Archives for Chemistry Experiments of Cuprous thiocyanate

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Copper-Catalyzed Cross-Coupling of Silicon Pronucleophiles with Unactivated Alkyl Electrophiles Coupled with Radical Cyclization

A copper-catalyzed C(sp3)-Si cross-coupling of aliphatic C(sp3)-I electrophiles using a Si-B reagent as the silicon pronucleophile is reported. The reaction involves an alkyl radical intermediate that also engages in 5-exo-trig ring closures onto pendant alkenes prior to the terminating C(sp3)-Si bond formation. Several Ueno-Stork-type precursors cyclized with excellent diastereocontrol in good yields. The base-mediated release of the silicon nucleophile and the copper-catalyzed radical process are analyzed by quantum-chemical calculations, leading to a full mechanistic picture.

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

 

Awesome Chemistry Experiments For Cuprous thiocyanate

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All-solution-processed high-performance quantum dot light emitting devices employing an inorganic thiocyanate as hole injection layer

We report here the all-solution-processed, high-efficiency quantum dot light emitting diode (QLED) employing inorganic copper (I) thiocyanate (CuSCN) as hole injection layer. In comparison with the widely used injection material of poly(3,4-ethylenedioxythiophene): poly(styrene sulfonate) (PEDOT:PSS), the hole injection into the QD layer is significantly improved, allowing low turn-on voltage, high luminance and efficiency. By optimizing the multilayer structure and synergistically balancing the carrier injection, the resulting QLEDs exhibit high performance with the maximum current efficiency of 52.4 cd/A and external quantum efficiency of 12.0% for green device, 17.0 cd/A and 16.2% for red device. These results indicate that CuSCN is a reliable hole transport materials for low-cost, high-efficiency QLED devices.

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

 

More research is needed about 1111-67-7

Sometimes chemists are able to propose two or more mechanisms that are consistent with the available data. Computed Properties of CCuNS, If a proposed mechanism predicts the wrong experimental rate law, however, the mechanism must be incorrect.Welcome to check out more blogs about 1111-67-7, in my other articles.

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Synthesis of 1D {Cu6(mu3-SC3H 6N2)4(mu-SC3H6N 2)2(mu-I)2I4}n and 3D {Cu2(mu-SC3H6N2) 2(mu-SCN)2}n polymers with 1,3-imidazolidine-2-thione: Bond isomerism in polymers

The reaction of copper(I) iodide with 1, 3-imidazolidine-2-thione (SC 3H6N2) in a 1:2 molar ratio (M/L) has formed unusual 1D polymers, {Cu6(mu3-SC3H 6N2)4(mu-SC3H6N 2)2(mu-I)2I4}n (1) and {Cu6(mu3-SC3H6N2) 2(mu-SC3H6N2)4(mu-I) 4I2}n (1a). A similar reaction with copper(I) bromide has formed a polymer {Cu6(mu3-SC 3H6N2)2(mu-SC3H 6N2)4(mu-Br)4Br2} n (3a), similar to 1a, along with a dimer, {Cu2(mu- SC3H6N2)2(eta1-SC 3H6N2)2Br2} (3). Copper(I) chloride behaved differently, and only an unsymmetrical dimer, {Cu2(mu-SC3H6N2) (eta1-SC3H6N2)3Cl 2} (4), was formed. Finally, reactions of copper-(I) thiocyanate in 1:1 or 1:2 molar ratios yielded a 3D polymer, {Cu2(mu-SC 3H6N2)2(mu-SCN)2} n (2). Crystal data: 1, C9H18Cu 3I3N6S3, triclinic, P1, a = 9.6646(11) A, b = 10.5520(13) A, c = 12.6177(15) A, alpha = 107.239(2), beta = 99.844(2), gamma = 113.682(2), V = 1061.8(2) A3, Z = 2, R = 0.0333; 2, C4H 6CuN3S2, monoclinic, P21/c, a = 7.864(3) A, b = 14.328(6) A, c = 6.737(2) A, beta = 100.07(3), V = 747.4(5), Z = 4, R = 0.0363; 3, C12H 24Br2Cu2N8S4, monoclinic, C2/c, a = 19.420(7) A, b = 7.686(3) A, c = 16.706(6) A, beta = 115.844(6), V = 2244.1(14) A3, Z = 4, R = 0.0228; 4, C12H24Cl2Cu2N8S 4, monoclinic, P21/c, a = 7,4500(6) A, b = 18.4965(15) A, c = 16.2131(14) A, beta = 95.036(2), V = 2225.5(3) A3, Z = 4, R = 0.0392. The 3D polymer 2 exhibits 20-membered metallacyclic rings in its structure, while synthesis of linear polymers; 1 and 1a, represents an unusual example of I (1a)-S (1) bond isomerism.

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

 

More research is needed about Cuprous thiocyanate

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Synthesis, structural and spectroscopic study of polymeric copper(I) thiocyanato complexes [Cu(NCS)L](n) (L = methyl nicotinate and ethyl nicotinate) and [HL] [Cu(NCS)2] (HL = H-ethyl isonicotinate)

Three new copper(I) thiocyanato complexes [Cu(NCS)L](n) (L = methyl nicotinate 1, ethyl nicotinate 2), and [HL] [Cu(NCS)2] (HL = H-ethyl isonicotinate 3), have been prepared and characterized by spectroscopic and crystallographic methods. All three complexes display MLCT transitions in the visible region, as well as visible solid state emission spectra at room temperature. Their IR spectra are measured and discussed. In the structure of 1 each copper atom links two S atoms from two mu-S,S,N thiocyanato ligands and two nitrogen atoms from a pyridine nucleus and from a third mu-S,S,N thiocyanate group; the two S atoms bind another copper atom forming a Cu2S2 cyclic unit. The ladder propagates along the a axis of the unit cell. The structure of 2 features CuS2N2 coordination with approximate tetrahedral environment, mu-S,S,N bridging thiocyanate groups giving rise to corrugated layers at y = 1/4. Complex 3 consists of an N-protonated ethyl isonicotinate cation and a polymeric [Cu(NCS)2]- anion. Each trigonal planar copper atom in the anion is coordinated by two S atoms from a mu-S,N thiocyanate bridge and a terminal S-thiocyanate group, and the third site is occupied by the end nitrogen of a mu-S,N thiocyanate bridge. The terminal NCS group forms a hydrogen bond of the type N-H¡¤¡¤¡¤N with an N-H group of the [HL]+ cation. The planar ribbon which runs in the a direction is further stabilized by N-H¡¤¡¤¡¤O hydrogen bonds. (C) 2000 Elsevier Science Ltd.

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

 

Can You Really Do Chemisty Experiments About 1111-67-7

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Electrochemical self-assembly of CuSCN-DAST hybrid thin films

Abstract: Nanostructured inorganic?organic hybrid thin films of copper(I) thiocyanate (CuSCN) and 4-(N,N-dimethylamino)-4?-(N?-methyl)stilbazolium tosylate (DAST) were electrochemically self-assembled by adding DAST into methanolic bath containing Cu2+ and SCN? ions. Loading of the stilbazolium organic chromophore (DAS+) increased linearly on increasing DAST concentration, accompanied with changes of the film morphology, crystallographic orientation of CuSCN and transition from beta- to alpha-CuSCN. At low DAST concentrations, transport limited passive occlusion of DAS+ has been suggested with its diffusion coefficient of 1.25?¡Á?10?6 cm2?s?1 in methanol at 298?K, while the loading receives kinetic limitation by the surface chemical reaction to yield definitive hybrid structures, resulting in unique ?hair comb? shape beta-CuSCN-DAST and ?nano-platelets? shape alpha-CuSCN-DAST hybrid structures. Both the inorganic and organic components are interconnected and bi-continuous, as the loaded DAS+ could be totally extracted by dimethylacetamide to leave porous skeleton of crystalline CuSCN, making them highly interesting for device applications. Graphical abstract: [Figure not available: see fulltext.]

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

 

The important role of 1111-67-7

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Progress in Materials Development for the Rapid Efficiency Advancement of Perovskite Solar Cells

The efficiency of perovskite solar cells (PSCs) has undergone rapid advancement due to great progress in materials development over the past decade and is under extensive study. Despite the significant challenges (e.g., recombination and hysteresis), both the single-junction and tandem cells have gradually approached the theoretical efficiency limit. Herein, an overview is given of how passivation and crystallization reduce recombination and thus improve the device performance; how the materials of dominant layers (hole transporting layer (HTL), electron transporting layer (ETL), and absorber layer) affect the quality and optoelectronic properties of single-junction PSCs; and how the materials development contributes to rapid efficiency enhancement of perovskite/Si tandem devices with monolithic and mechanically stacked configurations. The interface optimization, novel materials development, mixture strategy, and bandgap tuning are reviewed and analyzed. This is a review of the major factors determining efficiency, and how further improvements can be made on the performance of PSCs.

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

 

A new application about Cuprous thiocyanate

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A VERSATILE SYNTHETIC ROUTE TO SUBSTITUTED THIANTHRENES

2,7-Dinitrothianthrene has been prepared by the base-catalyzed cyclization of 2-chloro-5-nitrobenzenethiol and proves to be a versatile starting point for the preparation of several 2,7-disubstituted thianthrenes, both symmetrically and unsymmetrically substituted.

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

 

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A Potential Hybrid Hole-Transport Material Incorporating a Redox-Active Tetrathiafulvalene Derivative with CuSCN

Inorganic CuSCN and organic tetrathiafulvalene derivatives (TTFs) have been exploited as hole-transport materials (HTM) in hybrid perovskite solar cells. To develop new HTM, we herein report two hybrid materials incorporating redox-active TTFs with CuSCN framework (TTFs-CuSCN). Single-crystal analysis showed that compound [Cu2(py-TTF-py)(SCN)2] (1) is three-dimensional (3D) and compound [Cu(py-TTF-py)(SCN)] (2) is two-dimensional (2D) (py-TTF-py = 2,6-bis(4?-pyridyl)tetrathiafulvalene). There are covalent coordination interactions between CuSCN and py-TTF-py and short S¡¤¡¤¡¤S contacts between the py-TTF-py ligands for both compounds. Besides, C¡¤¡¤¡¤S contacts exist between py-TTF-py ligands of the neighboring 2D networks in 2, which facilitate the charge transfer and supply efficient multidimensional pathways for carrier migration. As a result, 2 presented better semiconductor performance in comparison with that of 1. The performance of 2 related to the HTMs could be significantly improved by modulating the electronic state of the TTFs-CuSCN framework via oxidative doping. The iodine-doped 2D material (2-I2) gives the most excellent conductivity and carrier mobility, which might be a potential new HTM.

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

 

Properties and Exciting Facts About Cuprous thiocyanate

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Synthesis, Crystal Structure and Chemical Reactivity of Dichloro(thiosemicarbazide)copper(II)

The structure of dichloro(thiosemicarbazide)copper(II), , has been determined by X-ray crystallography.Contrary to earlier proposals the compound is found to be monomeric.Electron spin resonance studies of the compound both as a polycrystalline solid and in dimethylformamide solution are also in accordance with a monomeric structure.The reactivity of towards some Lewis bases such as imidazole, 2,2′-bipyridyl etc. has also been studied.

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

 

Extracurricular laboratory:new discovery of Cuprous thiocyanate

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In heterogeneous catalysis, the catalyst is in a different phase from the reactants. Formula: CCuNS, At least one of the reactants interacts with the solid surface in a physical process called adsorption in such a way. 1111-67-7, name is Cuprous thiocyanate. In an article£¬Which mentioned a new discovery about 1111-67-7

Synthetic, spectral, structural and catalytic activity of infinite 3-D and 2-D copper(ii) coordination polymers for substrate size-dependent catalysis for CO2 conversion

Two copper(ii) coordination polymers, viz. [Cu2(OAc)4(mu4-hmt)0.5]n (1) and [Cu{C6H4(COO-)2}2]n¡¤2C9H14N3 (2), have been synthesized solvothermally and characterized. The solid-state structure reveals that 1 is an infinite three-dimensional (3D) motif with fused hexagonal rings consisting of Cu(ii) and hmt in a mu4-bridging mode, while 2 is an infinite two dimensional (2D) motif containing Pht-2 in a mu1-bridging mode. CP 1 has a two-fold interpenetrated diamondoid network composed of 4-connected sqc6 topology with the point symbol of {66}, while 2 has a Shubnikov tetragonal plane network possessing a 4-connected node with an sql topology with a point symbol of {44¡¤.62}-VS [4¡¤4¡¤4¡¤4¡¤?¡¤?]. Both CPs 1 and 2 serve as efficient catalysts for CO2-based chemical fixation. Moreover, 1 demonstrates one of the highest reported catalytic activity values (%yield) among Cu-based MOFs for the chemical fixation of CO2 with epoxides. 1 shows high efficiency for CO2 cycloaddition with small epoxides but its catalytic activity decreases sharply with the increase in the size of epoxide substrates. The catalytic results suggested that the copper(ii) motif-catalyzed CO2 cycloaddition of small substrates had been carried out within the framework, while large substrates could not enter into the framework for catalytic reactions. The high efficiency and size-dependent selectivity toward small epoxides on catalytic CO2 cycloaddition make 1 a promising heterogeneous catalyst for carbon fixation and it can be used as a recoverable stable heterogeneous catalyst without any loss of performance. The solvent-free synthesis of the cyclic carbonate from CO2 and an epoxide was monitored by in situ FT-IR spectroscopy and an exposed Lewis-acid metal site catalysis mechanism was proposed.

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