Chemical Composition and Crystal Structure of Kenoargentotetrahedrite-(Fe), Ag₆Cu₄Fe₂Sb₄S₁₂, from the Bajiazi Pb-Zn Deposit, Liaoning, China

Kenoargentotetrahedrite-(Fe) is observed as greenish-grey anhedral grains, 50–150 μm in size, in association with galena, sphalerite and chalcopyrite in the Bajiazi Pb-Zn deposit of magmatic-hydrothermal type, Liaoning, China. The empirical formula from electron microprobe analyses is Ag5.50Cu4.17Fe1.75Zn0.31Sb3.96As0.04S12.08, corresponding to the ideal formula Ag6Cu4Fe2Sb4S12. The crystal structure of kenoargentotetrahedrite-(Fe) has been determined and refined by single-crystal X-ray diffraction with R1 = 0.0192 for 1866 (404 unique) reflections. It is cubic, space group I4¯3m with unit cell parameters a = 10.4928(2) Å, V = 1155.26(7) Å3 and Z = 2. The structure of kenoargentotetrahedrite-(Fe) is characterized by a poor occupancy of 0.05 of the octahedral S(2) site with the S(2)-M(2) bonding length of 1.9994(8) Å. The six Ag atoms at M(2) around S(2) form an octahedron cluster (Ag6)4+ with the valence state of +4 and Ag-Ag distance of 2.8276(1) Å. The structure is identical to that by Rozhdestvenskaya et al., being composed of a collapsed sodalite-like framework of corner-connected M(1)S4 tetrahedron forming cages containing M(2)6-octahedron cluster, encircled by four SbS3 trigonal pyramids. It is related to the tetrahedrite group minerals with the existence of the (Ag6)4+ cluster replacing the S(2)-centered Ag6 octahedron according to the substitution mechanism 6M(2)Ag+ + S(2)S2−=M(2)(Ag6)4+ + S(2) S

Chemical Composition and Crystal Structure of Kenoargentotetrahedrite-(Fe), Ag6Cu4Fe2Sb4S12, from the Bajiazi Pb-Zn Deposit, Liaoning, China

Kenoargentotetrahedrite-(Fe) is observed as greenish-grey anhedral grains, 50–150 μm in size, in association with galena, sphalerite and chalcopyrite in the Bajiazi Pb-Zn deposit of magmatic-hydrothermal type, Liaoning, China. The empirical formula from electron microprobe analyses is Ag5.50Cu4.17Fe1.75Zn0.31Sb3.96As0.04S12.08, corresponding to the ideal formula Ag6Cu4Fe2Sb4S12. The crystal structure of kenoargentotetrahedrite-(Fe) has been determined and refined by single-crystal X-ray diffraction with R1 = 0.0192 for 1866 (404 unique) reflections. It is cubic, space group I4¯3m with unit cell parameters a = 10.4928(2) Å, V = 1155.26(7) Å3 and Z = 2. The structure of kenoargentotetrahedrite-(Fe) is characterized by a poor occupancy of 0.05 of the octahedral S(2) site with the S(2)-M(2) bonding length of 1.9994(8) Å. The six Ag atoms at M(2) around S(2) form an octahedron cluster (Ag6)4+ with the valence state of +4 and Ag-Ag distance of 2.8276(1) Å. The structure is identical to that by Rozhdestvenskaya et al., being composed of a collapsed sodalite-like framework of corner-connected M(1)S4 tetrahedron forming cages containing M(2)6-octahedron cluster, encircled by four SbS3 trigonal pyramids. It is related to the tetrahedrite group minerals with the existence of the (Ag6)4+ cluster replacing the S(2)-centered Ag6 octahedron according to the substitution mechanism 6M(2)Ag+ + S(2)S2−=M(2)(Ag6)4+ + S(2) S

The Crystal Structure of Bornite Cu₅FeS₄: Ordered Fe and Split Cu

The crystal structure of bornite with ideal formula Cu5FeS4 from the Saishitang skarn copper deposit in Qinghai Province, along with bornite from the Yushui spouting hydrothermal copper deposit in Guangdong Province and the Bofang sandstone copper deposit in Hunan Province, has been refined by single-crystal X-ray diffraction with R1 = 0.0259–0.0483 (I > 2σ) and 0.0338–0.1067 for 2732 to 3273 unique reflections. As represented by the Saishitang sample, it is orthorhombic with a Pbca space group and unit cell parameters a = 10.97016(18) Å, b = 21.8803(4) Å, c = 10.9637(2) Å, V = 2631.61(8) Å3 and Z = 16. The structure is composed of sulfur layers parallel to the (0 1 0) lattice plane with interstices occupied by metal atoms. The Fe atoms occupy two tetrahedral sites with full occupancy, but the Cu atoms are all partially distributed over 20 paired sites, split from 10 sites with a distance ranging from 0.24 Å to 0.54 Å. The Fe-S tetrahedra are not split with Fe-S lengths from 2.2609 Å to 2.3286 Å (average 2.2997 Å). The Cu-S lengths in pyramidal triangles are from 2.218 Å to 2.397 Å (average 2.288 Å), whereas the Cu-S tetrahedra are strongly distorted, with great variations in Cu-S lengths from 2.224 Å to 2.604 Å (average 2.391 Å). The orthorhombic unit cell is stacked from 16 1a-type (5.5 Å) cubes; each cube has one tetrahedrally-coordinated Fe atom, five split from 3- to 4-coordinated Cu atoms, and two vacancies, i.e., 5CuIII–IV+FeIV+2[]+4S. The phenomenon of site-splitting of Cu atoms may provide for a more accurate structure of bornite, allowing for a better understanding of its magnetic properties and ore-formation conditions

Discovery of Potent and Orally Bioavailable Dihydropyrazole GPR40 Agonists

G protein-coupled receptor 40 (GPR40) has become an attractive target for the treatment of diabetes since it was shown clinically to promote glucose-stimulated insulin secretion. Herein, we report our efforts to develop highly selective and potent GPR40 agonists with a dual mechanism of action, promoting both glucose-dependent insulin and incretin secretion. Employing strategies to increase polarity and the ratio of sp³/sp² character of the chemotype, we identified BMS-986118 (compound <b>4</b>), which showed potent and selective GPR40 agonist activity <i>in vitro</i>. <i>In vivo</i>, compound <b>4</b> demonstrated insulinotropic efficacy and GLP-1 secretory effects resulting in improved glucose control in acute animal models

The enhanced X-ray Timing and Polarimetry mission—eXTP

International audienceIn this paper we present the enhanced X-ray Timing and Polarimetry mission—eXTP. eXTP is a space science mission designed to study fundamental physics under extreme conditions of density, gravity and magnetism. The mission aims at determining the equation of state of matter at supra-nuclear density, measuring effects of QED, and understanding the dynamics of matter in strong-field gravity. In addition to investigating fundamental physics, eXTP will be a very powerful observatory for astrophysics that will provide observations of unprecedented quality on a variety of galactic and extragalactic objects. In particular, its wide field monitoring capabilities will be highly instrumental to detect the electro-magnetic counterparts of gravitational wave sources. The paper provides a detailed description of: (1) the technological and technical aspects, and the expected performance of the instruments of the scientific payload, (2) the elements and functions of the mission, from the spacecraft to the ground segment

The enhanced x-ray timing and polarimetry mission – eXTP: an update on its scientific cases, mission profile and development status

The enhanced x-ray timing and polarimetry mission (eXTP) is a flagship observatory for x-ray timing, spectroscopy and polarimetry developed by an international consortium. Thanks to its very large collecting area, good spectral resolution and unprecedented polarimetry capabilities, eXTP will explore the properties of matter and the propagation of light in the most extreme conditions found in the universe. eXTP will, in addition, be a powerful x-ray observatory. The mission will continuously monitor the x-ray sky, and will enable multi-wavelength and multi-messenger studies. The mission is currently in phase B, which will be completed in the middle of 2022