Archives for Chemistry Experiments of 1111-67-7

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Delayed Annealing Treatment for High-Quality CuSCN: Exploring Its Impact on Bifacial Semitransparent n-i-p Planar Perovskite Solar Cells

Inorganic p-type copper(I) thiocyanate (CuSCN) hole-transporting material (HTM) belongs to a promising class of compounds integral for the future commercialization of perovskite solar cells (PSCs). However, deposition of high-quality CuSCN films is a challenge for fabricating n-i-p planar PSCs. Here we demonstrate pinhole-free and ultrasmooth CuSCN films with high crystallinities and uniform coverage via delayed annealing treatment at 100 C, which can effectively optimize the interfacial contact between the perovskite absorber and the electrode for efficient charge transport. A satisfactory efficiency of 13.31% is achieved from CuSCN-based n-i-p planar PSC. In addition, due to the superior transparency of p-type CuSCN HTMs, it is also possible to prepare bifacial semitransparent n-i-p planar PSCs, which eventually permits a maximum efficiency of 12.47% and 8.74% for the front and rear illumination, respectively. The low-temperature process developed in this work is also beneficial for those applications such as flexible and tandem solar cells on heat-sensitive substrates.

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

 

Extended knowledge of 1111-67-7

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Cis -1,2-Bis(diphenylphosphino)ethylene copper(i) catalyzed C-H activation and carboxylation of terminal alkynes

The reaction of cis-1,2-bis(diphenylphosphino)ethylene (dppet) with CuX (X = CN, SCN) in 1:1 M molar ratio in DCM-MeOH (50:50 V/V) under refluxing conditions gave two dimeric Cu(i) complexes, viz. [Cu2(mu-CN)2(kappa2-P,P-dppet)2] (1) and [Cu2(mu2-SCN)2(kappa2-P,P-dppet)2] (2). These complexes have been characterized by elemental analyses, IR, 1H and 31P NMR, and electronic absorption spectroscopies, and ESI-MS. The molecular structure of 2 was confirmed by single crystal X-ray diffraction, which indicated that 2 exists as a centrosymmetric dimer in which the two copper centers are bonded to two dppet ligands and two bridging thiocyanate groups in a mu2-manner. The electrochemical properties of 1 and 2 were studied by cyclic voltammetry. Both the complexes exhibited strong luminescence properties in the solution state at ambient temperature. Both the complexes were found to be efficient catalysts for the conversion of terminal alkynes into propiolic acids with CO2. Owing to their excellent catalytic activity, the reactions proceed at atmospheric pressure and ambient temperature (25 C). The catalytic products were obtained in excellent yields (90-97%) by using the complex loading of 1 mol%.

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

 

Extended knowledge of 1111-67-7

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In homogeneous catalysis, the catalyst is in the same phase as the reactant. The number of collisions between reactants and catalyst is at a maximum.In a patent, 1111-67-7, name is Cuprous thiocyanate, introducing its new discovery. category: copper-catalyst

Copper-Mediated [(Diethylphosphono)difluoromethyl]thiolation of alpha-Bromo Ketones

We report herein a straightforward access to alpha-[(diethoxyphosphoryl)difluoromethyl]thiolated ketones. The methodology, which involves the nucleophilic [Cu]CF2PO(OEt)2 species, has allowed the formation of the targeted compounds in moderate to high yields by using a simple procedure. This method represents a convenient alternative to the known approaches for the introduction of this emergent fluorinated motif.

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

 

Archives for Chemistry Experiments of Bis(acetylacetone)copper

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Luminescent dipyrrinato complexes of trivalent group 13 metal ions

Although free dipyrrins (dipyrromethenes) do not strongly luminesce, certain dipyrrinato complexes of BF2 and zinc(II) are known to be intensely luminescent species. Two new dipyrrinato fluorophores, based on complexes with gallium(III) and indium(III), are described. Using a previously described meso-mesityl-substituted dipyrrin, namely 5-mesityldipyrrin (mesdpm), the complexes [Ga(mesdpm)3] and [In(mesdpm)3] were prepared and structurally characterized. The complexes display the expected octahedral geometry about the metal ions. In some solvents, such as hexanes, the complexes emit green light upon excitation with UV light at room temperature, with quantum yields of 2.4% ([Ga(mesdpm)3]) and 7.4% ([In(mesdpm)3]) and lifetimes in the low nanosecond range. Observations are consistent with assignment to ligand-localized transitions, and this interpretation is further confirmed by density functional calculations described herein. The new complexes are important additions to the widely used family of dipyrrin-based fluorescent species and show that dipyrrinato complexes containing metals other than BF2 and zinc(II) may be useful fluorophores.

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

 

A new application about 1111-67-7

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Syntheses, structures and vibrational spectroscopy of some unusual silver(I) (pseudo-) halide/unidentate nitrogen base polymers

The meagre (structurally defined) array of 1:2 silver(I) (pseudo-)halide:unidentate nitrogen base adducts is augmented by the single-crystal X-ray structural characterization of the 1:2 silver(I) thiocyanate:piperidine (‘pip’) adduct. It is of the one-dimensional ‘castellated polymer’ type previously recorded for the chloride: ?Ag(pip) 2(mu-SCN)Ag(pip)2? a single bridging atom (S) linking successive silver atoms. By contrast, in its copper(I) counterpart, also a one-dimensional polymer, the thiocyanate bridges as end-bound SN-ambidentate: ?CuSCNCuSCN? A study of the 1:1 silver(I) bromide:quinoline (‘quin’) adduct is recorded, as the 0.25 quin solvate, isomorphous with its previous reported ‘saddle polymer’ chloride counterpart. Recrystallization of 1:1 silver(I) iodide:tris(2,4,6-trimethoxyphenyl)phosphine (‘tmpp’) mixtures from py and quinoline (‘quin’)/acetonitrile solutions has yielded crystalline materials which have also been characterized by X-ray studies. In both cases the products are salts, the cation in each being the linearly coordinated silver(I) species [Ag(tmpp)2]+, while the anions are, respectively, the discrete [Ag5I7(py)2]2- species, based on the already known but unsolvated [Cu5I 7]2- discrete, and the [Ag5I7] (?|?)2- polymeric, arrays, and polymeric [Ag5I6(quin)](?|?)-. The detailed stereochemistry of the [Ag(tmpp)2]+ cation is a remarkably constant feature of all structures, as is its tendency to close-pack in sheets normal to their P-Ag-P axes. The far-IR spectra of the above species and of several related complexes have been recorded and assigned. The vibrational modes of the single stranded polymeric AgX chains in [XAg(pip) 2](?|?) (X = Cl, SCN) are discussed, and the assignments nu(AgX) = 155, 190 cm-1 (X = Cl) and 208 cm -1 (X = SCN) are made. The nu(AgX) and nu(AgN) modes in the cubane tetramers [XAg(pip)]4 (X = Br, I) are assigned and discussed in relation to the assignments for the polymeric AgX:pip (1:2) complexes, and those for the polymeric [XAg(quin)](?|?) (X = Cl, Br) compounds. The far-IR spectra of [Ag(tmpp)2]2[Ag 5I7(py)2] and its corresponding 2-methylpyridine complex show a single strong band at about 420 cm-1 which is assigned to the coordinated tmpp ligand in [Ag(tmpp)2] +, and a partially resolved triplet at about 90, 110 and 140 cm -1 which is assigned to the nu(AgI) modes of the [Ag 5I7L2]2- anion. An analysis of this pattern is given using a model which has been used previously to account for unexpectedly simple nu(CuI) spectra for oligomeric iodocuprate(I) species.

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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 role of short-range diffusion in solvent-assisted mechanochemical synthesis of metal complexes

The role of short-range diffusion in solvent-assisted mechanochemical synthesis is demonstrated in studies of a polymorphic transition and a ligand dissociation reaction involving copper(i) thiocyanate complexes. The Royal Society of Chemistry.

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

 

More research is needed about Bis(acetylacetone)copper

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Phosphate-free synthesis, optical absorption and photoelectric properties of Cu2ZnGeS4 and Cu2ZnGeSe4 uniform nanocrystals

Copper-based quaternary chalcogenide semiconductor Cu2ZnGeS 4 and Cu2ZnGeSe4 nanocrystals have been synthesized successfully via a simple and convenient one-pot phosphine-free solution approach. Oleylamine was used as both the solvent and reductant for Se or S and benefited the formation of homogeneous quaternary nanocrystals. Scanning transmission electron microscopy-EDS elemental mapping confirms the uniform spatial distribution of four elements in nanocrystals. UV-Vis absorption spectra of Cu2ZnGeS4 and Cu2ZnGeSe4 nanocrystals show strong photon absorption in the entire visible range. The photoresponsive behavior indicates the potential application of Cu 2ZnGeSe4 nanocrystals in solar energy conversion systems.

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

 

Discovery of Cuprous thiocyanate

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Related Products of 1111-67-7, Catalysts function by providing an alternate reaction mechanism that has a lower activation energy than would be found in the absence of the catalyst. In some cases, the catalyzed mechanism may include additional steps.In a article, 1111-67-7, molcular formula is CCuNS, introducing its new discovery.

Synthesis and structural characterization of five copper(I) complexes of[2,3-f]-pyrazino-[1,10]phenanthroline-2,3-dicarbonitrile and triphenylp hosphine

Five new copper(I) complexes containing PPh3 and C 16H6N6, [Cu(PPh3)(C 16H6N6)Cl]?H2O (1), [Cu(PPh3)(C16H6N6)Br]?CH 3CN (2),[Cu(PPh3)(C16H6N 6)I]? CH3CN (3), [Cu(PPh3)(C 16H6N6)(CN)]?0.5 CH2Cl 2 (4) and Cu(PPh3)(C16H6N 6)(SCN) (5) {PPh3 = triphenylphosphine, C 16H6N6 = [2,3-f]-pyrazino-[1,10] phenanthroline-2,3-dicarbonitrile} have been synthesized for the first time. These complexes are obtained by the reactions of CuX (X = Cl, Br, I, CN, SCN) with the bidentate ligand C16H6N6 and the monodentate ligand PPh3 in the molar ratio of 1:1:1 in the mixed solvent of CH2Cl2 and CH3CN(5 ml/5 ml). They are characterized by X-ray crystallography, luminescence, IR, 1H NMR and 31P NMR. In solid state the complexes 1-5 are mononuclear with similar structures, but in solution they have different structures according to their different 1H NMR signals. All the complexes exhibit intense luminescence in solid state at room temperature.

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

 

Brief introduction of Cuprous thiocyanate

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2-Picolinic acid and benzoic acid from di-2-pyridyl ketone and acetophenone: A case of two copper catalysed Baeyer-Villiger rearrangements?

The synthesis and crystal structure elucidation of two novel polymeric copper(II) complexes has led us to propose a mechanism for the formation of 2-picolinic acid (pic) from di-2-pyridyl ketone (dpk) and benzoic acid from acetophenone. During studies into the interaction of copper ions with the dpk-acetophenone system, two complexes Na2(NCS)2(H 2O)[Cu(pic)2] (1) and Na2(H2O) 2[Cu(pic)2(NCS)2] (2) which contain pic coordinated to copper were isolated. The occurrence of (1) and (2) has led us to consider the Baeyer-Villiger rearrangement as a possible mechanism for the formation of (1) and (2).

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

 

More research is needed about 1317-39-1

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Process for preparing aminobenzocyclobutenes

A process for preparing a 3- or 4-aminobenzocyclobutene comprises aminating a 3- or 4-halo- or sulfonyloxybenzocyclobutene reactant with an aminating agent by heating at a temperature from about 80 C. to a temperature at which dimerization or oligomerization of a benzocyclobutene reactant or product is a significant side reaction, in the presence of a metal-containing catalyst, for a time sufficient to aminate the halo- or sulfonyloxybenzocyclobutene reactant. In another aspect, this invention relates to a process for making a 3- or 4-phthalimido- or maleimidobenzocyclobutene, comprising reacting a 3- or 4-halobenzocyclobutene reactant with a phthalimide or maleimide compound in the presence of a metal-containing catalyst. The resulting phthalimido- or maleimidobenzocyclobutene can be hydrolyzed to a 3- or 4-aminobenzocyclobutene.

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