3-methylpyrazole, 4-methylpyrazole, 3,5-dimethylpyrazole, 4-bromopyrazole or bis(4-methylpyrazol-1-yl)methane, m=1; L=pyrazole, 1,2,4-triazole or 2-methylimidazole, m=2), [Cu(NO3)(PPh3)(L)] (L=3,4,5-trimethylpyrazole or 4-phenylimidazole), [Cu(NO)3(PAr3)n(L)3] (Ar=p- or m-tolyl, n=0 or 1, L=pyrazole),[CuX(PPh3)2(L)] (X=Cl, Br or I, L=pyrazole or 3,5-dimethylpyrazole) and [CuX(PPh3)(L)] (X=Cl or Br, L=bis(pyrazol-1-yl)methane, bis(3,5-dimethy lpyrazol-1-yl)methane or bis(triazol-1-yl)methane) have been prepared and characterized by analytical and spectral data. The compounds [CuX(PPh3)(L)] (X=Cl, Br or I, L=pyrazole or 3,5-dimethylpyrazole) are fluxional at temperature above 240 K. The dinuclear compound [Cu2(PPh3)3(pzH)2] was obtained when the reaction between [CuI(PPh3)3] and pyrazole (pzH) wascarried out in methanol containing alkali. In the crystal structure of the title compound, the copper atom is found in a strongly distorted tet rahedral coordination [P-Cu-P: 128.0(1)°] with two long Cu-O distances [2.217(9) and 2.184(9) A].

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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Quantum dot sensitized solar cells (QDSSCs) are a promising photovoltaic technology due to their low cost and simplicity of fabrication. Most QDSSCs have an n-type configuration with electron injection from QDs into TiO2, which generally leads to unbalanced charge transport (slower hole transfer rate) limiting their efficiency and stability. We have previously demonstrated that p-type (inverted) QD sensitized cells have the potential to solve this problem. Here we show for the first time that electrodeposited CuSCN nanowires can be used as a p-type nanostructured electrode for p-QDSSCs. We demonstrate their efficient sensitization by heavy metal free CuInSxSe2-x quantum dots. Photophysical studies show efficient and fast hole injection from the excited QDs into the CuSCN nanowires. The transfer rate is strongly time dependent but the average rate of 2.5 × 109 s-1 is much faster than in previously studied sensitized systems based on NiO. Moreover, we have developed an original experiment allowing us to calculate independently the rates of charge injection and QD regeneration by the electrolyte and thus to determine which of these processes occurs first. The average QD regeneration rate (1.3 × 109 s-1) is in the same range as the hole injection rate, resulting in an overall balanced charge separation process. To reduce recombination in the sensitized systems and improve their stability, the CuSCN nanowires were coated with thin conformal layers of Al2O3 using atomic layer deposition (ALD) and fully characterized by XPS and EDX. We demonstrate that the alumina layer protects the surface of CuSCN nanowires, reduces charge recombination, and increases the overall charge transfer rate up to 1.5 times depending on the thickness of the deposited Al2O3 layer.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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The development of effective and stable hole transporting materials (HTMs) is very important for achieving high-performance planar perovskite solar cells (PSCs). Herein, copper salts (cuprous thiocyanate (CuSCN) or cuprous iodide (CuI)) doped 2,2,7,7-tetrakis(N,N-di-p-methoxyphenylamine)-9,9-spirobifluorene (spiro-OMeTAD) based on a solution processing as the HTM in PSCs is demonstrated. The incorporation of CuSCN (or CuI) realizes a p-type doping with efficient charge transfer complex, which results in improved film conductivity and hole mobility in spiro-OMeTAD:CuSCN (or CuI) composite films. As a result, the PCE is largely improved from 14.82% to 18.02% due to obvious enhancements in the cell parameters of short-circuit current density and fill factor. Besides the HTM role, the composite film can suppress the film aggregation and crystallization of spiro-OMeTAD films with reduced pinholes and voids, which slows down the perovskite decomposition by avoiding the moisture infiltration to some extent. The finding in this work provides a simple method to improve the efficiency and stability of planar perovskite solar cells.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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A copper-mediated oxidative dehydrosulfurative carbon-oxygen cross-coupling reaction with boric ester and six-membered cyclic thiourea for single-step production of densely substituted 2-alkoxypyrimidines incorporated in a privileged scaffold is described. This is the first demonstration of boric ester acting as an alkoxy donor in a metal-catalyzed coupling reaction to produce ether. The reaction method offers a shortcut for producing 2-alkoxypyrimidine derivatives with rapid diversification and expands the utility of boric ester and the scope of Liebeskind-Srogl-type reactions.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”

 

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Non-centrosymmetric one- to three-dimensional CuSCN-based coordination polymers with substituted pyrazine or pyrimidine spacer ligands can be prepared by self-assembly in acetonitrile solution at 100C. Both 1?[CuSCN(2NCpyz)2] (1) (2 NCpyz = 2-cyanopyrazine) and 1?[CuSCN(4 HOpym)2] (3) (4 HOpym = 4-hydroxypyrimidine) contain single zigzag CuSCN chains as their central backbone and crystallise in polar space groups (monoclinic Cm and orthorhombic Ama2). In 2?[(CuSCN)2(mu-2Mepyz)] (2) (2Mepyz = 2-methylpyrazine), 1?[(CuSCN)2] staircase double chains are connected by bridging 2 Merpyz ligands to afford a lamellar polymer (triclinic P1). Whereas 2?[CuSCN(5 Brpym)] (4) (5 Brpym = 5-bromopyrimidine) with its honeycomb 2?[CuSCN] layers is chiral (monoclinic P21), both 3D polymers 3?[(CuSCN)2(mu-pym)] (5) and 3?[(CuSCN)3(mu-4 Mepym)] (6) (4 Mepym = 4-methylpyrimidine) contain polar coordination networks (orthorhombic Fdd2 and monoclinic Pc). The CuSCN framework in (5) consists of thiocyanate bridged 1?[CuS] chains, that in 6 of interlocked 2?[CuSCN] and 2?[Cu2S(SCN)] sheets.

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Reference:
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”