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C is rhombohedral graphite-like structured and crystallizes in the hexagonal P6/mmm space group. The structure is two-dimensional and consists of one C sheet oriented in the (0, 0, 1) direction. C is bonded in a trigonal planar geometry to three equivalent C atoms. All C–C bond lengths are 1.43 Å.
C is rhombohedral graphite-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of two C sheets oriented in the (0, 0, 1) direction. C is bonded in a trigonal planar geometry to three equivalent C atoms. All C–C bond lengths are 1.42 Å.
C is rhombohedral graphite-like structured and crystallizes in the hexagonal P6/mmm space group. The structure is two-dimensional and consists of one C sheet oriented in the (0, 0, 1) direction. C is bonded in a trigonal planar geometry to three equivalent C atoms. All C–C bond lengths are 1.42 Å.
C is Graphite structured and crystallizes in the orthorhombic Cmme space group. The structure is two-dimensional and consists of two C sheets oriented in the (0, 0, 1) direction. C is bonded in a trigonal planar geometry to three equivalent C atoms. There is two shorter (1.42 Å) and one longer (1.43 Å) C–C bond length.
C crystallizes in the tetragonal I4/mmm space group. The structure is two-dimensional and consists of two C sheets oriented in the (0, 0, 1) direction. C is bonded in a square co-planar geometry to four equivalent C atoms. All C–C bond lengths are 1.62 Å.
C crystallizes in the orthorhombic Cmcm space group. The structure is two-dimensional and consists of two C sheets oriented in the (0, 0, 1) direction. C is bonded in a square co-planar geometry to four equivalent C atoms. All C–C bond lengths are 1.63 Å.
C crystallizes in the orthorhombic Cmcm space group. The structure is two-dimensional and consists of two C sheets oriented in the (0, 0, 1) direction. C is bonded in a square co-planar geometry to four equivalent C atoms. All C–C bond lengths are 1.61 Å.
C crystallizes in the monoclinic P2/m space group. The structure is one-dimensional and consists of one C ribbon oriented in the (1, 0, 0) direction. C is bonded in a linear geometry to two equivalent C atoms. Both C–C bond lengths are 1.28 Å.
Aluminum doping can improve the phase stability of metastable compound Sm 2 Fe 17 C x with a high carbon content (x > 1.5). We investigated the preferential site substitution of Al, chemical bonding, and structural stability in Sm 2 (Fe,Al) 17 C 3 using first-principle calculations. Our results reveal a strong correlation between the preferential substitution of Fe by Al and the atomic site chemical environment, which affects the overall phase stability. Specifically, Al preferentially occupies the 9d site in Sm 2 (Fe,Al) 17 C 3 . At the same time, Al prefers the site 6c in its parent phase Sm 2 (Fe,Al) 17 . Partial replacement of Fe with Al leads to a more negative formation energy, indicating enhanced thermodynamic stability. Crystal Orbital Hamilton Population (COHP) and Crystal Orbital Bond Index (COBI) analysis suggest that insertion of carbon weakens the bonding strength of Sm-Fe (18f) and Sm-Fe (18h), resulting in metastability of Sm 2 Fe 17 C x . Doping Al strengthens Al-Fe, Al-Sm, Sm-Fe (18f, 18h) and Fe–C bonding in Sm 2 (Fe,Al) 17 C 3 , as revealed by calculated COHP and COBI. These effects contribute to improved phase stability in the Al-doped 2:17 interstitial compound.
Abstract C−H amination and amidation by catalytic nitrene transfer are well‐established and typically proceed via electrophilic attack of nitrenoid intermediates. In contrast, the insertion of (formal) terminal nitride ligands into C−H bonds is much less developed and catalytic nitrogen atom transfer remains unknown. We here report the synthesis of a formal terminal nitride complex of palladium. Photocrystallographic, magnetic, and computational characterization support the assignment as an authentic metallonitrene (Pd−N) with a diradical nitrogen ligand that is singly bonded to Pd II . Despite the subvalent nitrene character, selective C−H insertion with aldehydes follows nucleophilic selectivity. Transamidation of the benzamide product is enabled by reaction with N 3 SiMe 3 . Based on these results, a photocatalytic protocol for aldehyde C−H trimethylsilylamidation was developed that exhibits inverted, nucleophilic selectivity as compared to typical nitrene transfer catalysis. This first example of catalytic C−H nitrogen atom transfer offers facile access to primary amides after deprotection.
Abstract UV irradiation of solutions of a guanidinate coordinated dimagnesium(I) compound, [{(Priso)Mg} 2 ] 3 (Priso=[(DipN) 2 CNPr i 2 ] − , Dip=2,6‐diisopropylphenyl), in either benzene, toluene, the three isomers of xylene, or mesitylene, leads to facile activation of an aromatic C−H bond of the solvent in all cases, and formation of aryl/hydride bridged magnesium(II) products, [{(Priso)Mg} 2 (μ‐H)(μ‐Ar)] 4 – 9 . In contrast to similar reactions reported for β‐diketiminate coordinated counterparts of 3 , these C−H activations proceed with little regioselectivity, though they are considerably faster. Reaction of 3 with an excess of the pyridine, p ‐NC 5 H 4 Bu t (py Bu t ), gave [(Priso)Mg(py Bu t H)(py Bu t ) 2 ] 10 , presumably via reduction of the pyridine to yield a radical intermediate, [(Priso)Mg(py Bu t ⋅)(py Bu t ) 2 ] 11 , which then abstracts a proton from the reaction solvent or a reactant. DFT calculations suggest two possible pathways to the observed arene C−H activations. One of these involves photochemical cleavage of the Mg−Mg bond of 3 , generating magnesium(I) doublet radicals, (Priso)Mg⋅. These then doubly reduce the arene substrate to give “Birch‐like” products, which subsequently rearrange via C−H activation of the arene. Circumstantial evidence for the photochemical generation of transient magnesium radical species includes the fact that irradiation of a cyclohexane solution of 3 leads to an intramolecular aliphatic C−H activation process and formation of an alkyl‐bridged magnesium(II) species, [{Mg(μ‐Priso −H )} 2 ] 12 . Furthermore, irradiation of a 1 : 1 mixture of 3 and the β‐diketiminato dimagnesium(I) compound, [{( Dip Nacnac)Mg} 2 ] ( Dip Nacnac=[HC(MeCNDip) 2 ] − ), effects a “scrambling” reaction, and the near quantitative formation of an unsymmetrical dimagnesium(I) compound, [(Priso)Mg−Mg( Dip Nacnac)] 13 . Finally, the EPR spectrum (77 K) of a glassed solution of UV irradiated 3 is dominated by a broad featureless signal, indicating the presence of a doublet radical species.
We present measurements of the first to fourth moments of the lepton mass squared $q$ 2 of $B$ → $X_cℓ\overline{ν}_ℓ$ decays for $ℓ = e, μ$ and with $X_c$ a hadronic system containing a charm quark. These results use a sample of electron-positron collisions at the $Υ$($4S$) resonance corresponding to 62.8 fb -1 of integrated luminosity and collected by the Belle II 2 experiment in 2019 and 2020. To identify the $X_c$ system and reconstruct $q$ 2 , one of the $B$ mesons from an $Υ$($4S$) → $B\overline{B}$ decay is fully reconstructed in a hadronic decay mode using a multivariate $B$ tagging algorithm. We report raw and central moments for $q$ 2 > 1.5 $GeV$ 2 =$c$ 4 up to $q$ 2 > 8.5 $GeV$ 2 =$c$ 4 , probing up to 77% of the accessible $B$ → $X_cℓ\overline{ν}_ℓ$ phase space. This is the first measurement of moments in the experimentally challenging range of [1.5; 2.5] $GeV$ 2 =$c$ 4 . The results can be used for a new determination of |$V_{cb}$| using inclusive $B$ → $X_cℓ\overline{ν}_ℓ$ decays.
We report a measurement of decay-time-dependent charge-parity ( C P ) asymmetries in B 0 → K S 0 K S 0 K S 0 decays. We use 387 × 10 6 B B ¯ pairs collected at the ϒ ( 4 S ) resonance with the Belle II detector at the SuperKEKB asymmetric-energy electron-positron collider. We reconstruct 220 signal events and extract the C P -violating parameters S and C from a fit to the distribution of the decay-time difference between the two B mesons. The resulting confidence region is consistent with previous measurements in B 0 → K S 0 K S 0 K S 0 and B 0 → ( c c ¯ ) K 0 decays and with predictions based on the standard model. Published by the American Physical Society 2024
Abstract. Highly oxygenated organic molecules (HOMs) contribute substantially to the formation and growth of atmospheric aerosol particles, which affect air quality, human health and Earth's climate. HOMs are formed by rapid, gas-phase autoxidation of volatile organic compounds (VOCs) such as α-pinene, the most abundant monoterpene in the atmosphere. Due to their abundance and low volatility, HOMs can play an important role in new-particle formation (NPF) and the early growth of atmospheric aerosols, even without any further assistance of other low-volatility compounds such as sulfuric acid. Both the autoxidation reaction forming HOMs and their NPF rates are expected to be strongly dependent on temperature. However, experimental data on both effects are limited. Dedicated experiments were performed at the CLOUD (Cosmics Leaving OUtdoor Droplets) chamber at CERN to address this question. In this study, we show that a decrease in temperature (from +25 to -50°C) results in a reduced HOM yield and reduced oxidation state of the products, whereas the NPF rates (J1.7 nm) increase substantially. Measurements with two different chemical ionization mass spectrometers (using nitrate and protonated water as reagent ion, respectively) provide the molecular composition of the gaseous oxidation products, and a two-dimensional volatility basis set (2D VBS) model provides their volatility distribution. The HOM yield decreases with temperature from 6.2 % at 25°C to 0.7 % at -50°C. However, there is a strong reduction of the saturation vapor pressure of each oxidation state as the temperature is reduced. Overall, the reduction in volatility with temperature leads to an increase in the nucleation rates by up to 3 orders of magnitude at -50°C compared with 25°C. In addition, the enhancement of the nucleation rates by ions decreases with decreasing temperature, since the neutral molecular clusters have increased stability against evaporation. The resulting data quantify how the interplay between the temperature-dependent oxidation pathways and the associated vapor pressures affect biogenic NPF at the molecular level. Our measurements, therefore, improve our understanding of pure biogenic NPF for a wide range of tropospheric temperatures and precursor concentrations.
Using ( 27.12 ± 0.14 ) × 10 8 ψ ( 3686 ) events collected with the BESIII detector, we present the first observation of the decays χ c J → Λ Λ ¯ ω , where J = 0 , 1, 2, with statistical significances of 11.7 σ , 11.2 σ , and 11.8 σ . The branching fractions of these decays are determined to be B ( χ c 0 → Λ Λ ¯ ω ) = ( 2.37 ± 0.22 ± 0.25 ) × 10 − 4 , B ( χ c 1 → Λ Λ ¯ ω ) = ( 1.01 ± 0.10 ± 0.11 ) × 10 − 4 , and B ( χ c 2 → Λ Λ ¯ ω ) = ( 1.40 ± 0.13 ± 0.17 ) × 10 − 4 , where the first uncertainties are statistical and the second are systematic. We observe no clear intermediate structures. Published by the American Physical Society 2024
Using 10.1 fb − 1 of e + e − collision data collected by the BESIII detector with center-of-mass energies between 4.15 GeV and 4.30 GeV, we search for the decays X ( 3872 ) → π 0 π 0 χ c 1 , 2 , where the X ( 3872 ) is produced in e + e − → γ X ( 3872 ) . No evidence above 3 σ is found for either decay. Upper limits at the 90% CL on the branching fractions of X ( 3872 ) → π 0 π 0 χ c 1 , 2 normalized to the branching fraction of X ( 3872 ) → π + π − J / ψ are set to be B ( X ( 3872 ) → π 0 π 0 χ c 1 ) / B ( X ( 3872 ) → π + π − J / ψ ) < 1.1 and B ( X ( 3872 ) → π 0 π 0 χ c 2 ) / B ( X ( 3872 ) → π + π − J / ψ ) < 0.5 , taking into account both statistical and systematic uncertainties. Published by the American Physical Society 2024
Based on 368.5 p b − 1 of e + e − collision data collected at center-of-mass energies 4.914 and 4.946 GeV by the BESIII detector, the e + e − → ϕ χ c 1 ( 3872 ) process is searched for the first time. No significant signal is observed and the upper limits at the 90% confidence level on the product of the Born cross section σ ( e + e − → ϕ χ c 1 ( 3872 ) ) and the branching fraction B [ χ c 1 ( 3872 ) → π + π − J / ψ ] at 4.914 and 4.946 GeV are set to be 0.85 and 0.96 pb, respectively. These measurements provide useful information for the production of the χ c 1 ( 3872 ) at e + e − colliders and deepen our understanding about the nature of this particle. Published by the American Physical Society 2024
A measurement of time-dependent C P violation in the decays of B 0 and B ¯ 0 mesons to the final states J / ψ ( → μ + μ − ) K S 0 , ψ ( 2 S ) ( → μ + μ − ) K S 0 and J / ψ ( → e + e − ) K S 0 with K S 0 → π + π − is presented. The data correspond to an integrated luminosity of 6 fb − 1 collected at a center-of-mass energy of s = 13 TeV with the LHCb detector. The C P -violation parameters are measured to be S ψ K S 0 = 0.717 ± 0.013 ( stat ) ± 0.008 ( syst ) and C ψ K S 0 = 0.008 ± 0.012 ( stat ) ± 0.003 ( syst ) . This measurement of S ψ K S 0 represents the most precise single measurement of the CKM angle β to date and is more precise than the current world average. In addition, measurements of the C P -violation parameters of the individual channels are reported and a combination with the LHCb Run 1 measurements is performed. © 2024 CERN, for the LHCb Collaboration 2024 CERN