Crystallography Open Database
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Searching space group like 'P n m a'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
9017822 | CIF | Ba K O4 V | P n m a | 7.802; 5.908; 10.376 90; 90; 90 | 478.274 | Mugavero, S. J.; Bharathy, M.; McAlum, J.; Loye, H. C. Crystal growth of alkaline earth vanadates from hydroxide fluxes Solid State Sciences, 2008, 10, 370-376 |
9017806 | CIF | Cl Cu2 H3 O3 | P n m a | 6.02797; 6.86383; 9.11562 90; 90; 90 | 377.158 | Zheng, X. G.; Mori, T.; Nishiyama, K.; Higemoto, W.; Yamada, H.; Nishikubo, K.; Xu, C. N. Antiferromagnetic transitions in polymorphous minerals of the natural cuprates atacamite and botallackite Cu2Cl(OH)3 Physical Review B - Condensed Matter, 2005, 71, 174404-174408 |
9017753 | CIF | Fe P | P n m a | 5.099; 3.251; 5.695 90; 90; 90 | 94.405 | Britvin, S. N.; Vapnik, Y.; Polekhovsky, Y. S.; Krivovichev, S. V.; Krzhizhanovskaya, M. G.; Gorelova, L. A.; Vereshchagin, O. S.; Shilovskikh, V. V.; Zaitsev, A. N. Murashkoite, FeP, a new terrestrial phosphide from pyrometamorphic rocks of the Hatrurim Formation, South Levant Mineralogy and Petrology, 2019, 113, 237-248 |
9017737 | CIF | Al6 As3 H33 O33 | P n m a | 19.855; 17.6933; 7.7799 90; 90; 90 | 2733.08 | Grey, I. E.; Favreau, G.; Mills, S. J.; Mumme, W. G.; Bougerol, C.; Brand, H. E. A.; Kampf, A. R.; MacRae, C. M.; Shanks, F. Galeaclolusite, [Al6(AsO4)3(OH)9(H2O)4]*8H2O, a new bulachite-related mineral from Cap Garonne, France Mineralogical Magazine, 2021, 85, 142-148 |
9017720 | CIF | Al2 As H7 O9 | P n m a | 15.3994; 17.6598; 7.80827 90; 90; 90 | 2123.46 | Grey, I. E.; Yoruk, E.; Kodjikian, S.; Klein, H.; Bougerol, C.; Brand, H. E. A.; Bordet, P.; Mumme, W. G.; Favreau, G.; Mills, S. J. Bulachite, [Al6(AsO4)3(OH)9(H2O)4]*2H2O from Cap Garonne, France: Crystal structure and formation from a higher hydrate Note: T = 100 C Mineralogical Magazine, 2020, 84, 608-615 |
9017705 | CIF | Dy0.08 Er0.05 F2.92 Gd0.03 Ho0.02 O0.08 Tb0.01 Tm0.01 Y0.79 Yb0.01 | P n m a | 6.3827; 6.86727; 4.39168 90; 90; 90 | 192.495 | Atencio, D.; Bastos Neto, A. C.; Pereira, V. P.; Ferron, J. T. M. M.; Hoshino, M.; Moriyama, T.; Watanabe, Y.; Miyawaki, R.; Coutinho, J. M. V.; Andrade, M. B.; Domanik, K.; Chukanov, N. V.; Momma, K.; Hirano, H.; Tsunematsu, M. Waimirite-(Y), orthorhombic YF3, a new mineral from the Pitinga mine, Presidente Figueiredo, Amazonas, Brazil and from Jabal Tawlah, Saudi Arabia: description and crystal structure Mineralogical Magazine, 2015, 79, 767-780 |
9017681 | CIF | As2 Cu4 O9 | P n m a | 8.2581; 6.4026; 13.8047 90; 90; 90 | 729.9 | Pekov, I. V.; Zubkova, N. V.; Yapaskurt, V. O.; Belakovskiy, D. I.; Vigasina, M. F.; Sidorov, E. G.; Pushcharovsky, D. Y. New arsenate minerals from the Arsenatnaya fumarole, Tolbachik volcano, Kamchatka, Russia. II. Ericlaxmanite and kozyrevskite, two natural modifications of Cu4O(AsO4)2 Mineralogical Magazine, 2014, 78, 1553-1569 |
9017639 | CIF | C8 H66 Ca4 Cr8 O69 S Sr | P n m a | 15.351; 20.421; 18.27 90; 90; 90 | 5727.33 | Elliott, P.; Giester, G.; Rowe, R.; Pring, A. Putnisite, SrCa4Cr3+8(CO3)8SO4(OH)16*25H2O, a new mineral from Western Australia: description and crystal structure Mineralogical Magazine, 2014, 78, 131-144 |
9017629 | CIF | H I O Pb | P n m a | 7.8244; 4.2107; 10.4724 90; 90; 90 | 345.026 | Siidra, O. I.; Zenko, D. Y.; Suknotova, A. N.; Krivovichev, S. V. Crystal structure of a novel synthetic compound, Pb2O(OH)I, and structure refinement of iodolaurionite, Pb(OH)I: hydroxo- and oxocentred units in Pb minerals and synthetic compounds Mineralogical Magazine, 2013, 77, 3239-3248 |
9017596 | CIF | Ca0.138 Fe1.68 Mg0.764 Na2.862 O12 Ti3.556 | P n m a | 27.714; 2.9881; 11.3564 90; 90; 90 | 940.449 | Anashkin, S.; Bovkun, A.; Bindi, L.; Garanin, V.; Litvin, Y. Kudryavtsevaite, Na3MgFe3+Ti4O12, a new kimberlitic mineral Mineralogical Magazine, 2013, 77, 327-334 |
9017546 | CIF | Al6.54 As0.22 B O17.186 Sb0.62 Si2.186 Ta0.11 | P n m a | 4.7264; 11.981; 20.566 90; 90; 90 | 1164.59 | Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S. The crystal chemistry of holtite Sample: H4 Mineralogical Magazine, 2009, 73, 1033-1050 |
9017545 | CIF | Al6.374 As0.052 B O17.156 Sb0.792 Si2.156 Ta0.26 | P n m a | 4.69; 11.897; 20.385 90; 90; 90 | 1137.42 | Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S. The crystal chemistry of holtite Sample: H3 Mineralogical Magazine, 2009, 73, 1033-1050 |
9017544 | CIF | Al6.39 As0.138 B O17.65 Sb0.21 Si2.65 Ta0.23 | P n m a | 4.6981; 11.926; 20.413 90; 90; 90 | 1143.73 | Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S. The crystal chemistry of holtite Sample: H2 Mineralogical Magazine, 2009, 73, 1033-1050 |
9017543 | CIF | Al6.32 As0.152 B O17.61 Sb0.238 Si2.61 Ta0.32 | P n m a | 4.6818; 11.867; 20.302 90; 90; 90 | 1127.96 | Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S. The crystal chemistry of holtite Sample: H1 Mineralogical Magazine, 2009, 73, 1033-1050 |
9017538 | CIF | Al2 As2 K Na O9 | P n m a | 8.2368; 5.5228; 17.016 90; 90; 90 | 774.061 | Ben Yahia, H.; Nilges, T.; Rodewald, U. C.; Pottgen, R. New arsenates (V) NaKAl2O(AsO4)2 and Na2KAl3(AsO4)4 Materials Research Bulletin, 2010, 45, 2017-2023 |
9017480 | CIF | Br3 Fe K | P n m a | 8.712; 3.845; 14.15 90; 90; 90 | 473.992 | Amit, A.; Horowitz, A.; Makovsky, J. Preparation and crystal structure of KFeCl3 and KFeBr3 Israel Journal of Chemistry, 1974, 12, 827-830 |
9017477 | CIF | As2 Cu4 O9 | P n m a | 8.253; 6.4122; 13.789 90; 90; 90 | 729.712 | Adams, R. D.; Layland, R.; Payen, C. Cu4(AsO4)2(O): A new copper arsenate with unusual low temperature magnetic properties Inorganic Chemistry, 1995, 34, 5397-5398 |
9017465 | CIF | Ba Cu2 O7 Si2 | P n m a | 6.86317; 13.1773; 6.86317 90; 90; 90 | 620.692 | Chen, Y.; Zhang, Y.; Feng, S. Hydrothermal synthesis and properties of pigments Chinese purple BaCuSi2O6 and dark blue BaCu2Si2O7 Dyes and Pigments, 2014, 105, 167-173 |
9017395 | CIF | As Rh | P n m a | 5.62; 3.58; 6 90; 90; 90 | 120.718 | Heyding, R. D.; Calvert, L. D. Arsenides of the transition metals IV. A note on the platinum metal arsenides Canadian Journal of Chemistry, 1961, 39, 955-957 |
9017377 | CIF | F3 Y | P n m a | 6.3537; 6.8545; 4.3953 90; 90; 90 | 191.422 | Cheetham, A. K.; Norman, N. The structures of yttrium and bismuth trifluorides by neutron diffraction Acta Chemica Scandinavica, 1974, 55-60 |
9017287 | CIF | Bi5 O16 Te | P n m a | 10.61155; 22.74458; 5.399038 90; 90; 90 | 1303.09 | Nenert, G.; Missen, O. P.; Lian, H.; Weil, M.; Blake, G. R.; Kampf, A. R.; Mills, S. J. Crystal structure and thermal behavior of Bi6Te2O15: investigation of synthetic and natural pingguite Physics and Chemistry of Minerals, 2020, 47 |
9017286 | CIF | Bi6 O15 Te2 | P n m a | 10.637; 22.797; 5.4136 90; 90; 90 | 1312.75 | Nenert, G.; Missen, O. P.; Lian, H.; Weil, M.; Blake, G. R.; Kampf, A. R.; Mills, S. J. Crystal structure and thermal behavior of Bi6Te2O15: investigation of synthetic and natural pingguite Physics and Chemistry of Minerals, 2020, 47 |
9017076 | CIF | Cr2 Fe O4 | P n m a | 9.0633; 2.95793; 10.6391 90; 90; 90 | 285.219 | Ishii, T.; Kojitani, H.; Tsukamoto, S.; Fujino, K.; Mori, D.; Inaguma, Y.; Tsujino, N.; Yoshino, T.; Yamazaki, D.; Higo, Y.; Funakoshi, K.; Akaogi, M. High-pressure phase transitions in FeCr2O4 and structure analysis of new post- spinel FeCr2O4 and Fe2Cr2O5 phases with meteoritical and petrological implications American Mineralogist, 2014, 99, 1788-1797 |
9017058 | CIF | Al0.015 Ca Cr0.011 Fe1.957 Mg0.003 O4 Ti0.004 | P n m a | 9.2183; 3.0175; 10.6934 90; 90; 90 | 297.45 | Galuskina, I. O.; Vapnik, Y.; Lazic, B.; Armbruster, T.; Murashko, M.; Galuskin, E. V. Harmunite CaFe2O4: A new mineral from the Jabel Harmun, West Bank, Palestinian Autonomy, Israel American Mineralogist, 2014, 99, 965-975 |
9016899 | CIF | Al6.692 B O18 Si2.943 | P n m a | 4.6882; 11.7924; 20.1856 90; 90; 90 | 1115.96 | Evans, R. J.; Fyfe, C. A.; Groat, L. A.; Lam, A. E. MAS NMR measurements and ab initio calculations of the 29Si chemical shifts in dumortierite and holtite American Mineralogist, 2012, 97, 329-340 |
9016795 | CIF | Al1.89 F0.03 Fe1.71 H3.94 K0.01 Li1.88 Mg1.47 Mn0.01 Na0.04 O23.97 Si8 | P n m a | 18.2872; 17.6797; 5.2784 90; 90; 90 | 1706.57 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Greenbushes, W Australia American Mineralogist, 2005, 90, 1167-1176 |
9016794 | CIF | Al1.33 F0.1 Fe1.26 H3.8 Li1.93 Mg2.42 Mn0.04 Na0.05 O23.9 Si8 Zn0.01 | P n m a | 18.336; 17.693; 5.2755 90; 90; 90 | 1711.47 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Norway American Mineralogist, 2005, 90, 1167-1176 |
9016793 | CIF | Al1.3 F0.13 Fe1.3 H3.74 Li1.93 Mg2.32 Mn0.06 Na0.1 O23.87 Si8 Zn0.01 | P n m a | 18.335; 17.693; 5.2743 90; 90; 90 | 1710.99 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Uto, Sweden American Mineralogist, 2005, 90, 1167-1176 |
9016792 | CIF | Al1.34 F0.09 Fe1.26 H3.82 Li1.98 Mg2.35 Mn0.04 Na0.05 O23.91 Si8 Zn0.01 | P n m a | 18.3345; 17.6955; 5.2764 90; 90; 90 | 1711.86 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Zaire American Mineralogist, 2005, 90, 1167-1176 |
9016791 | CIF | Al1.76 F0.07 Fe1.2 H3.86 Li1.97 Mg2.01 Mn0.04 Na0.02 O23.93 Si8 Zn0.01 | P n m a | 18.2754; 17.6569; 5.2738 90; 90; 90 | 1701.79 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Rwanda American Mineralogist, 2005, 90, 1167-1176 |
9016790 | CIF | Al1.98 F0.02 Fe1.2 H3.96 Li1.71 Mg1.89 Mn0.01 Na0.03 O24 Si7.98 | P n m a | 18.277; 17.646; 5.2792 90; 90; 90 | 1702.63 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Siberia American Mineralogist, 2005, 90, 1167-1176 |
9016789 | CIF | Al1.97 F0.03 Fe1.23 H3.94 Li1.98 Mg1.8 Mn0.02 Na0.03 O23.97 Si7.99 Zn0.01 | P n m a | 18.277; 17.65; 5.2736 90; 90; 90 | 1701.21 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: HS 119915 Siberia American Mineralogist, 2005, 90, 1167-1176 |
9016715 | CIF | La0.1 Nb2 O6 Sr0.9 | P n m a | 11.021; 7.675; 5.584 90; 90.19; 90 | 472.327 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9016677 | CIF | C Fe2.7 Mn0.3 | P n m a | 5.0598; 6.7462; 4.5074 90; 90; 90 | 153.857 | Fasiska, E. J.; Jeffery, G. A. On the cementite structure Acta Crystallographica, 1965, 19, 463-471 |
9016657 | CIF | La0.2 Nb2 O6 Sr0.8 | P n m a | 11.042; 7.665; 5.584 90; 90; 90 | 472.613 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9016628 | CIF | Ca2 Fe2 O5 | P n m a | 5.3744; 14.6175; 5.5526 90; 90; 90 | 436.214 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 3.863 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9016584 | CIF | C Fe3 | P n m a | 5.09; 6.748; 4.523 90; 90; 90 | 155.353 | Herbstein, F. H.; Smuts, J. Comparison of X-ray and neutron-diffraction refinements of the structure of cementite Fe3C Acta Crystallographica, 1964, 17, 1331-1332 |
9016495 | CIF | Ca Fe0.12 Mg0.88 O4 Si | P n m a | 11.1098; 6.3894; 4.8281 90; 90; 90 | 342.722 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Thermal parameters for minerals of the olivine group: their implication on vibrational spectra, thermodynamic functions and transferable force fields Acta Crystallographica, Section B, 1995, 51, 721-733 |
9016470 | CIF | Al0.37 Ca2 Fe1.63 O5 | P n m a | 5.3246; 14.4558; 5.5273 90; 90; 90 | 425.444 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 6.267 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9016436 | CIF | Cs6 Mo7 O38 P7 | P n m a | 10.084; 21.297; 17.491 90; 90; 90 | 3756.35 | Guesdon, A.; Borel, M.; Leclaire, A.; Grandin, A.; Raveau, B. A mixed-valent molybdenum monophosphate with a "butterfly"-shaped tunnel structure Cs6Mo7O9(PO4)7*H2O _cod_database_code 1001603 Journal of Solid State Chemistry, 1994, 111, 315-321 |
9016435 | CIF | Mg0.6 Mn1.4 O4 Si | P n m a | 10.52411; 6.17903; 4.83927 90; 90; 90 | 314.692 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1 Journal of Applied Crystallography, 1999, 32, 51-59 |
9016247 | CIF | Ca2 Fe2 O5 | P n m a | 5.3035; 14.4389; 5.4979 90; 90; 90 | 421.011 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 9.73 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9016235 | CIF | Ag0.331 Bi3.875 Cu0.203 Pb3.32 S10 Sb0.447 | P n m a | 23.652; 4.0539; 19.095 90; 90; 90 | 1830.88 | Topa, D.; Makovicky, E. The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 3 The Canadian Mineralogist, 2010, 48, 1081-1107 |
9016186 | CIF | Al2 Ge H2 O6 | P n m a | 9.107; 8.551; 4.804 90; 90; 90 | 374.106 | Marler, B.; Wunder, B. Crystal structure of dialuminium dihydroxogermanate, Al~2~GeO~4~(OH)~2~ Zeitschrift für Kristallographie - New Crystal Structures, 1998, 213, 3-3 |
9016180 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.2004; 5.5529; 10.0423 90; 90; 90 | 903.397 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = .0001 GPa American Mineralogist, 2012, 97, 1165-1176 |
9016171 | CIF | C O6 Pb2 S2 | P n m a | 16.343; 8.76; 4.592 90; 90; 90 | 657.412 | Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F. Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-02 Mineralogical Magazine, 2011, 75, 2721-2732 |
9016116 | CIF | Mg0.6 Mn1.4 O4 Si | P n m a | 10.52411; 6.17903; 4.83927 90; 90; 90 | 314.692 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo Journal of Applied Crystallography, 1999, 32, 51-59 |
9016013 | CIF | Ca2 Fe2 O5 | P n m a | 5.4271; 14.7619; 5.5978 90; 90; 90 | 448.464 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 0.0001 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9016006 | CIF | Ce O6 Ta Ti | P n m a | 10.9694; 7.5288; 5.3829 90; 90; 90 | 444.554 | Thorogood, G. J.; Avdeev, M.; Kennedy, B. J. Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide Solid State Sciences, 2010, 12, 1263-1269 |
9015959 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.1353; 5.5062; 9.9432 90; 90; 90 | 883.396 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 2.945 GPa American Mineralogist, 2012, 97, 1165-1176 |
9015955 | CIF | Al0.37 Ca2 Fe1.63 O5 | P n m a | 5.3549; 14.541; 5.5524 90; 90; 90 | 432.341 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 3.729 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9015926 | CIF | Eu O6 Ta2 | P n m a | 11.02; 7.64; 5.61 90; 90; 90 | 472.322 | Jacobsen, H.; Lissner, F.; Manek, E.; Meyer, G. Crystal structures of dieuropium(II) ditantalum heptoxide, Eu2Ta2O7 and europium(II) ditantalum hexoxide, EuTa2O6 Zeitschrift fur Kristallographie, 1996, 211, 547-548 |
9015921 | CIF | Ag0.51 Bi4 Cu0.463 Pb3.446 S10 | P n m a | 23.879; 4.0453; 19.017 90; 90; 90 | 1837 | Topa, D.; Makovicky, E. The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 6 The Canadian Mineralogist, 2010, 48, 1081-1107 |
9015897 | CIF | La0.924 Nb1.228 O6 Ti0.772 | P n m a | 10.96305; 7.58996; 5.46833 90; 90; 90 | 455.015 | Golobic, A.; Skapin, S. D.; Suvorov, D.; Meden, A. Solving Structural Problems of Ceramic Materials Croatica Chemica Acta, 2004, 77, 435-446 |
9015862 | CIF | Al0.37 Ca2 Fe1.63 O5 | P n m a | 5.4042; 14.6835; 5.5947 90; 90; 90 | 443.954 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 0.0001 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9015849 | CIF | Mn2 O4 Si | P n m a | 10.60016; 6.25753; 4.90338 90; 90; 90 | 325.245 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo Journal of Applied Crystallography, 1999, 32, 51-59 |
9015812 | CIF | La0.2 Nb2 O6 Sr0.8 | P n m a | 11.042; 7.644; 5.563 90; 90; 90 | 469.545 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9015811 | CIF | Al6.81 As0.093 B O17.884 Sb0.023 Si2.884 | P n m a | 4.6971; 11.8149; 20.2267 90; 90; 90 | 1122.5 | Groat, L. A.; Evans, R. J.; Grew, E. S.; Pieczka, A. The crystal chemistry of As- and Sb-bearing dumortierite Sample: D21 The Canadian Mineralogist, 2012, 50, 855-872 |
9015808 | CIF | Ca H8 O15 Si4 V | P n m a | 9.6329; 13.6606; 9.7949 90; 90; 90 | 1288.92 | Danisi, R. M.; Armbruster, T.; Lazic, B. In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: room temperature American Mineralogist, 2012, 97, 1874-1880 |
9015799 | CIF | Bi4 Cu0.73 Pb3.695 S10 | P n m a | 23.816; 4.0408; 19.057 90; 90; 90 | 1833.96 | Topa, D.; Makovicky, E. The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 4 The Canadian Mineralogist, 2010, 48, 1081-1107 |
9015764 | CIF | Ca O13.014 Si4 V | P n m a | 9.4746; 13.262; 9.605 90; 90; 90 | 1206.89 | Danisi, R. M.; Armbruster, T.; Lazic, B. In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: T = 175 C American Mineralogist, 2012, 97, 1874-1880 |
9015735 | CIF | C O6 Pb2 S2 | P n m a | 16.32; 8.7616; 4.5809 90; 90; 90 | 655.02 | Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F. Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-01 Mineralogical Magazine, 2011, 75, 2721-2732 |
9015720 | CIF | Ca2 Fe2 O5 | P n m a | 5.3522; 14.5621; 5.5354 90; 90; 90 | 431.425 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 5.564 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9015659 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.0539; 5.4609; 9.8437 90; 90; 90 | 862.985 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 6.511 GPa American Mineralogist, 2012, 97, 1165-1176 |
9015658 | CIF | Mg2 O4 Si | P n m a | 10.20141; 5.98348; 4.75534 90; 90; 90 | 290.266 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1 Journal of Applied Crystallography, 1999, 32, 51-59 |
9015654 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.0271; 5.4473; 9.8119 90; 90; 90 | 856.622 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 7.766 GPa American Mineralogist, 2012, 97, 1165-1176 |
9015649 | CIF | C H Nd O4 | P n m a | 7.2333; 4.964; 8.4908 90; 90; 90 | 304.872 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
9015506 | CIF | La0.3 Nb2 O6 Sr0.7 | P n m a | 11.046; 7.653; 5.571 90; 90; 90 | 470.945 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9015438 | CIF | Ag0.014 Bi4 Cu0.132 Pb3.904 S10 | P n m a | 23.87; 4.0647; 19.13 90; 90; 90 | 1856.08 | Topa, D.; Makovicky, E. The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 1 The Canadian Mineralogist, 2010, 48, 1081-1107 |
9015333 | CIF | F H Mg O | P n m a | 10.1299; 3.0723; 4.676 90; 90; 90 | 145.527 | Crichton, W. A.; Parise, J. B.; Muller, H.; Breger, J.; Marshall, W. G.; Welch, M. D. Synthesis and structure of magnesium hydroxide fluoride, Mg(OH)F: a topological intermediate between brucite- and rutile-type structures Mineralogical Magazine, 2012, 76, 25-36 |
9015305 | CIF | Al0.37 Ca2 Fe1.63 O5 | P n m a | 5.3769; 14.6032; 5.5712 90; 90; 90 | 437.45 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 2.015 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9015299 | CIF | Nb2 O6 Sr | P n m a | 10.9862; 7.7223; 5.5944 90; 90.372; 90 | 474.612 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9015294 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.0796; 5.4721; 9.869 90; 90; 90 | 868.365 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 5.533 GPa American Mineralogist, 2012, 97, 1165-1176 |
9015281 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.0845; 5.477; 9.8785 90; 90; 90 | 870.245 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 5.145 GPa American Mineralogist, 2012, 97, 1165-1176 |
9015277 | CIF | La0.3 Nb2 O6 Sr0.7 | P n m a | 11.053; 7.64; 5.556 90; 90; 90 | 469.176 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9015267 | CIF | Cu3 Mo1.94 O9 S0.06 | P n m a | 7.6638; 6.867; 14.5554 90; 90; 90 | 766.012 | Zelenski, M. E.; Zubkova, N. V.; Pekov, I. V.; Polekhovsky, Y. S.; Pushcharovsky, D. Y. Cupromolybdite, Cu3O(MoO4)2, a new fumarolic mineral from the Tolbachik volcano, Kamchatka Peninsula, Russia European Journal of Mineralogy, 2012, 24, 749-757 |
9015246 | CIF | Ca O12.18 Si4 V | P n m a | 9.39; 13.11; 9.39 90; 90; 90 | 1155.94 | Danisi, R. M.; Armbruster, T.; Lazic, B. In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: T = 350 C American Mineralogist, 2012, 97, 1874-1880 |
9015230 | CIF | As Cd Cu H O5 | P n m a | 7.415; 5.89; 9.016 90; 90; 90 | 393.768 | Effenberger, H. CdCu(OH)(AsO4), the first Cd member of the adelite-descloizite structure type Zeitschrift fur Kristallographie, 2002, 19, 85-85 |
9015222 | CIF | Nd O6 Ta Ti | P n m a | 10.9771; 7.5051; 5.3602 90; 90; 90 | 441.596 | Thorogood, G. J.; Avdeev, M.; Kennedy, B. J. Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide Solid State Sciences, 2010, 12, 1263-1269 |
9015192 | CIF | Mg Mn O4 Si | P n m a | 10.451; 6.12446; 4.80757 90; 90; 90 | 307.717 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1 Journal of Applied Crystallography, 1999, 32, 51-59 |
9015130 | CIF | H8 O12 S2 U | P n m a | 14.674; 11.093; 5.688 90; 90; 90 | 925.885 | Kierkegaard, P. The crystal structure of U(SO4)2*4H2O Acta Chemica Scandinavica, 1956, 10, 599-616 |
9015074 | CIF | Mg Mn O4 Si | P n m a | 10.451; 6.12446; 4.80757 90; 90; 90 | 307.717 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo Journal of Applied Crystallography, 1999, 32, 51-59 |
9015070 | CIF | Ba Cu2 Ge2 O7 | P n m a | 7.04765; 13.407; 7.02755 90; 90; 90 | 664.018 | Yamada, T.; Hiroi, Z.; Takano, M. Spin-1/2 quantum antiferromagnetic chains with tunable superexchange interactions found in BaCu2(Si1-xGex)2O7 Journal of Solid State Chemistry, 2001, 156, 101-109 |
9015061 | CIF | Al6.79 B O18 Si3 | P n m a | 4.6995; 11.779; 20.1671 90; 90; 90 | 1116.36 | Groat, L. A.; Evans, R. J.; Grew, E. S.; Pieczka, A. The crystal chemistry of As- and Sb-bearing dumortierite Sample: D67 The Canadian Mineralogist, 2012, 50, 855-872 |
9015055 | CIF | Al3 H O13 Pb2 Si3 | P n m a | 16.4529; 5.6432; 10.3631 90; 90; 90 | 962.183 | Dorsam, G.; Liebscher, A.; Wunder, B.; Franz, G.; Gottschalk, M. Synthesis of Pb-zoisite and Pb-lawsonite Neues Jahrbuch fur Mineralogie, Abhandlungen, 2011, 188, 99-110 |
9015033 | CIF | La O6 Ta Ti | P n m a | 10.942; 7.5831; 5.4614 90; 90; 90 | 453.156 | Thorogood, G. J.; Avdeev, M.; Kennedy, B. J. Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide Solid State Sciences, 2010, 12, 1263-1269 |
9015028 | CIF | B F4 H4 N | P n m a | 9.077; 5.679; 7.279 90; 90; 90 | 375.22 | Caron, A. P.; Ragle, J. L. Refinement of the structure of orthorhombic ammonium tetrafluoroborate, NH4BF4 Acta Crystallographica, Section B, 1971, 27, 1102-1107 |
9014929 | CIF | Ca O14.249 Si4 V | P n m a | 9.609; 13.6833; 9.7559 90; 90; 90 | 1282.73 | Danisi, R. M.; Armbruster, T.; Lazic, B. In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: T = 75 C American Mineralogist, 2012, 97, 1874-1880 |
9014902 | CIF | F H O Zn | P n m a | 10.228; 3.1125; 4.7165 90; 90; 90 | 150.148 | Crichton, W. A.; Parise, J. B.; Muller, H.; Breger, J.; Marshall, W. G.; Welch, M. D. Synthesis and structure of magnesium hydroxide fluoride, Mg(OH)F: a topological intermediate between brucite- and rutile-type structures Note: transformed from Serier et al (2007) Mineralogical Magazine, 2012, 76, 25-36 |
9014892 | CIF | Ba Cu2 O7 Si2 | P n m a | 6.86058; 13.17507; 6.89589 90; 90; 90 | 623.31 | Yamada, T.; Hiroi, Z.; Takano, M. Spin-1/2 quantum antiferromagnetic chains with tunable superexchange interactions found in BaCu2(Si1-xGex)2O7 Journal of Solid State Chemistry, 2001, 156, 101-109 |
9014882 | CIF | Bi4 Cu0.26 Pb3.867 S10 | P n m a | 23.894; 4.0616; 19.143 90; 90; 90 | 1857.79 | Topa, D.; Makovicky, E. The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 2 The Canadian Mineralogist, 2010, 48, 1081-1107 |
9014842 | CIF | Ag0.308 Bi4 Cu0.358 Pb3.643 S10 | P n m a | 23.846; 4.0559; 19.066 90; 90; 90 | 1844.01 | Topa, D.; Makovicky, E. The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 5 The Canadian Mineralogist, 2010, 48, 1081-1107 |
9014764 | CIF | Ca2 Fe2 O5 | P n m a | 5.3956; 14.6756; 5.5703 90; 90; 90 | 441.077 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 2.249 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9014745 | CIF | O6 Ta Tb Ti | P n m a | 10.977; 7.414; 5.238 90; 90; 90 | 426.287 | Thorogood, G. J.; Avdeev, M.; Kennedy, B. J. Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide Solid State Sciences, 2010, 12, 1263-1269 |
9014736 | CIF | C O6 Pb2 S2 | P n m a | 16.326; 8.773; 4.583 90; 90; 90 | 656.414 | Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F. Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-03 Baden-Wurttemberg, Germany Mineralogical Magazine, 2011, 75, 2721-2732 |
9014729 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.176; 5.5342; 10.0007 90; 90; 90 | 895.275 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 1.144 GPa American Mineralogist, 2012, 97, 1165-1176 |
9014702 | CIF | C H O4 Sm | P n m a | 7.1388; 4.9151; 8.4717 90; 90; 90 | 297.254 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
9014661 | CIF | Al0.37 Ca2 Fe1.63 O5 | P n m a | 5.2953; 14.3759; 5.5037 90; 90; 90 | 418.968 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 8.89 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9014610 | CIF | Al6.12 As0.1 B O16.86 Sb1.14 Si1.3 Ta0.3 | P n m a | 4.6893; 11.881; 20.394 90; 90; 90 | 1136.22 | Zubkova, N. V.; Pushcharovskii, D. Y.; Kabalov, Y. K.; Kazantsev, S. S.; Voloshin, A. V. Crystal structure of holtite II Crystallography Reports, 2006, 51, 16-22 |
9014579 | CIF | Al6.454 As0.21 B H O17.64 Sb0.36 Si2.43 Ta0.258 | P n m a | 4.695; 11.906; 20.38 90; 90; 90 | 1139.21 | Kazantsev, S. S.; Pushcharovsky, D. Y.; Pasero, M.; Merlino, S.; Zubkova, N. V.; Kabalov, Y. K.; Voloshin, A. V. Crystal structure of holtite I Crystallography Reports, 2005, 50, 42-47 |
9014567 | CIF | As2 Fe0.08 H7 Mg0.05 Mn0.05 O12 Zn2.82 | P n m a | 10.804; 19.003; 5.112 90; 90; 90 | 1049.54 | Neuhold, F.; Kolitsch, U.; Bernhardt, H. J.; Lengauer, C. L. Arsenohopeite, a new zinc arsenate mineral from the Tsumeb mine, Namibia Mineralogical Magazine, 2012, 76, 603-612 |
9014515 | CIF | O6 Pr Ta Ti | P n m a | 10.9511; 7.5288; 5.3829 90; 90; 90 | 443.813 | Thorogood, G. J.; Avdeev, M.; Kennedy, B. J. Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide Solid State Sciences, 2010, 12, 1263-1269 |
9014452 | CIF | La0.1 Nb2 O6 Sr0.9 | P n m a | 11.018; 7.672; 5.575 90; 90.25; 90 | 471.251 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9014394 | CIF | Al6.809 As0.099 B O17.876 Sb0.025 Si2.876 | P n m a | 4.6871; 11.7901; 20.1825 90; 90; 90 | 1115.31 | Groat, L. A.; Evans, R. J.; Grew, E. S.; Pieczka, A. The crystal chemistry of As- and Sb-bearing dumortierite Sample: D31 The Canadian Mineralogist, 2012, 50, 855-872 |
9014389 | CIF | Al6.668 As0.087 B O17.898 Sb0.022 Si2.89 | P n m a | 4.6901; 11.7874; 20.1872 90; 90; 90 | 1116.03 | Groat, L. A.; Evans, R. J.; Grew, E. S.; Pieczka, A. The crystal chemistry of As- and Sb-bearing dumortierite Sample: D27 The Canadian Mineralogist, 2012, 50, 855-872 |
9014384 | CIF | Ba Cu2 O7 Si2 | P n m a | 6.8556; 13.1725; 6.8901 90; 90; 90 | 622.213 | Yang, H.; Downs, R. T.; Evans, S. H.; Pinch, W. W. Scottyite, the natural analog of synthetic BaCu2Si2O7, a new mineral from the Wessels mine, Kalahari Manganese Fields, South Africa American Mineralogist, 2013, 98, 478-484 |
9014378 | CIF | Al6.24 As0.13 B H0.52 O17.499 Sb0.343 Si2.499 Ta0.248 | P n m a | 4.695; 11.906; 20.38 90; 90; 90 | 1139.21 | Kazantsev, S. S.; Zubkova, N. V.; Voloshin, A. V. Refinement of composition and structure of holtite I Crystallography Reports, 2006, 51, 412-413 |
9014371 | CIF | Ca2 Fe2 O5 | P n m a | 5.3246; 14.4819; 5.511 90; 90; 90 | 424.955 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 8.167 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9014320 | CIF | Mn2 O4 Si | P n m a | 10.60016; 6.25753; 4.90338 90; 90; 90 | 325.245 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1 Journal of Applied Crystallography, 1999, 32, 51-59 |
9014319 | CIF | Ca2 Fe2 O5 | P n m a | 5.3422; 14.5385; 5.5277 90; 90; 90 | 429.323 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 6.326 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
9014297 | CIF | Mg2 O4 Si | P n m a | 10.20141; 5.98348; 4.75534 90; 90; 90 | 290.266 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo Journal of Applied Crystallography, 1999, 32, 51-59 |
9014265 | CIF | As Cu S | P n m a | 11.356; 3.754; 5.453 90; 90; 90 | 232.464 | Marumo, F.; Nowacki, W. The crystal structure of lautite and of sinnerite, a new mineral from the Lengenbach Quarry Schweizerische Mineralogische und Petrographische Mitteilungen, 1964, 44, 439-454 |
9014173 | CIF | H8 O12 S2 U | P n m a | 14.6464; 11.0786; 5.691 90; 90; 90 | 923.431 | Plasil, J.; Fejfarova, K.; Novak, M.; Dusek, M.; Skoda, R.; Hlousek, J.; Cejka, J.; Majzlan, J.; Sejkora, J.; Machovic, V.; Talla, D. Behounekite, U(SO4)2(H2O)4, From Jachymov (St Joachimsthal), Czech Republic: the first natural U4+ sulphate Mineralogical Magazine, 2011, 75, 2739-2753 |
9014151 | CIF | La0.4 Nb2 O6 Sr0.6 | P n m a | 11.055; 7.658; 5.578 90; 90; 90 | 472.229 | Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M. Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd] Materials Research Bulletin, 1994, 29, 743-749 |
9014116 | CIF | Ca0.25 Ce0.348 Fe0.03 Gd0.01 La0.12 Nb1.14 Nd0.14 O6 Pr0.04 Sm0.02 Sr0.01 Th0.06 Ti0.86 Y0.02 | P n m a | 11.0563; 7.56; 5.3637 90; 90; 90 | 448.328 | Morrison, S. M.; Downs, R. T.; Domanik, K. J.; Yang, H.; Doell, D. Nioboaeschynite-(Ce), Ce(NbTi)O6 Acta Crystallographica, Section E, 2012, 68, i64-i65 |
9014111 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.1124; 5.4917; 9.911 90; 90; 90 | 876.97 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 4.025 GPa American Mineralogist, 2012, 97, 1165-1176 |
9013962 | CIF | Cu3 H4 O8 S | P n m a | 8.289; 6.079; 12.057 90; 90; 90 | 607.538 | Vilminot, S.; Richard-Plouet M; Andre, G.; Swierczynski, D.; Guillot, M.; Bouree-Vigneron F; Drillon, M. Magnetic structure and properties of Cu3(OH)4SO4 made of triple chains of spins s=1/2, Journal of Solid State Chemistry, 2003, 170, 255-264 |
9013955 | CIF | Ag4.925 Cu3.075 S4 | P n m a | 14.047; 7.805; 15.691 90; 90; 90 | 1720.31 | Kolitsch, U. The crystal structure and compositional range of mckinstryite Mineralogical Magazine, 2010, 74, 73-84 |
9013822 | CIF | Bi2 Pb S4 | P n m a | 11.742; 4.0814; 14.522 90; 90; 90 | 695.949 | Topa, D.; Makovicky, E.; Putz, H. The crystal structure of angelaite, Cu2AgPbBiS4 The Canadian Mineralogist, 2010, 48, 145-153 |
9013821 | CIF | Ag Bi Cu1.98 Pb S4 | P n m a | 12.734; 4.032; 14.633 90; 90; 90 | 751.309 | Topa, D.; Makovicky, E.; Putz, H. The crystal structure of angelaite, Cu2AgPbBiS4 The Canadian Mineralogist, 2010, 48, 145-153 |
9013798 | CIF | Br0.24 Cl4.86 H12 N2.9 Pb1.09 | P n m a | 8.4351; 15.7732; 8.4446 90; 90; 90 | 1123.54 | Demartin, F.; Gramaccioli, C. M.; Campostrini, I. Brontesite, (NH4)3PbCl5, a new product of fumarolic activity from La Fossa Crater, Vulcano, Aeolian Islands, Italy Locality: La Fossa Crater, Vulcano, Aeolian Islands, Italy The Canadian Mineralogist, 2009, 47, 1237-1243 |
9013791 | CIF | Fe H9 O12 S2 | P n m a | 9.687; 18.204; 5.425 90; 90; 90 | 956.656 | Peterson, R. C.; Valyashko, E.; Wang, R. The atomic structure of (H3O)Fe3+(SO4)2 and rhomboclase, (H5O2)Fe3+(SO4)2*2H2O Locality: Alcoparrosa, Chile The Canadian Mineralogist, 2009, 47, 625-634 |
9013788 | CIF | Cs3 O19 Si8 Y | P n m a | 11.476; 7.059; 26.971 90; 90; 90 | 2184.9 | Kolitsch, U.; Wierzbicka-Wieczorek M; Tillmanns, E. Crystal chemistry and topology of two flux-grown yttrium silicates, BaKYSi2O7 and Cs3YSi8O19 Locality: synthetic The Canadian Mineralogist, 2009, 47, 421-431 |
9013469 | CIF | Ca2 Fe2 O5 | P n m a | 5.4253; 14.7687; 5.598 90; 90; 90 | 448.538 | Berggren, J. Refinement of the crystal structure of dicalcium ferrite, Ca2Fe2O5 Acta Chemica Scandinavica, 1971, 25, 3616-3624 |
9013438 | CIF | F6 K Na Si | P n m a | 9.3246; 5.4992; 9.7892 90; 90; 90 | 501.969 | Fischer, J.; Kramer, V. Crystal structure of KNaSiF_6_ Materials Research Bulletin, 1991, 26, 925-930 |
9013424 | CIF | Bi2 Se3 | P n m a | 11.83; 4.09; 11.62 90; 90; 90 | 562.23 | Atabaeva, E. Y.; Mashkov, S. A.; Popova, S. V. The crystal structure of a new modification of Bi2Se3-II Kristallografiya, 1973, 18, 173-174 |
9013387 | CIF | B3.112 Mg8 O16.026 Si1.028 | P n m a | 20.494; 11.89; 4.588 90; 90; 90 | 1117.97 | Galuskina, I. O.; Kadiyski, M.; Armbruster, T.; Galuskin, E. V.; Pertsev, N. N.; Dzierzanowski, P.; Wrzalik, R. A new natural phase in the system Mg2SiO4-Mg2BO3F-Mg2BO3(OH): composition, paragenesis and structure of OH-dominant pertsevite European Journal of Mineralogy, 2008, 20, 951-964 |
9013159 | CIF | Cr Fe P | P n m a | 5.833; 3.569; 6.658 90; 90; 90 | 138.606 | Kumar, S.; Krishnamurthy, A.; Srivastava, B. K.; Das, A.; Paranjpe, S. K. Magnetization and neutron diffraction studies on FeCrP Pramana - Journal of Physics, 2004, 63, 199-205 |
9012864 | CIF | As3 Cu2 Fe H4 O11 | P n m a | 9.585; 13.143; 8.0884 90; 90; 90 | 1018.94 | Sarp, H.; Guenee, L. Radovanite, Cu2Fe3+(As5+O4)(As3+O2OH)2H2O, a new mineral: its description and crystal structure Archives des Sciences, Geneve, 2002, 55, 47-55 |
9012836 | CIF | As4 S3 | P n m a | 11.21; 9.9; 6.58 90; 90; 90 | 730.242 | Whitfield, H. J. Crystal structure of the beta-form of tetraarsenic trisulphide Journal of the Chemical Society, Dalton Transactions, Inorganic Chemistry, 1973, 1973, 1737-1738 |
9012835 | CIF | As4 S3 | P n m a | 9.12; 7.99; 10.1 90; 90; 90 | 735.975 | Whitfield, H. J. The crystal structure of tetra-arsenic trisulfide Note: "alpha-dimorphite" Journal of the Chemical Society A: Inorganic, Physical, Theoretical, 1970, 1970, 1800-1803 |
9012597 | CIF | Cl5 Fe H10 N2 O | P n m a | 13.706; 9.924; 7.024 90; 90; 90 | 955.393 | Figgis, B. N.; Raston, C. L.; Sharma, R. P.; White, A. H. Crystal structure of diammonium aquapentachloroferrate(III) Australian Journal of Chemistry, 1978, 31, 2717-2720 |
9012587 | CIF | Ca O6 Ta2 | P n m a | 11.068; 7.505; 5.378 90; 90; 90 | 446.725 | Jahnberg, L. Crystal structure of orthorhombic CaTa2O6 Acta Chemica Scandinavica, 1963, 17, 2548-2559 |
9012585 | CIF | As0.95 Co Sb0.05 | P n m a | 5.16; 3.54; 5.87 90; 90; 90 | 107.224 | Fjellvag, H.; Selte, K.; Stave, F. E. On the structural and magnetic properties of Co1-tNitAs and CoAs1-xSbx Acta Chemica Scandinavica A, 1984, 38, 687-691 |
9012584 | CIF | As Co0.9 Ni0.1 | P n m a | 5.16; 3.54; 5.87 90; 90; 90 | 107.224 | Fjellvag, H.; Selte, K.; Stave, F. E. On the structural and magnetic properties of Co1-tNitAs and CoAs1-xSbx Acta Chemica Scandinavica A, 1984, 38, 687-691 |
9012530 | CIF | Hg O | P n m a | 6.6129; 5.5208; 3.5219 90; 90; 90 | 128.579 | Aurivillius, K. Least-squares refinement of the crystal structures of orthorhombic HgO and of Hg2O2NaI Locality: synthetic Acta Chemica Scandinavica, 1964, 18, 1305-1306 |
9012419 | CIF | Al2.808 Ca0.685 H44.28 Na0.444 O56.971 Si21.192 | P n m a | 20.201; 19.991; 13.469 90; 90; 90 | 5439.3 | Vezzalini, G.; Quartieri, S.; Galli, E.; Alberti, A.; Cruciani, G.; Kvick, A. Crystal structure of the zeolite mutinaite, the natural analog of ZSM-5 Note: reported occupancies do not match reported chemistry Zeolites, 1997, 19, 323-325 |
9012254 | CIF | F7 In Mg Na2 | P n m a | 10.435; 7.345; 7.553 90; 90; 90 | 578.9 | Caramanian, A.; Souron, J. P.; Gredin, P.; de Kozak, A. The crystal structure of the weberite Na2MgInF7 Journal of Solid State Chemistry, 2001, 159, 234-238 |
9012213 | CIF | H28 K Mg2 Na O22 P2 | P n m a | 25.1754; 6.9316; 11.2189 90; 90; 90 | 1957.76 | Yang, H.; Sun, H. J. Crystal structure of a new phosphate compound, Mg2KNa(PO4)2*14H2O Journal of Solid State Chemistry, 2004, 177, 2991-2997 |
9012198 | CIF | H8 Mg0.62 O12 P2 Zn2.38 | P n m a | 10.594; 18.333; 5.029 90; 90; 90 | 976.731 | Haussuhl, S.; Middendorf, B.; Dorffel, M. Structure and properties of hopeites (MgxZn1-x)3(PO4)2*4H2O Journal of Solid State Chemistry, 1991, 93, 9-16 |
9012092 | CIF | H8 O12 P2 Zn3 | P n m a | 10.553; 18.199; 5.031 90; 90; 90 | 966.224 | Kawahara, A.; Takano, Y.; Takahashi, M. The structure of hopeite Mineralogical Journal, 1973, 7, 289-297 |
9011991 | CIF | Fe2 S4 Tl3 | P n m a | 7.38; 10.73; 11.14 90; 90; 90 | 882.148 | Welz, D.; Deppe, P.; Schaefer, W.; Sabrowsky, H.; Rosenberg, M. Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium I. Chain structures Journal of Physics and Chemistry of Solids, 1989, 50, 297-308 |
9011960 | CIF | Bi11.4 Cu0.6 Fe0.4 Pb9 S28 Sb0.6 | P n m a | 54.76; 4.03; 22.75 90; 90; 90 | 5020.53 | Kupcik, V. Die kristallstruktur des minerals eclarit, (Cu,Fe)Pb9Bi12S28 Tschermaks Mineralogische und Petrographische Mitteilungen, 1984, 32, 259-269 |
9011950 | CIF | Ca5 O12 P2 Si | P n m a | 6.737; 15.508; 10.132 90; 90; 90 | 1058.56 | Dickens, B.; Brown, W. E. The crystal structure of Ca5(PO4)2SiO4 (silico-carnotite) Tschermaks Mineralogische und Petrographische Mitteilungen, 1971, 16, 1-27 |
9011812 | CIF | C O5 Pb3 | P n m a | 22.194; 9.108; 5.7405 90; 90; 90 | 1160.4 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of basic lead carbonates. III. Crystal structures of Pb3O2(CO3) and NaPb2(OH)(CO3)2 Mineralogical Magazine, 2000, 64, 1077-1087 |
9011776 | CIF | Ba3 F H4 Mn4 Na O22 Si6 | P n m a | 23.42; 12.266; 7.181 90; 90; 90 | 2062.88 | Yamnova, N. A.; Puscharovskii, D. Y.; Mernaf, T.; Kalinin, V. V.; Kalacheva, L. V. Crystal structure of a new natural Na, Ba, Mn-fluorosilicate Kristallografiya, 1992, 37, 345-351 |
9011480 | CIF | O2 Si | P n m a | 20.108; 19.918; 13.392 90; 90; 90 | 5363.65 | Taylor, J. C.; Miller, S. A.; Bibby, D. M. A study of decomposition methods for refinement of H±ZSM5 zeolite with powder diffraction data Note: dehydrated mutinaite Zeitschrift fur Kristallographie, 1986, 176, 183-192 |
9011425 | CIF | S3 Sb2 | P n m a | 11.3107; 3.8363; 11.2285 90; 90; 90 | 487.219 | Bayliss, P.; Nowacki, W. Refinement of the crystal structure of stibnite, Sb2S3 Zeitschrift fur Kristallographie, 1972, 135, 308-315 |
9011380 | CIF | Cl5 Fe H2 K2 O | P n m a | 13.391; 9.648; 6.942 90; 90; 90 | 896.881 | Schultz, A. J.; Carlin, R. L. Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .14 GPa Sample: T = 15 K Acta Crystallographica, Section B, 1995, 51, 43-47 |
9011379 | CIF | Cl5 Fe H2 K2 O | P n m a | 13.452; 9.631; 7.003 90; 90; 90 | 907.282 | Schultz, A. J.; Carlin, R. L. Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .1 MPa Sample: T = 15 K Acta Crystallographica, Section B, 1995, 51, 43-47 |
9011266 | CIF | Ca4 H120 Na3 O252 Si85 | P n m a | 20.078; 19.894; 13.372 90; 90; 90 | 5341.2 | van Koningsveld, H. High-temperature (350 K) orthorhombic framework structure of zeolite H-ZSM-5 Note: anisotropic thermal parameters obtained from ICSD Acta Crystallographica, Section B, 1990, 46, 731-735 |
9011241 | CIF | Na O3 V | P n m a | 14.147; 3.6496; 5.364 90; 90; 90 | 276.948 | Kato, K.; Takayama, E. Das entwaesserungsverhalten des natriummetavanadatdihydrats und die kristallstruktur des beta-natriummetavanadats Note: anisoB's corrected from ICSD Acta Crystallographica, Section B, 1984, 40, 102-105 |
9011236 | CIF | S3 Sn2 | P n m a | 8.878; 3.751; 14.02 90; 90; 90 | 466.885 | Kniep, R.; Mootz, D.; Severin, U.; Wunderlich, H. Structure of tin(II) tin(IV) trisulphide, a redetermination Acta Crystallographica, Section B, 1982, 38, 2022-2023 |
9011206 | CIF | H O5 Pb V Zn | P n m a | 7.593; 6.057; 9.416 90; 90; 90 | 433.049 | Hawthorne, F. C.; Faggiani, R. Refinement of the structure of descloizite Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 717-720 |
9011154 | CIF | H8 O12 P2 Zn3 | P n m a | 10.629; 18.339; 5.04 90; 90; 90 | 982.423 | Whitaker, A. The crystal structure of hopeite, Zn3(PO4)2*4H2O Acta Crystallographica, Section B, 1975, 31, 2026-2035 |
9011079 | CIF | Cl K O4 | P n m a | 8.7684; 5.6237; 7.2039 90; 90; 90 | 355.23 | Marabello, D.; Bianchi, R.; Gervasio, G.; Cargnoni, F. An experimental (120K) and theoretical electron-density study of KMnO4 and KClO4 Locality: synthetic Note: potassium perchlorate T = 120 K Acta Crystallographica, Section A, 2004, 60, 494-501 |
9010926 | CIF | Al1.98 Be Cr0.02 O4 | P n m a | 9.4082; 5.479; 4.4288 90; 90; 90 | 228.294 | Weber, S. U.; Grodzicki, M.; Lottermoser, W.; Redhammer, G. J.; Tippelt, G.; Ponahlo, J.; Amthauer, G. 57Fe Mossbauer spectroscopy, X-ray single-crystal diffractometry, and electronic structure calculations on natural alexandrite Note: changed O1(z) from .788822 to .78822 Physics and Chemistry of Minerals, 2007, 34, 507-515 |
9010734 | CIF | Fe H3.028 O12 S2 | P n m a | 9.7226; 18.28; 5.427 90; 90; 90 | 964.536 | Majzlan, J.; Navrotsky, A.; McCleskey, R. B.; Alpers, C. N. Thermodynamic properties and crystal structure refinement of ferricopiapite, coquimbite, rhomboclase, and Fe2(SO4)3(H2O)5 Locality: synthetic European Journal of Mineralogy, 2006, 18, 175-186 |
9010629 | CIF | O5 S V | P n m a | 7.389; 6.274; 7.0788 90; 90; 90 | 328.163 | Krivovichev, S. V.; Vergasova, L. P.; Britvin, S. N.; Filatov, S. K.; Kahlenberg, V.; Ananiev, V. V. Pauflerite, B-VO(SO4), a new mineral species from the Tolbachik volcano, Kamchatka Peninsula, Russia The Canadian Mineralogist, 2007, 45, 921-927 |
9010589 | CIF | Be0.84 O6 Ti1.5 V1.5 | P n m a | 9.982; 8.502; 4.548 90; 90; 90 | 385.975 | Raade, G.; Balic-Zunic T The crystal structure of (Be,_)(V,Ti)3O6, a mineral related to kyzylkumite The Canadian Mineralogist, 2006, 44, 1147-1158 |
9010482 | CIF | Be H Na O8 Si3 | P n m a | 12.7334; 13.6298; 7.3467 90; 90; 90 | 1275.05 | Gatta, G. D.; Rotiroti, N.; McIntyre, G. J.; Guastoni, A.; Nestola, F. New insights into the crystal chemistry of epididymite and eudidymite from Malosa, Malawi: A single-crystal neutron diffraction study American Mineralogist, 2008, 93, 1158-1165 |
9010453 | CIF | Cd2 Cu2 H10 O17 P2 S | P n m a | 10.4768; 20.8938; 6.164 90; 90; 90 | 1349.3 | Elliot, P.; Brugger, J.; Pring, A.; Cole, M. L.; Willis, A. C.; Kolitsch, U. Birchite, a new mineral from Broken Hill, New South Wales, Australia: Description and structure refinement American Mineralogist, 2008, 93, 910-917 |
9010276 | CIF | Al3 H O13 Si3 Sr2 | P n m a | 16.3548; 5.5985; 10.26 90; 90; 90 | 939.43 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au21, X(Sr) = 1 American Mineralogist, 2007, 92, 1133-1147 |
9010275 | CIF | Al3 Ca0.26 H O13 Si3 Sr1.74 | P n m a | 16.3376; 5.5936; 10.2407 90; 90; 90 | 935.857 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au44, X(Sr) = .87 American Mineralogist, 2007, 92, 1133-1147 |
9010274 | CIF | Al3 Ca0.28 H O13 Si3 Sr1.72 | P n m a | 16.3432; 5.5943; 10.2378 90; 90; 90 | 936.029 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au33, X(Sr) = .86 American Mineralogist, 2007, 92, 1133-1147 |
9010273 | CIF | Al3 Ca0.46 H O13 Si3 Sr1.54 | P n m a | 16.3229; 5.5871; 10.2132 90; 90; 90 | 931.42 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au22, X(Sr) = .77 American Mineralogist, 2007, 92, 1133-1147 |
9010272 | CIF | Al3 Ca0.67 H O13 Si3 Sr1.33 | P n m a | 16.3095; 5.5814; 10.1907 90; 90; 90 | 927.658 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au23, X(Sr) = .66 American Mineralogist, 2007, 92, 1133-1147 |
9010271 | CIF | Al3 Ca0.73 H O13 Si3 Sr1.27 | P n m a | 16.3048; 5.5769; 10.1819 90; 90; 90 | 925.843 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt2, X(Sr) = .63 American Mineralogist, 2007, 92, 1133-1147 |
9010270 | CIF | Al3 Ca0.96 H O13 Si3 Sr1.04 | P n m a | 16.2864; 5.5719; 10.1606 90; 90; 90 | 922.036 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt36, X(Sr) = .52 American Mineralogist, 2007, 92, 1133-1147 |
9010269 | CIF | Al3 Ca1.15 H O13 Si3 Sr0.85 | P n m a | 16.2798; 5.5676; 10.1388 90; 90; 90 | 918.975 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt3, X(Sr) = .42 American Mineralogist, 2007, 92, 1133-1147 |
9010268 | CIF | Al3 Ca1.24 H O13 Si3 Sr0.76 | P n m a | 16.253; 5.563; 10.1196 90; 90; 90 | 914.968 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au42, X(Sr) = .37 American Mineralogist, 2007, 92, 1133-1147 |
9010267 | CIF | Al3 Ca1.37 H O13 Si3 Sr0.63 | P n m a | 16.2435; 5.5592; 10.1083 90; 90; 90 | 912.788 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au30, X(Sr) = .32 American Mineralogist, 2007, 92, 1133-1147 |
9010266 | CIF | Al3 Ca1.5 H O13 Si3 Sr0.5 | P n m a | 16.2383; 5.5603; 10.1019 90; 90; 90 | 912.099 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au34, X(Sr) = .24 American Mineralogist, 2007, 92, 1133-1147 |
9010265 | CIF | Al3 Ca1.5 H O13 Si3 Sr0.5 | P n m a | 16.2278; 5.5576; 10.0893 90; 90; 90 | 909.93 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au31, X(Sr) = .25 American Mineralogist, 2007, 92, 1133-1147 |
9010264 | CIF | Al3 Ca1.57 H O13 Si3 Sr0.43 | P n m a | 16.2384; 5.558; 10.0877 90; 90; 90 | 910.445 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt4, X(Sr) = .22 American Mineralogist, 2007, 92, 1133-1147 |
9010263 | CIF | Al3 Ca1.68 H O13 Si3 Sr0.32 | P n m a | 16.21; 5.5529; 10.0695 90; 90; 90 | 906.381 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au45, X(Sr) = .16 American Mineralogist, 2007, 92, 1133-1147 |
9010262 | CIF | Al3 Ca1.74 H O13 Si3 Sr0.26 | P n m a | 16.2023; 5.5512; 10.0589 90; 90; 90 | 904.72 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au40, X(Sr) = .13 American Mineralogist, 2007, 92, 1133-1147 |
9010261 | CIF | Al3 Ca1.89 H O13 Si3 Sr0.11 | P n m a | 16.1941; 5.5505; 10.0483 90; 90; 90 | 903.195 | Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M. Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au32, X(Sr) = .06 American Mineralogist, 2007, 92, 1133-1147 |
9010053 | CIF | Fe Ni0.13 P0.97 Si0.03 Ti0.87 | P n m a | 6.007; 3.602; 6.897 90; 90; 90 | 149.232 | Ivanov, A. V.; Zolensky, M. E.; Saito, A.; Ohsumi, K.; Yang, S. V.; Kononkova, N. N.; Mikouchi, T. Florenskyite, FeTiP, a new phosphide from the Kaidun meteorite American Mineralogist, 2000, 85, 1082-1086 |
9010012 | CIF | Be2 H Na2 O16 Si6 | P n m a | 12.74; 13.63; 7.33 90; 90; 90 | 1272.83 | Robinson, P. D.; Fang, J. H. The crystal structure of epididymite Locality: Narsarsuk, Greenland American Mineralogist, 1970, 55, 1541-1549 |
9009958 | CIF | Al Ge3 O8 Rb | P n m a | 8.848; 9.55; 10.01 90; 90; 90 | 845.829 | Tripathi, A.; Parise, J. B. Hydrothermal synthesis and structural characterization of the aluminogermanate analogues of JBW, montesommaite, analcime and paracelsian Sample: Rb-AlGe-Para Microporous and Mesoporous Materials, 2002, 52, 65-78 |
9009912 | CIF | Ru Sb | P n m a | 5.9608; 3.7023; 6.5797 90; 90; 90 | 145.205 | Endresen, K.; Furuseth, S.; Selte, K.; Kjekshus, A.; Rakke, T.; Andresen, A. F. On the MnP type structure of RuSb and RhSb Acta Chemica Scandinavica A, 1977, 31, 249-252 |
9009911 | CIF | Rh Sb | P n m a | 5.9718; 3.8621; 6.3242 90; 90; 90 | 145.859 | Endresen, K.; Furuseth, S.; Selte, K.; Kjekshus, A.; Rakke, T.; Andresen, A. F. On the MnP type structure of RuSb and RhSb Acta Chemica Scandinavica A, 1977, 31, 249-252 |
9009906 | CIF | C2 Cr3 | P n m a | 5.5329; 2.829; 11.4719 90; 90; 90 | 179.565 | Rundqvist, S.; Runnsjo, G. Crystal structure refinement of Cr3C2 Note: values obtained from intensities measured with scintillation counter Acta Chemica Scandinavica, 1969, 23, 1191-1199 |
9009905 | CIF | C2 Cr3 | P n m a | 5.5329; 2.829; 11.4719 90; 90; 90 | 179.565 | Rundqvist, S.; Runnsjo, G. Crystal structure refinement of Cr3C2 Note: values obtained from intensities recorded photographically Acta Chemica Scandinavica, 1969, 23, 1191-1199 |
9009846 | CIF | Ca5 O12 S Si2 | P n m a | 6.863; 15.387; 10.181 90; 90; 90 | 1075.12 | Irran, E.; Tillmanns, E.; Hentschel, G. Ternesite, Ca5(SiO4)2SO4, a new mineral from the Ettringer Bellerberg/Eifel, Germany Locality: Ettringer Bellerberg volcano, Eifel, Germany Mineralogy and Petrology, 1997, 60, 121-132 |
9009831 | CIF | O4 S Zn | P n m a | 8.604; 6.746; 4.774 90; 90; 90 | 277.095 | Wildner, M.; Giester, G. Crystal structure refinements of synthetic chalcocyanite (CuSO4) and zincosite (ZnSO4) Mineralogy and Petrology, 1988, 39, 201-209 |
9009830 | CIF | Cu O4 S | P n m a | 8.409; 6.709; 4.833 90; 90; 90 | 272.658 | Wildner, M.; Giester, G. Crystal structure refinements of synthetic chalcocyanite (CuSO4) and zincosite (ZnSO4) Mineralogy and Petrology, 1988, 39, 201-209 |
9009805 | CIF | As O4 P | P n m a | 8.4315; 5.0229; 7.2039 90; 90; 90 | 305.089 | Bodenstein, D.; Brehm, A.; Jones, P. G.; Schwarzmann, E.; Sheldrick, G. M. Preparation and crystal structure of arsenic(III) phosphorus(V) oxide, AsPO4 Zeitschrift fur Naturforschung B, 1982, 37, 136-137 |
9009773 | CIF | H Mn O2 | P n m a | 10.667; 2.871; 4.554 90; 90; 90 | 139.466 | Kohler, T.; Armbruster, T.; Libowitzky, E. Hydrogen bonding and Jahn-Teller distortion in groutite, alpha-MnOOH, and manganite, gamma-MnOOH, and their relations to the manganese dioxides ramsdellite and pyrolusite Journal of Solid State Chemistry, 1997, 133, 486-500 |
9009576 | CIF | Fe H9 O12 S2 | P n m a | 9.724; 18.333; 5.421 90; 90; 90 | 966.402 | Mereiter, K. Die kristallstruktur von rhomboklas, H5O2+{Fe[SO4]2*2H2O}- Note: synthetic crystal Tschermaks Mineralogische und Petrographische Mitteilungen, 1974, 21, 216-232 |
9009515 | CIF | Cr O4 Pb | P n m a | 8.79861; 5.73422; 7.27402 90; 90; 90 | 366.997 | Knight, K. S. A high temperature structural phase transition in crocoite (PbCrO4) at 1068 K: crystal structure refinement at 1073 K and thermal expansion tensor determination at 1000 K Sample: the high temperature form at T = 1073 K Mineralogical Magazine, 2000, 64, 291-300 |
9009506 | CIF | Ba0.13 O4 S Sr0.87 | P n m a | 8.408; 5.372; 6.897 90; 90; 90 | 311.522 | Brigatti, M. F.; Galli, E.; Medici, L. Ba-rich celestine: new data and crystal structure refinement Mineralogical Magazine, 1997, 61, 447-451 |
9009503 | CIF | Cu S2 Sb | P n m a | 6.016; 3.7968; 14.499 90; 90; 90 | 331.18 | Razmara, M. F.; Henderson, C. M. B.; Pattrick, R. A. D.; Bell, A. M. T.; Charnock, L. M. The crystal chemistry of the solid solution series between chalcostibite (CuSbS2) and emplectite (CuBiS2) Note: synthetic Mineralogical Magazine, 1997, 61, 79-88 |
9009502 | CIF | Bi Cu S2 | P n m a | 6.1413; 3.9191; 14.524 90; 90; 90 | 349.569 | Razmara, M. F.; Henderson, C. M. B.; Pattrick, R. A. D.; Bell, A. M. T.; Charnock, L. M. The crystal chemistry of the solid solution series between chalcostibite (CuSbS2) and emplectite (CuBiS2) Note: synthetic Mineralogical Magazine, 1997, 61, 79-88 |
9009473 | CIF | Al6.43 B O17.25 Sb0.75 Si2.25 Ta0.27 | P n m a | 4.6914; 11.896; 20.383 90; 90; 90 | 1137.55 | Hoskins, B. F.; Mumme, W. G.; Pryce, M. W. Holtite, (Si2.25Sb0.75)B[Al6(Al0.43 Ta0.27[]0.30)O15(O,OH)2.25]: crystal structure and crystal chemistry Mineralogical Magazine, 1989, 53, 457-463 |
9009362 | CIF | Ca0.75 Ce0.25 Nb0.95 O6 Ta0.63 Ti0.42 | P n m a | 11.065; 7.527; 5.343 90; 90; 90 | 444.998 | Giuseppetti, G.; Tadini, P. The crystal structure of vigezzite, (Ca,Ce)(Nb,Ta,Ti)2O6, intermediate term of the aeschynite series Neues Jahrbuch fur Mineralogie, Monatshefte, 1990, 1990, 301-308 |
9009289 | CIF | Br4 H2 O Pt Rb2 | P n m a | 14.112; 10.885; 6.917 90; 90; 90 | 1062.51 | Rodek, E.; Sterzel, W.; Bartl, H.; Schuckmann, W. Kristallstruktur von Rb2PtBr4*H2O Neues Jahrbuch fur Mineralogie, Monatshefte, 1979, 1979, 277-281 |
9009264 | CIF | Pb0.41 S0.93 Se0.07 Sn0.59 | P n m a | 11.4085; 4.086; 4.2813 90; 90; 90 | 199.573 | Sejkora, J.; Berlepsch, P.; Makovicky, E.; Balic-Zunic T; Litochleb, J. Teallite from Radvanice near Trutnov (Czech Republic) Sample: Anisotropic refinement Neues Jahrbuch fur Mineralogie, Abhandlungen, 2002, 177, 163-180 |
9009263 | CIF | Pb0.39 S0.93 Se0.07 Sn0.61 | P n m a | 11.4085; 4.086; 4.2813 90; 90; 90 | 199.573 | Sejkora, J.; Berlepsch, P.; Makovicky, E.; Balic-Zunic T; Litochleb, J. Teallite from Radvanice near Trutnov (Czech Republic) Sample: Isotropic refinement Neues Jahrbuch fur Mineralogie, Abhandlungen, 2002, 177, 163-180 |
9008398 | CIF | H6 Mn O6 S | P n m a | 9.763; 5.635; 9.558 90; 90; 90 | 525.829 | Basso, R.; Lucchetti, G.; Palenzona, A. Gravegliaite, MnSO3*3H2O, a new mineral from Val Graveglia (Northern Apennines, Italy) Zeitschrift fur Kristallographie, 1991, 197, 97-106 |
9008396 | CIF | Al0.05 Ca0.02 Fe1.24 H2 Mg5.71 Mn0.02 Na0.01 O24 Si7.95 | P n m a | 18.544; 18.026; 5.282 90; 90; 90 | 1765.64 | Walitzi, E. M.; Walter, F.; Ettinger, K. Verfeinerung der kristallstruktur von anthophyllit vom Ochsenkogel/Gleinalpe, Osterreich Zeitschrift fur Kristallographie, 1989, 188, 237-244 |
9008256 | CIF | Cl2 Cu K2 O4 S | P n m a | 7.732; 6.078; 16.292 90; 90; 90 | 765.644 | Giacovazzo, C.; Scandale, E.; Scordari, F. The crystal structure of chlorotionite, CuK2Cl2SO4 Zeitschrift fur Kristallographie, 1976, 144, 226-237 |
9008200 | CIF | Bi Cu Pb S3 | P n m a | 11.638; 4.039; 11.319 90; 90; 90 | 532.06 | Ohmasa, M.; Nowacki, W. A redetermination of the crystal structure of aikinite [BiS2|S|CuIVPbVII] Zeitschrift fur Kristallographie, 1970, 132, 71-86 |
9008198 | CIF | C O3 Sr | P n m a | 6.02; 5.093; 8.376 90; 90; 90 | 256.807 | Pannhorst, W.; Lohn, J. Zur kristallstruktur von strontianit, SrCO3 Zeitschrift fur Kristallographie, 1970, 131, 455-459 |
9008106 | CIF | O4 S Sr | P n m a | 8.377; 5.35; 6.873 90; 90; 90 | 308.027 | Garske, D.; Peacor, D. R. Refinement of the structure of celestite SrSO4 Zeitschrift fur Kristallographie, 1965, 121, 204-210 |
9008091 | CIF | O4 S Sn | P n m a | 8.799; 5.319; 7.115 90; 90; 90 | 332.995 | Rentzeperis, P. J. The crystal structure of the anhydrous stannous sulphate Zeitschrift fur Kristallographie, 1962, 117, 431-436 |
9008011 | CIF | Cu S2 Sb | P n m a | 6.02; 3.791; 14.485 90; 90; 90 | 330.574 | Hofmann, W. Strukturelle und morphologische zusammenhange bei erzen vom formeltyp ABC2 Zeitschrift fur Kristallographie, 1932, 84, 177-203 |
9007990 | CIF | H8 Ni O12 P2 Zn2 | P n m a | 10.562; 18.224; 5.0133 90; 90; 90 | 964.969 | Wu, W. Y.; Liang, X. Q.; Li, Y. Z. NiZn2(PO4)2*4H2O, a nickel-doped modification of hopeite Acta Crystallographica, Section E, 2005, 61, i108-i110 |
9007989 | CIF | Co H8 O12 P2 Zn2 | P n m a | 10.568; 18.258; 5.025 90; 90; 90 | 969.576 | Wu, W. Y.; Liang, X. Q.; Li, Y. Z. CoZn2(PO4)2*4H2O, a cobalt-doped modification of hopeite Acta Crystallographica, Section E, 2005, 61, i105-i107 |
9007972 | CIF | Br Eu I | P n m a | 8.3723; 4.7404; 9.799 90; 90; 90 | 388.903 | Liao, W.; Liu, X.; Dronskowski, R. Europium(II) bromide iodide Acta Crystallographica, Section E, 2004, 60, i69-i71 |
9007960 | CIF | Rb2 S4 W | P n m a | 9.6254; 7.0218; 12.3761 90; 90; 90 | 836.471 | Yao, J.; Ibers, J. A. Dirubidium tetrathiotungstate, Rb2[WS4] Acta Crystallographica, Section E, 2004, 60, i10-i11 |
9007947 | CIF | Li3 Mo3 O12 Sc | P n m a | 5.13; 10.56; 17.745 90; 90; 90 | 961.296 | Kolitsch, U.; Tillmanns, E. Li3Sc(MoO4)3: substitutional disorder on three (Li,Sc) sites Acta Crystallographica, Section E, 2003, 59, i55-i58 |
9007923 | CIF | Cl2 Hg N4 O6 | P n m a | 15.5758; 5.4976; 11.2826 90; 90; 90 | 966.124 | Nockemann, P.; Meyer, G. Ammonium mercury(II) dichloride nitrate, (NH4)2HgCl2(NO3)2 Acta Crystallographica, Section E, 2002, 58, i68-i69 |
9007913 | CIF | H Mn O5 Pb V | P n m a | 7.646; 6.179; 9.507 90; 90; 90 | 449.155 | Kolitsch, U. Refinement of pyrobelonite, PbMnIIVO4(OH), a member of the descloizite group Acta Crystallographica, Section E, 2001, 57, i119-i121 |
9007904 | CIF | B Ga O4 Pb | P n m a | 6.9944; 5.8925; 8.2495 90; 90; 90 | 339.999 | Park, H.; Barbier, J. PbGaBO4, an orthoborate with a new structure-type Acta Crystallographica, Section E, 2001, 57, i82-i84 |
9007882 | CIF | Er5 Sb3 | P n m a | 11.662; 9.136; 8.007 90; 90; 90 | 853.098 | Borzone, G.; Fornasini, M. L. Structure of Er5Sb3 Acta Crystallographica, Section C, 1990, 46, 2456-2457 |
9007855 | CIF | C2 Ag N3 | P n m a | 16.133; 3.612; 5.983 90; 90; 90 | 348.644 | Britton, D. Silver dicyanamide, AgN(CN)2 - orthorhombic modification Acta Crystallographica, Section C, 1990, 46, 2297-2299 |
9007830 | CIF | Fe0.069 Mg0.931 S3 Si0.5 | P n m a | 12.677; 7.405; 5.913 90; 90; 90 | 555.072 | Fuhrmann, J.; Pickardt, J. Synthesis and structure of magnesium iron thiosilicates (Mg1-xFex)2SiS4 Acta Crystallographica, Section C, 1990, 46, 1996-1998 |
9007829 | CIF | Fe0.303 Mg0.697 S3 Si0.5 | P n m a | 12.633; 7.348; 5.901 90; 90; 90 | 547.774 | Fuhrmann, J.; Pickardt, J. Synthesis and structure of magnesium iron thiosilicates (Mg1-xFex)2SiS4 Acta Crystallographica, Section C, 1990, 46, 1996-1998 |
9007821 | CIF | C25 H12 Fe5 K7.64 N30 Na O10.47 | P n m a | 30; 11.272; 16.053 90; 90; 90 | 5428.48 | Marsh, R. E. On the structure of 'potassium nitroprusside 0.8 hydrate' Acta Crystallographica, Section C, 1990, 46, 1761-1763 |
9007807 | CIF | Ba Cu2 O7 Si2 | P n m a | 6.866; 13.19; 6.909 90; 90; 90 | 625.697 | Janczak, J.; Kubiak, R.; Glowiak, T. Structure of barium copper pyrosilicate at 300 K Acta Crystallographica, Section C, 1990, 46, 1383-1385 |
9007798 | CIF | Al H14 Na O9.25 Si3 | P n m a | 9.868; 10.082; 10.098 90; 90; 90 | 1004.64 | Hansen, S.; Hakansson, U.; Falth, L. Structure of synthetic zeolite Na-P2 Acta Crystallographica, Section C, 1990, 46, 1361-1362 |
9007791 | CIF | Gd Si | P n m a | 7.973; 3.858; 5.753 90; 90; 90 | 176.961 | Nagaki, D. A.; Simon, A. Structure of gadolinium monosilicide Acta Crystallographica, Section C, 1990, 46, 1197-1199 |
9007754 | CIF | Mo3 N2 O10 | P n m a | 13.182; 7.589; 9.286 90; 90; 90 | 928.955 | Range, K. J.; Fassler, A. Diammonium trimolybdate(VI), (NH4)2Mo3O10 Acta Crystallographica, Section C, 1990, 46, 488-489 |
9007750 | CIF | B2 Ba2 Cu O6 | P n m a | 8.023; 11.29; 13.889 90; 90; 90 | 1258.06 | Smith, R. W.; Keszler, D. A. Structure of Ba2Cu(BO3)2 Acta Crystallographica, Section C, 1990, 46, 370-372 |
9007748 | CIF | S4 Tm2 Zn | P n m a | 13.308; 7.769; 6.285 90; 90; 90 | 649.805 | Lemoine, P.; Tomas, A.; Vovan, T.; Guittard, M. Structure du sulfure de thulium et de zinc ZnTm2S4 Acta Crystallographica, Section C, 1990, 46, 365-368 |
9007746 | CIF | Ba H8 O5 | P n m a | 7.64; 11.403; 5.965 90; 90; 90 | 519.664 | Lutz, H. D.; Kellersohn, T.; Vogt, T. Hydrogen bonding in barium hydroxide trihydrate by neutron diffraction Acta Crystallographica, Section C, 1990, 46, 361-363 |
9007718 | CIF | Cl Cu2 H3 O3 | P n m a | 6.03; 6.865; 9.12 90; 90; 90 | 377.531 | Parise, J. B.; Hyde, B. G. The structure of atacamite and its relationship to spinel Acta Crystallographica, Section C, 1986, 42, 1277-1280 |
9007708 | CIF | C13 H10 | P n m a | 8.365; 18.745; 5.654 90; 90; 90 | 886.558 | Gerkin, R. E.; Lundstedt, A. P.; Reppart, W. J. Structure of fluorene, C~13~H~10~, at 159 K Acta Crystallographica Section C, 1984, 40, 1892-1894 |
9007655 | CIF | Fe S | P n m a | 5.65; 3.3155; 5.7426 90; 90; 90 | 107.574 | King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 6.35 GPa, MnP-type structure Acta Crystallographica, Section B, 1982, 38, 1877-1887 |
9007654 | CIF | Fe S | P n m a | 5.716; 3.347; 5.797 90; 90; 90 | 110.905 | King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 4.15 GPa, MnP-type structure Note: a cell edge altered from value reported Acta Crystallographica, Section B, 1982, 38, 1877-1887 |
9007653 | CIF | Fe S | P n m a | 5.825; 3.4675; 6.0059 90; 90; 90 | 121.308 | King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 463 K, P = 0.0001 GPa, MnP-type structure Acta Crystallographica, Section B, 1982, 38, 1877-1887 |
9007637 | CIF | As O2 | P n m a | 8.597; 5.235; 7.269 90; 90; 90 | 327.143 | Jones, P. G.; Beesk, W.; Sheldrick, G. M.; Schwarzmann, E. Arsenic dioxide Acta Crystallographica, Section B, 1980, 36, 439-440 |
9007524 | CIF | Bi Cu Pb S3 | P n m a | 11.608; 4.0279; 11.275 90; 90; 90 | 527.172 | Kohatsu, I.; Wuensch, B. J. The crystal structure of aikinite, PbCuBiS3 Note: B(3,3) altered for Pb and Cu, in order to reproduce Biso Acta Crystallographica, Section B, 1971, 27, 1245-1252 |
9007514 | CIF | Cu7 S4 | P n m a | 7.89; 7.84; 11.01 90; 90; 90 | 681.052 | Koto, K.; Morimoto, N. The crystal structure of anilite Acta Crystallographica, Section B, 1970, 26, 915-924 |
9007508 | CIF | B F4 K | P n m a | 8.6588; 5.48; 7.0299 90; 90; 90 | 333.57 | Brunton, G. The crystal structure of KBF4 Acta Crystallographica, Section B, 1969, 25, 2161-2162 |
9007444 | CIF | O4 S Zn | P n m a | 8.58; 6.73; 4.77 90; 90; 90 | 275.436 | Kokkoros, P. A.; Rentzeperis, P. J. The crystal structure of the anhydrous sulphates of copper and zinc Acta Crystallographica, 1958, 11, 361-364 |
9007405 | CIF | Bi2 S3 | P n m a | 10.634; 3.8423; 10.463 90; 90; 90 | 427.508 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 9.18 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007404 | CIF | Bi2 S3 | P n m a | 10.659; 3.8525; 10.51 90; 90; 90 | 431.581 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 8.30 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007403 | CIF | Bi2 S3 | P n m a | 10.701; 3.8655; 10.565 90; 90; 90 | 437.018 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 7.22 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007402 | CIF | Bi2 S3 | P n m a | 10.758; 3.8833; 10.65 90; 90; 90 | 444.92 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 5.92 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007401 | CIF | Bi2 S3 | P n m a | 10.907; 3.9191; 10.822 90; 90; 90 | 462.593 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 3.53 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007400 | CIF | Bi2 S3 | P n m a | 10.987; 3.9353; 10.903 90; 90; 90 | 471.415 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 2.43 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007399 | CIF | Bi2 S3 | P n m a | 11.136; 3.9574; 11.035 90; 90; 90 | 486.308 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = .97 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007398 | CIF | Bi2 S3 | P n m a | 11.269; 3.9717; 11.129 90; 90; 90 | 498.102 | Lundegaard, L. F.; Makovicky, E.; Boffa Ballaran, T.; Balic-Zunic T Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Sample: P = .0001 GPa Physics and Chemistry of Minerals, 2005, 32, 578-584 |
9007376 | CIF | Bi2 Se3 | P n m a | 11.83; 4.09; 11.62 90; 90; 90 | 562.23 | Caracas, R.; Gonze, X. First-principles study of the electronic properties of A2B3 minerals, with A=Bi,Sb and B=S,Se Note: Hypothetical sulphosalt structure derived from density functional theory Physics and Chemistry of Minerals, 2005, 32, 295-300 |
9007375 | CIF | Bi2 S3 | P n m a | 11.305; 3.981; 11.147 90; 90; 90 | 501.673 | Caracas, R.; Gonze, X. First-principles study of the electronic properties of A2B3 minerals, with A=Bi,Sb and B=S,Se Note: Hypothetical sulphosalt structure derived from density functional theory Physics and Chemistry of Minerals, 2005, 32, 295-300 |
9007374 | CIF | Sb2 Se3 | P n m a | 11.794; 3.986; 11.648 90; 90; 90 | 547.583 | Caracas, R.; Gonze, X. First-principles study of the electronic properties of A2B3 minerals, with A=Bi,Sb and B=S,Se Note: Hypothetical sulphosalt structure derived from density functional theory Physics and Chemistry of Minerals, 2005, 32, 295-300 |
9007373 | CIF | S3 Sb2 | P n m a | 11.311; 3.836; 11.229 90; 90; 90 | 487.215 | Caracas, R.; Gonze, X. First-principles study of the electronic properties of A2B3 minerals, with A=Bi,Sb and B=S,Se Note: Hypothetical sulphosalt structure derived from density functional theory Physics and Chemistry of Minerals, 2005, 32, 295-300 |
9007246 | CIF | S3 Sb2 | P n m a | 10.508; 3.7409; 10.579 90; 90; 90 | 415.854 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 7.832 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007245 | CIF | S3 Sb2 | P n m a | 10.529; 3.7458; 10.604 90; 90; 90 | 418.217 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 7.406 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007244 | CIF | S3 Sb2 | P n m a | 10.836; 3.7919; 10.884 90; 90; 90 | 447.213 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 3.235 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007243 | CIF | S3 Sb2 | P n m a | 10.959; 3.806; 10.983 90; 90; 90 | 458.1 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 2.118 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007242 | CIF | S3 Sb2 | P n m a | 11.044; 3.8124; 11.043 90; 90; 90 | 464.956 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 1.591 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007241 | CIF | S3 Sb2 | P n m a | 11.098; 3.8232; 11.091 90; 90; 90 | 470.59 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 1.115 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007240 | CIF | S3 Sb2 | P n m a | 11.299; 3.8313; 11.227 90; 90; 90 | 486.015 | Lundegaard, L. F.; Miletich, R.; Balic-Zunic T; Makovicky, E. Equation of state and crystal structure of Sb2S3 between 0 and 10 GPa Sample: Romania, P = 0.0001 GPa Physics and Chemistry of Minerals, 2003, 30, 463-468 |
9007051 | CIF | S3 Sb2 | P n m a | 11.314; 3.837; 11.234 90; 90; 90 | 487.688 | Kyono, A.; Kimata, M.; Matsuhisa, M.; Miyashita, Y.; Okamoto, K. Low-temperature crystal structures of stibnite implying orbital overlap of Sb 5s2 inert pair electrons Sample: T = 293 K Physics and Chemistry of Minerals, 2002, 29, 254-260 |
9007050 | CIF | S3 Sb2 | P n m a | 11.305; 3.836; 11.223 90; 90; 90 | 486.696 | Kyono, A.; Kimata, M.; Matsuhisa, M.; Miyashita, Y.; Okamoto, K. Low-temperature crystal structures of stibnite implying orbital overlap of Sb 5s2 inert pair electrons Sample: T = 225 K Physics and Chemistry of Minerals, 2002, 29, 254-260 |
9007049 | CIF | S3 Sb2 | P n m a | 11.299; 3.828; 11.214 90; 90; 90 | 485.034 | Kyono, A.; Kimata, M.; Matsuhisa, M.; Miyashita, Y.; Okamoto, K. Low-temperature crystal structures of stibnite implying orbital overlap of Sb 5s2 inert pair electrons Sample: T = 173 K Physics and Chemistry of Minerals, 2002, 29, 254-260 |
9007048 | CIF | S3 Sb2 | P n m a | 11.292; 3.828; 11.205 90; 90; 90 | 484.345 | Kyono, A.; Kimata, M.; Matsuhisa, M.; Miyashita, Y.; Okamoto, K. Low-temperature crystal structures of stibnite implying orbital overlap of Sb 5s2 inert pair electrons Sample: T = 128 K Physics and Chemistry of Minerals, 2002, 29, 254-260 |
9007046 | CIF | Fe2 O4 Si | P n m a | 10.4597; 6.0818; 4.815 90; 90; 90 | 306.3 | Lottermoser, W.; Steiner, K.; Grodzicki, M.; Jiang, K.; Scharfetter, G.; Bats, J. W.; Redhammer, G. J.; Treutmann, W.; Hosoya, S.; Amthauer, G. The electric field gradient in synthetic fayalite alpha-Fe2SiO4 at moderate temperatures Sample: T = 153 K Physics and Chemistry of Minerals, 2002, 29, 112-121 |
9005749 | CIF | Fe H9.384 O12 S2 | P n m a | 9.7226; 18.28; 5.427 90; 90; 90 | 964.536 | Majzlan J; Navrotsky A; McCleskey R B; Alpers C N Thermodynamic properties and crystal structure refinement of ferricopiapite, coquimbite, rhomboclase, and Fe2(SO4)3(H2O)5 Locality: synthetic European Journal of Mineralogy, 2006, 18, 175-186 |
9005701 | CIF | Al6.61 B F0.009 Fe0.02 H0.849 Mg0.12 O17.991 Si2.83 Ti0.09 | P n m a | 4.6948; 11.8037; 20.2106 90; 90; 90 | 1119.99 | Fuchs, Y.; Ertl, A.; Hughes, J. M.; Prowatke, S.; Brandstatter, F.; Schuster, R. Dumortierite from the Gfohl unit, Lower Austria: chemistry, structure, and infra-red spectroscopy Sample: DUM2 European Journal of Mineralogy, 2005, 17, 173-183 |
9005700 | CIF | Al6.64 B F0.021 Fe0.04 H0.81 Mg0.09 O17.979 Si2.84 Ti0.07 | P n m a | 4.69; 11.7875; 20.1823 90; 90; 90 | 1115.75 | Fuchs, Y.; Ertl, A.; Hughes, J. M.; Prowatke, S.; Brandstatter, F.; Schuster, R. Dumortierite from the Gfohl unit, Lower Austria: chemistry, structure, and infra-red spectroscopy Sample: DUM1 European Journal of Mineralogy, 2005, 17, 173-183 |
9005673 | CIF | B Cu2 H5 O6 | P n m a | 9.455; 5.866; 8.668 90; 90; 90 | 480.754 | Kampf, A. R.; Favreau, G. Jacquesdietrichite, Cu2[BO(OH)2](OH)3, a new mineral from the Tachgagalt mine, Morocco: Description and crystal structure European Journal of Mineralogy, 2004, 16, 361-366 |
9005641 | CIF | As5 Ca Cu5 H6 K O22 | P n m a | 19.647; 10.087; 9.963 90; 90; 90 | 1974.46 | Sarp, H.; Cerny, R. Calcio-andyrobertsite-2O, KCaCu5(AsO4)4[AsO2(OH)2]*2H2O: its description, crystal structure and relation with calcio-andyrobertsite-1M Note: polytype 2O European Journal of Mineralogy, 2004, 16, 163-169 |
9005510 | CIF | Cl2 O2 Pb3 | P n m a | 11.879; 5.808; 9.505 90; 90; 90 | 655.781 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of lead oxide chlorides. I. Crystal structures of synthetic mendipite, Pb3O2Cl2, and synthetic damaraite, Pb3O2(OH)Cl European Journal of Mineralogy, 2001, 13, 801-809 |
9005460 | CIF | As2 Cu3 H8 O12 | P n m a | 5.6906; 17.061; 9.732 90; 90; 90 | 944.854 | Sarp, H.; Cerny, R. Rollandite, Cu3(AsO4)2.4H2O, a new mineral: its description and crystal structure European Journal of Mineralogy, 2000, 12, 1045-1050 |
9005441 | CIF | Ca2 Fe1.445 Ga0.555 O5 | P n m a | 5.42; 14.721; 5.599 90; 90; 90 | 446.732 | Kahlenberg, V.; Fischer, R. X. Crystal growth and cation distribution in doped dicalcium ferrite Ca2(Fe1-xMex)2O5 (Me=Al,Ga) Sample: Me = Ga European Journal of Mineralogy, 2000, 12, 129-135 |
9005440 | CIF | Al0.135 Ca2 Fe1.865 O5 | P n m a | 5.42; 14.743; 5.597 90; 90; 90 | 447.24 | Kahlenberg, V.; Fischer, R. X. Crystal growth and cation distribution in doped dicalcium ferrite Ca2(Fe1-xMex)2O5 (Me=Al,Ga) Sample: Me = Al European Journal of Mineralogy, 2000, 12, 129-135 |
9005426 | CIF | Ca0.01 Ce0.005 Dy0.042 Er0.023 Fe0.03 Gd0.042 La0.001 Nb0.36 Nd0.015 O6 Pr0.001 Sm0.017 Ta0.22 Th0.07 Ti1.41 U0.04 W0.05 Y0.65 Yb0.018 | P n m a | 11.031; 7.448; 5.188 90; 90; 90 | 426.24 | Bonazzi, P.; Menchetti, S. Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: VV Locality: western Alps European Journal of Mineralogy, 1999, 11, 1043-1049 |
9005425 | CIF | Ce0.001 Dy0.076 Er0.041 Fe0.01 Gd0.056 Nb0.17 Nd0.005 O6 Sm0.013 Ta0.01 Th0.04 Ti1.8 U0.08 W0.06 Y0.61 Yb0.025 | P n m a | 10.881; 7.484; 5.156 90; 90; 90 | 419.871 | Bonazzi, P.; Menchetti, S. Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: CE - note: O1 z coordinate altered to match reported bond lengths Locality: western Alps European Journal of Mineralogy, 1999, 11, 1043-1049 |
9005424 | CIF | Ca0.02 Ce0.011 Dy0.079 Er0.034 Gd0.091 Nb0.09 Nd0.026 O6 Pr0.002 Sm0.016 Ta0.01 Th0.1 Ti1.81 U0.03 W0.11 Y0.55 Yb0.022 | P n m a | 10.904; 7.49; 5.189 90; 90; 90 | 423.791 | Bonazzi, P.; Menchetti, S. Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: TR2 Locality: western Alps European Journal of Mineralogy, 1999, 11, 1043-1049 |
9005423 | CIF | Ca0.01 Ce0.009 Dy0.071 Er0.043 Gd0.072 La0.001 Nb0.03 Nd0.032 O6.02 Pr0.003 Sm0.034 Th0.12 Ti1.95 U0.02 W0.02 Y0.54 Yb0.03 | P n m a | 10.803; 7.532; 5.18 90; 90; 90 | 421.487 | Bonazzi, P.; Menchetti, S. Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: MI Locality: western Alps European Journal of Mineralogy, 1999, 11, 1043-1049 |
9005422 | CIF | Ca0.01 Ce0.005 Dy0.065 Er0.034 Gd0.068 Nb0.05 Nd0.011 O6 Pr0.001 Sm0.01 Th0.06 Ti1.95 U0.004 W0.03 Y0.639 Yb0.025 | P n m a | 10.862; 7.483; 5.15 90; 90; 90 | 418.594 | Bonazzi, P.; Menchetti, S. Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: TR1 Locality: western Alps European Journal of Mineralogy, 1999, 11, 1043-1049 |
9005393 | CIF | Al0.283 B Cr0.005 Fe0.665 Mg0.969 O4 Ti0.077 | P n m a | 9.174; 3.084; 9.337 90; 90; 90 | 264.168 | Appel, P. W. U.; Bigi, S.; Brigatti, M. F. Crystal structure and chemistry of yuanfuliite and its relationships with warwickite Sample: 425360 European Journal of Mineralogy, 1999, 11, 483-491 |
9005392 | CIF | Al0.226 B Cr0.018 Fe0.717 Mg0.963 Mn0.005 O4 Ti0.07 | P n m a | 9.198; 3.091; 9.355 90; 90; 90 | 265.972 | Appel, P. W. U.; Bigi, S.; Brigatti, M. F. Crystal structure and chemistry of yuanfuliite and its relationships with warwickite Sample: 425359 European Journal of Mineralogy, 1999, 11, 483-491 |
9005379 | CIF | Cu3 Mo0.742 O9 S1.258 | P n m a | 7.421; 6.754; 13.624 90; 90; 90 | 682.854 | Berlepsch, P.; Armbruster, T.; Brugger, J.; Bykova, E. Y.; Kartashov, P. M. The crystal structure of vergasovaite Cu3O[(Mo,S)O4SO4], and its relation to synthetic Cu3O[MoO4]2 European Journal of Mineralogy, 1999, 11, 101-110 |
9005283 | CIF | Ca O8 P2 U | P n m a | 13.926; 6.958; 6.136 90; 90; 90 | 594.561 | Dusausoy, Y.; Ghermani, N. E.; Podor, R.; Cuney, M. Low-temperature ordered phase of CaU(PO4)2: synthesis and crystal structure European Journal of Mineralogy, 1996, 8, 667-673 |
9004912 | CIF | As2 H22 O23 Sr0.84 U2 | P n m a | 14.3778; 20.9611; 7.1703 90; 90; 90 | 2160.95 | Locock, A. J.; Burns, P. C.; Flynn, T. M. Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet Sample: SrUAs11 The Canadian Mineralogist, 2005, 43, 721-733 |
9004910 | CIF | H22 O23 P2 Sr0.795 U2 | P n m a | 14.042; 21.008; 6.997 90; 90; 90 | 2064.07 | Locock, A. J.; Burns, P. C.; Flynn, T. M. Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet Sample: SrUP11 The Canadian Mineralogist, 2005, 43, 721-733 |
9004836 | CIF | B2 O8 Si2 Sr | P n m a | 8.155; 7.919; 8.921 90; 90; 90 | 576.113 | Pautov, L. A.; Agakhanov, A. A.; Sokolova, E. V.; Hawthorne, F. C. Maleevite, BaB2Si2O8, and pekovite, SrB2Si2O8, new mineral species from the Dara-i-Pioz alkaline massif, Northern Tajikistan: Description and crystal structure Locality: Dara-i-Pioz alkaline massif, Northern Tajikistan The Canadian Mineralogist, 2004, 42, 107-119 |
9004835 | CIF | B2 Ba O8 Si2 | P n m a | 8.141; 8.176; 9.038 90; 90; 90 | 601.577 | Pautov, L. A.; Agakhanov, A. A.; Sokolova, E. V.; Hawthorne, F. C. Maleevite, BaB2Si2O8, and pekovite, SrB2Si2O8, new mineral species from the Dara-i-Pioz alkaline massif, Northern Tajikistan: Description and crystal structure Locality: Dara-i-Pioz alkaline massif, Northern Tajikistan The Canadian Mineralogist, 2004, 42, 107-119 |
9004784 | CIF | O9 Pb4 V2 | P n m a | 22.7276; 11.5346; 7.4349 90; 90; 90 | 1949.09 | Krivovichev, S. V.; Burns, P. C. Chains of edge-sharing OPb4 tetrahedra in the structure of Pb4O(VO4)2 and in related minerals and inorganic compounds The Canadian Mineralogist, 2003, 41, 951-958 |
9004625 | CIF | Ba H8 O9 Si2 | P n m a | 5.0453; 9.044; 18.366 90; 90; 90 | 838.035 | Basciano, L. C.; Groat, L. A.; Roberts, A. C.; Gault, R. A.; Dunning, G. E.; Walstrom, R. E. Bigcreekite: A new barium silicate mineral species from Fresno County, California Locality: Fresno County, California, USA The Canadian Mineralogist, 2001, 39, 761-768 |
9004394 | CIF | Cu H O5 Pb V | P n m a | 7.667; 6.053; 9.316 90; 90; 90 | 432.34 | Cooper, M. A.; Hawthorne, F. C. The crystal structure of mottramite, and the nature of Cu=Zn solid solution in the mottramite-descloizite series The Canadian Mineralogist, 1995, 33, 1119-1124 |
9004204 | CIF | Cu3 H4 O8 S | P n m a | 8.244; 6.043; 11.987 90; 90; 90 | 597.174 | Hawthorne, F. C.; Groat, L. A.; Eby, R. K. Antlerite, Cu3SO4(OH)4, a heteropolyhedral wallpaper structure The Canadian Mineralogist, 1989, 27, 205-209 |
9004150 | CIF | Ag0.33 Bi8.34 Pb5.33 S15.03 Se2.97 | P n m a | 53.68; 4.11; 15.4 90; 90; 90 | 3397.62 | Mumme, W. G. Weibullite Ag0.32Pb5.09Bi8.55Se6.08S11.92 from Falun, Sweden: A higher homologue of galenobismutite The Canadian Mineralogist, 1980, 18, 1-12 |
9004122 | CIF | Ba O4 S | P n m a | 8.8842; 5.4559; 7.1569 90; 90; 90 | 346.904 | Hill R J A further refinement of the barite structure The Canadian Mineralogist, 1977, 15, 522-526 |
9004091 | CIF | O4 S Sr | P n m a | 8.36; 5.352; 6.858 90; 90; 90 | 306.846 | Hawthorne, F. C.; Ferguson, R. B. Anhydrous sulphates. I: Refinement of the crystal structure of celestite with an appendix on the structure of thenardite The Canadian Mineralogist, 1975, 13, 181-187 |
9003869 | CIF | As0.98 Bi0.02 Br0.09 Cl0.45 I0.46 Pb2 S2.979 Se0.021 | P n m a | 11.543; 6.6764; 9.359 90; 90; 90 | 721.258 | Zelenski, M.; Balic-Zunic T; Bindi, L.; Garavelli, A.; Makovicky, E.; Pinto, D.; Vurro, F. First occurrence of iodine in natural sulfosalts: the case of mutnovskite, Pb2AsS3(I,Cl,Br), a new mineral from Mutnovsky volcano, Kamchatka Peninsula, Russian Federation Locality: Mutnovsky volcano, Kamchatka Peninsula, Russian Federation American Mineralogist, 2006, 91, 21-28 |
9003720 | CIF | Al1.33 F0.1 Fe1.26 H1.9 Li1.93 Mg2.42 Mn0.04 Na0.05 O23.9 Si8 Zn0.01 | P n m a | 18.336; 17.693; 5.2755 90; 90; 90 | 1711.47 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Norway American Mineralogist, 2005, 90, 1167-1176 |
9003719 | CIF | Al1.3 F0.13 Fe1.3 H1.87 Li1.93 Mg2.32 Mn0.06 Na0.1 O23.87 Si8 Zn0.01 | P n m a | 18.335; 17.693; 5.2743 90; 90; 90 | 1710.99 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Uto, Sweden American Mineralogist, 2005, 90, 1167-1176 |
9003718 | CIF | Al1.34 F0.09 Fe1.26 H1.91 Li1.98 Mg2.35 Mn0.04 Na0.05 O23.91 Si8 Zn0.01 | P n m a | 18.3345; 17.6955; 5.2764 90; 90; 90 | 1711.86 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Zaire American Mineralogist, 2005, 90, 1167-1176 |
9003717 | CIF | Al1.76 F0.07 Fe1.2 H1.93 Li1.97 Mg2.01 Mn0.04 Na0.02 O23.93 Si8 Zn0.01 | P n m a | 18.2754; 17.6569; 5.2738 90; 90; 90 | 1701.79 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Rwanda American Mineralogist, 2005, 90, 1167-1176 |
9003716 | CIF | Al1.98 F0.02 Fe1.2 H1.98 Li1.71 Mg1.89 Mn0.01 Na0.03 O23.98 Si7.98 | P n m a | 18.277; 17.646; 5.2792 90; 90; 90 | 1702.63 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Siberia American Mineralogist, 2005, 90, 1167-1176 |
9003715 | CIF | Al1.97 F0.03 Fe1.23 H1.97 Li1.98 Mg1.8 Mn0.02 Na0.03 O23.97 Si7.99 Zn0.01 | P n m a | 18.277; 17.65; 5.2736 90; 90; 90 | 1701.21 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: HS 119915 Siberia American Mineralogist, 2005, 90, 1167-1176 |
9003714 | CIF | Al1.89 F0.03 Fe1.71 H1.97 K0.01 Li1.88 Mg1.47 Mn0.01 Na0.04 O23.97 Si8 | P n m a | 18.2872; 17.6797; 5.2784 90; 90; 90 | 1706.57 | Camara, F.; Oberti, R. The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Greenbushes, W Australia American Mineralogist, 2005, 90, 1167-1176 |
9003581 | CIF | Bi Cu S2 | P n m a | 6.134; 3.9111; 14.548 90; 90; 90 | 349.017 | Kyono, A.; Kimata, M. Crystal structures of chalcostibite (CuSbS2) and emplectite (CuBiS2): Structural relationship of stereochemical activity between chalcostibite and emplectite American Mineralogist, 2005, 90, 162-165 |
9003580 | CIF | Cu S2 Sb | P n m a | 6.018; 3.7958; 14.495 90; 90; 90 | 331.111 | Kyono, A.; Kimata, M. Crystal structures of chalcostibite (CuSbS2) and emplectite (CuBiS2): Structural relationship of stereochemical activity between chalcostibite and emplectite American Mineralogist, 2005, 90, 162-165 |
9003476 | CIF | Mn O2 | P n m a | 9.5155; 2.8644; 4.7061 90; 90; 90 | 128.27 | Post, J. E.; Heaney, P. J. Neutron and synchrotron X-ray diffraction study of the structures and dehydration behaviors of ramsdellite and "groutellite" American Mineralogist, 2004, 89, 969-975 |
9003475 | CIF | Mn O2 | P n m a | 9.2734; 2.8638; 4.5219 90; 90; 90 | 120.089 | Post, J. E.; Heaney, P. J. Neutron and synchrotron X-ray diffraction study of the structures and dehydration behaviors of ramsdellite and "groutellite" American Mineralogist, 2004, 89, 969-975 |
9003474 | CIF | Bi2 S3 | P n m a | 11.354; 3.9911; 11.188 90; 90; 90 | 506.984 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #3 American Mineralogist, 2004, 89, 932-940 |
9003473 | CIF | Bi2 S3 | P n m a | 11.345; 3.994; 11.193 90; 90; 90 | 507.176 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #2 American Mineralogist, 2004, 89, 932-940 |
9003472 | CIF | Bi2 S3 | P n m a | 11.316; 3.9709; 11.178 90; 90; 90 | 502.28 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #1 American Mineralogist, 2004, 89, 932-940 |
9003471 | CIF | Bi1.68 S3 Sb0.32 | P n m a | 11.318; 3.9547; 11.1631 90; 90; 90 | 499.652 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb0.320Bi1.680S3 American Mineralogist, 2004, 89, 932-940 |
9003470 | CIF | Bi1.638 S3 Sb0.362 | P n m a | 11.31; 3.9526; 11.119 90; 90; 90 | 497.063 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb0.362Bi1.638S3 American Mineralogist, 2004, 89, 932-940 |
9003469 | CIF | Bi1.612 S3 Sb0.388 | P n m a | 11.336; 3.9562; 11.186 90; 90; 90 | 501.664 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb0.387Bi1.613S3 American Mineralogist, 2004, 89, 932-940 |
9003468 | CIF | Bi1.09 S3 Sb0.91 | P n m a | 11.256; 3.8966; 11.205 90; 90; 90 | 491.453 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb.910Bi1.090S3 American Mineralogist, 2004, 89, 932-940 |
9003467 | CIF | Bi0.573 S3 Sb1.427 | P n m a | 11.318; 3.8872; 11.228 90; 90; 90 | 493.98 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb1.426Bi.574S3 American Mineralogist, 2004, 89, 932-940 |
9003466 | CIF | Bi0.536 S3 Sb1.464 | P n m a | 11.309; 3.871; 11.1876 90; 90; 90 | 489.761 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb1.463Bi.537S3 American Mineralogist, 2004, 89, 932-940 |
9003465 | CIF | Bi0.516 S3 Sb1.484 | P n m a | 11.318; 3.883; 11.226 90; 90; 90 | 493.358 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb1.483Bi.517S3 American Mineralogist, 2004, 89, 932-940 |
9003464 | CIF | Bi0.364 S3 Sb1.636 | P n m a | 11.274; 3.8739; 11.16 90; 90; 90 | 487.406 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb1.637Bi.363S3 American Mineralogist, 2004, 89, 932-940 |
9003463 | CIF | Bi0.064 S3 Sb1.936 | P n m a | 11.3122; 3.8428; 11.221 90; 90; 90 | 487.783 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb1.935Bi.065S3 American Mineralogist, 2004, 89, 932-940 |
9003462 | CIF | S3 Sb2 | P n m a | 11.3197; 3.8332; 11.233 90; 90; 90 | 487.407 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #4 American Mineralogist, 2004, 89, 932-940 |
9003461 | CIF | S3 Sb2 | P n m a | 11.2845; 3.822; 11.203 90; 90; 90 | 483.178 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #3 American Mineralogist, 2004, 89, 932-940 |
9003460 | CIF | S3 Sb2 | P n m a | 11.311; 3.8389; 11.223 90; 90; 90 | 487.323 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #2 American Mineralogist, 2004, 89, 932-940 |
9003459 | CIF | S3 Sb2 | P n m a | 11.282; 3.8296; 11.225 90; 90; 90 | 484.982 | Kyono, A.; Kimata, M. Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample #1 American Mineralogist, 2004, 89, 932-940 |
9003343 | CIF | Al0.46 Ca2 Fe1.54 O5 | P n m a | 5.3876; 14.6302; 5.5877 90; 90; 90 | 440.432 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bf80i_2 American Mineralogist, 2004, 89, 405-420 |
9003342 | CIF | Al0.441 Ca2 Fe1.559 O5 | P n m a | 5.3936; 14.6476; 5.5899 90; 90; 90 | 441.621 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht040_2 American Mineralogist, 2004, 89, 405-420 |
9003341 | CIF | Al0.408 Ca2 Fe1.592 O5 | P n m a | 5.3986; 14.6631; 5.591 90; 90; 90 | 442.585 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht035_1 American Mineralogist, 2004, 89, 405-420 |
9003340 | CIF | Al0.365 Ca2 Fe1.635 O5 | P n m a | 5.4027; 14.6779; 5.5923 90; 90; 90 | 443.471 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht030_3 American Mineralogist, 2004, 89, 405-420 |
9003339 | CIF | Al0.276 Ca2 Fe1.724 O5 | P n m a | 5.4071; 14.6949; 5.5941 90; 90; 90 | 444.489 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht025_2 American Mineralogist, 2004, 89, 405-420 |
9003338 | CIF | Al0.204 Ca2 Fe1.796 O5 | P n m a | 5.414; 14.7163; 5.5947 90; 90; 90 | 445.752 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht015_1 American Mineralogist, 2004, 89, 405-420 |
9003337 | CIF | Al0.114 Ca2 Fe1.886 O5 | P n m a | 5.4217; 14.7432; 5.596 90; 90; 90 | 447.306 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht005_2 American Mineralogist, 2004, 89, 405-420 |
9003336 | CIF | Ca2 Fe2 O5 | P n m a | 5.4268; 14.7631; 5.5969 90; 90; 90 | 448.403 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Amthauer, G. Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bx000_1 American Mineralogist, 2004, 89, 405-420 |
9003065 | CIF | Ca H18 K Mn12 O61 Si20 | P n m a | 16.8146; 25.2036; 13.3866 90; 90; 90 | 5673.09 | Hughes, J. M.; Rakovan, J. F.; Bracco, R.; Gunter, M. E. The atomic arrangemetn of the ganophyllite-group modulated layer silicates as determined from the orthorhombic dimorph of tamaite, with the elusive 16.8 A ganophyllite-group superstructure revealed Note: signs of the y-coordinates for O24 and O25 have been changed American Mineralogist, 2003, 88, 1324-1330 |
9002888 | CIF | Ca0.86 H22 O23 P2 U2 | P n m a | 14.0135; 20.7121; 6.9959 90; 90; 90 | 2030.55 | Locock, A. J.; Burns, P. C. The crystal structure of synthetic autunite, Ca[(UO2)(PO4)]2(H2O)11 American Mineralogist, 2003, 88, 240-244 |
9002809 | CIF | Fe1.5 Ni0.5 P | P n m a | 5.792; 3.564; 6.691 90; 90; 90 | 138.12 | Britvin, S. N.; Rudashevsky, N. S.; Krivovichev, S. V.; Burns, P. C.; Polekhovsky, Y. S. Allabogdanite, (Fe,Ni)2P, a new mineral from the Onello meteorite: The occurence and crystal structure American Mineralogist, 2002, 87, 1245-1249 |
9002770 | CIF | Al2.884 Ca2 Fe0.116 H O13 Si3 | P n m a | 16.1964; 5.558; 10.04 90; 90; 90 | 903.797 | Liebscher, A.; Gottschalk, M.; Franz, G. The substitution Fe-Al and the isosymmetric displacive phase transition in synthetic zoisite: A powder X-ray and infrared spectroscopic study Sample: Zo5, X(Fe/(Fe+Al-2)) = 0.116 American Mineralogist, 2002, 87, 909-921 |
9002769 | CIF | Al2.904 Ca2 Fe0.096 H O13 Si3 | P n m a | 16.1983; 5.5564; 10.0376 90; 90; 90 | 903.427 | Liebscher, A.; Gottschalk, M.; Franz, G. The substitution Fe-Al and the isosymmetric displacive phase transition in synthetic zoisite: A powder X-ray and infrared spectroscopic study Sample: Zo4, X(Fe/(Fe+Al-2)) = 0.096 American Mineralogist, 2002, 87, 909-921 |
9002768 | CIF | Al2.938 Ca2 Fe0.062 H O13 Si3 | P n m a | 16.2009; 5.5536; 10.0336 90; 90; 90 | 902.756 | Liebscher, A.; Gottschalk, M.; Franz, G. The substitution Fe-Al and the isosymmetric displacive phase transition in synthetic zoisite: A powder X-ray and infrared spectroscopic study Sample: Zo2, X(Fe/(Fe+Al-2)) = 0.062 American Mineralogist, 2002, 87, 909-921 |
9002767 | CIF | Al2.965 Ca2 Fe0.035 H O13 Si3 | P n m a | 16.19; 5.5511; 10.0332 90; 90; 90 | 901.707 | Liebscher, A.; Gottschalk, M.; Franz, G. The substitution Fe-Al and the isosymmetric displacive phase transition in synthetic zoisite: A powder X-ray and infrared spectroscopic study Sample: Zo1, X(Fe/(Fe+Al-2)) = 0.035 American Mineralogist, 2002, 87, 909-921 |
9002766 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.1913; 5.5488; 10.032 90; 90; 90 | 901.298 | Liebscher, A.; Gottschalk, M.; Franz, G. The substitution Fe-Al and the isosymmetric displacive phase transition in synthetic zoisite: A powder X-ray and infrared spectroscopic study Sample: Zo3, X(Fe/(Fe+Al-2)) = 0.0 American Mineralogist, 2002, 87, 909-921 |
9002390 | CIF | Fe0.01 Pb0.92 S3 Sn1.07 | P n m a | 8.8221; 3.7728; 14.0076 90; 90; 90 | 466.229 | Paar, W. H.; Miletich, R.; Topa, D.; Criddle, A. J.; De Brodtkorb, M. K.; Amthauer, G.; Tippelt, G. Suredaite, PbSnS3, a new mineral species, from the Pirquitas Ag-Sn deposit, NW-Argentina: Mineralogy and crystal structure American Mineralogist, 2000, 85, 1066-1075 |
9002159 | CIF | Fe H O2 | P n m a | 9.9189; 3.0148; 4.5835 90; 90; 90 | 137.063 | Gualtieri, A.; Venturelli, P. In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 156 C American Mineralogist, 1999, 84, 895-904 |
9002158 | CIF | Fe H O2 | P n m a | 9.9134; 3.0128; 4.58 90; 90; 90 | 136.791 | Gualtieri, A.; Venturelli, P. In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 25 C American Mineralogist, 1999, 84, 895-904 |
9001803 | CIF | Al2.88 Ca2 Fe0.12 H O13 Si3 | P n m a | 16.212; 5.555; 10.034 90; 90; 90 | 903.639 | Comodi, P.; Zanazzi, P. F. The pressure behavior of clinozoisite and zoisite: An X-ray diffraction study Sample: P = .001 kbar, room conditions American Mineralogist, 1997, 82, 61-68 |
9001566 | CIF | As S4 Tl3 | P n m a | 8.894; 10.855; 9.079 90; 90; 90 | 876.526 | Wilson, J. R.; Sen Gupta, P. K.; Robinson, P. D.; Criddle, A. J. Fangite, Tl3AsS4, a new thallium arsenic sulfosalt from the Mercur Au deposit, Utah, and revised optical data for gillulyite American Mineralogist, 1993, 78, 1096-1103 |
9001507 | CIF | H2 Mn5 O10 Si2 | P n m a | 10.732; 15.672; 4.811 90; 90; 90 | 809.171 | Freed, R. L.; Rouse, R. C.; Peacor, D. R. Ribbeite, a second example of edge-sharing silicate tetrahedra in the leucophoenicite group American Mineralogist, 1993, 78, 190-194 |
9001360 | CIF | Al0.01 B Cr0.23 Fe0.54 Mg1.12 O4 Ti0.1 | P n m a | 9.255; 3.0941; 9.402 90; 90; 90 | 269.235 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S7 American Mineralogist, 1991, 76, 1380-1388 |
9001359 | CIF | Al0.02 B Cr0.02 Fe0.61 Mg1.18 O4 Ti0.17 | P n m a | 9.242; 3.098; 9.383 90; 90; 90 | 268.651 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S6 American Mineralogist, 1991, 76, 1380-1388 |
9001358 | CIF | B Cr0.04 Fe0.65 Mg1.16 O4 Ti0.15 | P n m a | 9.246; 3.0993; 9.378 90; 90; 90 | 268.737 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S5 American Mineralogist, 1991, 76, 1380-1388 |
9001357 | CIF | Al0.02 B Cr0.17 Fe0.47 Mg1.18 O4 Ti0.16 | P n m a | 9.228; 3.084; 9.371 90; 90; 90 | 266.691 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S4 American Mineralogist, 1991, 76, 1380-1388 |
9001356 | CIF | Al0.04 B Cr0.18 Fe0.51 Mg1.15 O4 Ti0.12 | P n m a | 9.23; 3.0906; 9.378 90; 90; 90 | 267.519 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S3 American Mineralogist, 1991, 76, 1380-1388 |
9001355 | CIF | Al0.01 B Cr0.23 Fe0.5 Mg1.14 O4 Ti0.12 | P n m a | 9.226; 3.086; 9.369 90; 90; 90 | 266.749 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S2 American Mineralogist, 1991, 76, 1380-1388 |
9001354 | CIF | Al0.02 B Cr0.02 Fe0.85 Mg1.07 O4 Ti0.04 | P n m a | 9.246; 3.0927; 9.384 90; 90; 90 | 268.336 | Bigi, S.; Brigatti, M. F.; Capedri, S. Crystal chemistry of Fe- and Cr-rich warwickite sample S1 American Mineralogist, 1991, 76, 1380-1388 |
9001024 | CIF | Ba Cr0.9 O4 S0.1 | P n m a | 9.1028; 5.5276; 7.3314 90; 90; 90 | 368.891 | Duesler, E. N.; Foord, E. E. Crystal structure of hashemite, BaCrO4, a barite structure type American Mineralogist, 1986, 71, 1217-1220 |
9000871 | CIF | B2 F H9 Mg3 O13 S | P n m a | 10.132; 12.537; 7.775 90; 90; 90 | 987.618 | Giese, R. F.; Penna, G. The crystal structure of sulfoborite, Mg3SO4(B(OH)4)2(OH)F American Mineralogist, 1983, 68, 255-261 |
9000771 | CIF | F0.25 H0.37 Mg4 O8.56 P2 | P n m a | 8.258; 6.054; 14.383 90; 90; 90 | 719.063 | Romming, C.; Raade, G. The crystal structure of althausite, Mg4(PO4)2(OH,O)(F, ) American Mineralogist, 1980, 65, 488-498 |
9000601 | CIF | Cu H I O4 | P n m a | 10.784; 6.708; 4.781 90; 90; 90 | 345.853 | Ghose, S.; Wan, C. Salesite, CuIO3(OH), and Cu(IO3)2*2H2O: A comparison of the crystal structures and their magnetic behavior American Mineralogist, 1978, 63, 172-179 |
9000549 | CIF | Ba Be2 O7 Si2 | P n m a | 9.82; 11.67; 4.69 90; 90; 90 | 537.471 | Robinson, P. D.; Fang, J. H. Barylite, BaBe2Si2O7: its space group and crystal structure American Mineralogist, 1977, 62, 167-169 |
9000522 | CIF | H10 O12 P2 Zn3 | P n m a | 10.597; 18.318; 5.031 90; 90; 90 | 976.597 | Hill, R. J.; Jones, J. B. The crystal structure of hopeite American Mineralogist, 1976, 61, 987-995 |
9000212 | CIF | As3 H13 Mn9 O22 | P n m a | 10.754; 18.865; 9.884 90; 90; 90 | 2005.21 | Moore, P. B. Crystal chemistry of the basic manganese arsenates: IV. Mixed arsenic valences in the crystal structure of synadelphite American Mineralogist, 1970, 55, 2023-2037 |
9000211 | CIF | Al3.4 Ca0.04 Fe2.53 Mg3.05 Na0.54 O24 Si5.96 | P n m a | 18.601; 17.839; 5.284 90; 90; 90 | 1753.35 | Papike, J. J.; Ross, M. Gedrites: Crystal structures and intracrystalline cation distributions sample 002 American Mineralogist, 1970, 55, 1945-1972 |
9000210 | CIF | Al2.96 Ca0.04 Fe1.26 Mg4.48 Na0.36 O24 Si6.24 | P n m a | 18.531; 17.741; 5.249 90; 90; 90 | 1725.65 | Papike, J. J.; Ross, M. Gedrites: Crystal structures and intracrystalline cation distributions sample 001 American Mineralogist, 1970, 55, 1945-1972 |
9000207 | CIF | Be Na O8 Si3 | P n m a | 12.74; 13.63; 7.33 90; 90; 90 | 1272.83 | Robinson P D; Fang J H The crystal structure of epididymite American Mineralogist, 1970, 55, 1541-1549 |
9000179 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.212; 5.559; 10.036 90; 90; 90 | 904.469 | Dollase, W. A. Refinement and comparison of the structures of zoisite and clinozoisite American Mineralogist, 1968, 53, 1882-1898 |
9000156 | CIF | As H4 Mn3 O8 | P n m a | 9.55; 13.11; 5.25 90; 90; 90 | 657.303 | Moore, P. B. Crystal chemistry of the basic manganese arsenate minerals 1. The crystal structures of flinkite, Mn2Mn(OH)4(AsO4) and retzian, Mn2Y(OH)4(AsO4) American Mineralogist, 1967, 52, 1603-1613 |
9000120 | CIF | Al2 Be O4 | P n m a | 9.404; 5.476; 4.427 90; 90; 90 | 227.974 | Farrell, E. F.; Fang, J. H.; Newnham, R. E. Refinement of the chrysoberyl structure American Mineralogist, 1963, 48, 804-810 |
9000068 | CIF | H Mn O7 Pb V | P n m a | 7.663; 6.191; 9.522 90; 90; 90 | 451.739 | Donaldson, D. M.; Barnes, W. H. The structures of the minerals of the descloizite and adelite groups: II - pyrobelonite. American Mineralogist, 1955, 40, 580-596 |
8107700 | CIF | C30 H40 N2 Ni O2 | P n m a | 12.8114; 21.301; 10.6536 90; 90; 90 | 2907.3 | Shen, Lingyi; Xu, Na; Jiang, Mengna; Zhao, Jiang; Xu, Xiaoling; Yang, Xian-Jiong; Zhang, Qi-Long Crystal structure of dicarbonyl[N,N′-(1,2-dimethyl-1,2-ethanediylidene)bis[2,6-bis(1-methylethyl)benzenamine]-N,N′]nickel(0), C30H40N2NiO2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1195-1197 |
8107552 | CIF | C28 H32 O6 | P n m a | 7.752; 29.959; 10.176 90; 90; 90 | 2363.3 | Chen, Xiao-Ming; Zeng, Fei The crystal structure of dimethyl 2,2ʹ-((adamantane-1,3-diylbis(4,1-phenylene)) bis(oxy))diacetate, C28H32O6 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 753-755 |
8107510 | CIF | Ba O4 S | P n m a | 8.8806; 5.4539; 7.157 90; 90; 90 | 346.64 | Paulsen, Christian; Galéa-Clolus, Valérie; Pöttgen, Rainer Crystal structure of baryte from Mine du Pradet (France) Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 611-613 |
8107449 | CIF | C18 H30 N2 O2 S8 W3 | P n m a | 17.0254; 15.2534; 11.8789 90; 90; 90 | 3084.9 | Kim, Kang-Woo; Kim, Sunghyeon Crystal structure of bis(trimethylphenylammonium) aqua-oxido-octathiotritungstate, (Me3PhN)2[W3OS8(H2O)] Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 389-390 |
8107297 | CIF | C15 H13 B F9 N7 Ni O | P n m a | 17.8513; 13.3869; 8.5944 90; 90; 90 | 2053.83 | Fujisawa, Kiyoshi; Kataoka, Taisei; Terashima, Kohei; Tiekink, Edward R. T. The crystal structure of nitroxyl-κ N-{hydridotris(3-trifluoromethyl-5-methylpyrazolyl-1-yl-κN 3)borato}nickel(II), C15H13BF9N7NiO Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1075-1078 |
8107282 | CIF | C60 H132 N4 O20 P12 Rh4 | P n m a | 19.8694; 12.5765; 8.699 90; 90; 90 | 2173.8 | Elmakki, Mohammed A.; Alexander, Orbett T.; Venter, Johan A.; Roodt, Andreas The crystal structure of (carbonato κ2 O,O′)(2-oxopyridin-1(2H)-olato-κN)tris(trimethylphosphine)rhodium(III) water solvate, C15H33NO5P3Rh Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1023-1025 |
8107205 | CIF | C8 H6 Cl N | P n m a | 20.3965; 7.8164; 4.5015 90; 90; 90 | 717.66 | Miao, Mingzhi; Li, Ji The crystal structure of 4-(chloromethyl)benzonitrile, C8H6ClN Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 749-750 |
8106990 | CIF | C20 H15.5 Cl N1.5 Pd0.5 | P n m a | 16.7821; 17.1436; 11.1431 90; 90; 90 | 3205.9 | Teci, Matthieu; Brenner, Eric; Matt, Dominique; Toupet, Loïc Crystal structure of trans-dichlorido[1,3-bis(9-methyl-9H-fluoren-9-yl) benzimidazol-2-ylidene](pyridine)palladium(II) – a compound with anagostic CH–Pd interactions, C40H31Cl2N3Pd Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 733-735 |
8106875 | CIF | C19 H17 Br N2 | P n m a | 11.506; 12.176; 11.327 90; 90; 90 | 1586.9 | Yuan, Lin; Li, Zhong-Yan; Zhang, Min; Yuan, Xian-You Crystal structure of 2-(4-bromophenyl)-1,3-dimethyl-2,3-dihydro-1H-perimidine, C19H17BrN2 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 361-363 |
8106724 | CIF | C11 H16 N2 O7 | P n m a | 13.753; 6.9471; 13.797 90; 90; 90 | 1318.2 | Zeng, Huahui; Shen, Qianjin Crystal structure of trimethyammonium 2,6-dicarboxyisonicotinate monohydrate, C11H16N2O7 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 929-930 |
8106698 | CIF | C2 H3 K N4 S | P n m a | 13.874; 6.5644; 6.6911 90; 90; 90 | 609.39 | Wang, Xiuhang Crystal structure of potassium 1-methyl-1H-1,2,3,4-tetrazole-5-thiolate, C2H3N4SK Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 845-847 |
8106527 | CIF | Ga1.24 Sb2.77 Y5 | P n m a | 7.9629; 15.175; 7.9795 90; 90; 90 | 964.2 | Yan, Chang; Zhao, Meng; Gao, Ju; Yao, Jinlei Crystal structure of yttrium gallium antimonide, Y5Ga1.24Sb2.77 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 331-332 |
8106505 | CIF | C20 H17 N3 | P n m a | 11.371; 12.144; 11.718 90; 90; 90 | 1618 | Zhang, Min; Yuan, Lin; Yuan, Xian-You; Li, Zhong-Yan Crystal structure of 4-(1,3-dimethyl-2,3-dihydro-1H-perimidin-2-yl)benzonitrile, C20H17N3 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 267-268 |
8106407 | CIF | C9 H5 F3 N2 O | P n m a | 7.276; 6.7773; 17.613 90; 90; 90 | 868.5 | You, Gui-Rong; Rao, Guo-Wu Crystal structure of 8-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde, C9H5F3N2O Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 1081-1082 |
8106336 | CIF | C10 H13 Cl N2 O4 | P n m a | 14.903; 9.1004; 8.756 90; 90; 90 | 1187.5 | Messali, Mouslim; Aouad, Mohamed Reda; Rezki, Nadjet; Almutairi, M. Saud; Warad, Ismail Crystal structure of 4-(dimethylamino)-1-(prop-2-yn-1-yl)pyridin-1-ium perchlorate, C10H13ClN2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 897-898 |
8106273 | CIF | C18 H16 O2 | P n m a | 14.474; 6.815; 13.738 90; 90; 90 | 1355.1 | Wu, Jichun; Luo, Guoyong; Liu, Yuchen; Yang, Wude Crystal structure of 2-isopropyl-8-methyl-phenanthrene-3,4-dione, C18H16O2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 721-722 |
8106130 | CIF | C48 H54 Cl2 N2 O17 | P n m a | 28.3651; 22.8464; 7.1341 90; 90; 90 | 4623.2 | Zhang, Mei; Lou, Benyong; Huang, Xiaodong; Huang, Yali Crystal structure of 9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-7-ium chloride — 4-hydroxy-3-methoxybenzoic acid — water (2/1/5), C48H54N2Cl2O17 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 291-293 |
8106128 | CIF | Be3 Cs2 O14 P4 | P n m a | 15.0612; 11.0386; 15.5316 90; 90; 90 | 2582.2 | Fang, Wang; Yigang, Chen Crystal structure of cesium beryllophosphate, Be3Cs2P4O14 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 287-288 |
8106041 | CIF | C21 H22 N6 Ni O6 | P n m a | 18.214; 20.934; 5.5296 90; 90; 90 | 2108.4 | Hui, Guo; Xin-Hong, Chang; Hao-Yue, Qin Crystal structure of catena-poly[diaqua-(μ2-5-methylisophthalato-κ2 O:O′)(μ2-1,4-bis((1H-1,2,4-triazol-1-yl)methyl)benzene-κ2 N:N′)], NiC21H22O6N6 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 55-56 |
8105749 | CIF | C5 H5 N5 O3 | P n m a | 13.4643; 6.2866; 9.1138 90; 90; 90 | 771.43 | Zhou, Meng-Shu; Fu, Hong-Ru Crystal structure of 1H-1,2,3-Triazolo[4,5-b]-pyridin-4-ium nitrate, C5H5N5O3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 557-558 |
8105608 | CIF | C50 H48 B Cu F4 N4 P2 | P n m a | 24.166; 19.5652; 9.6477 90; 90; 90 | 4561.6 | Fazal, Atif; Fettouhi, Mohammed Crystal structure of (2,2′-bipyridine-κ 2 N,N′)bis(4-(dimethylamino)phenyldiphenylphosphane-κP)copper(I) tetrafluoroborate, C50H48BCuF4N4P2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 253-254 |
8105574 | CIF | C8 H6 N2 O6 | P n m a | 6.4261; 17.08; 8.5393 90; 90; 90 | 937.25 | Fanfan, Shen; Jianlong, Wang; Shaomin, Xue The crystal structure of 2,6-dimethyl-3,5-dinitrocyclohexa-2,5-diene-1,4-dione, C8H6N2O6 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 234, 159-160 |
8105527 | CIF | C10 H6 Br Cu2 N4 O4 | P n m a | 6.768; 23.693; 7.7301 90; 90; 90 | 1239.6 | Cuihong, Zhang; Xiaohu, Wei; Liguo, Yang; Zhenzhen, He; Jiaze, Wu; Hao, Liu; Xin, Li; Zongcheng, Miao Crystal structure of catena-poly[bromido-(μ2-pyrazine-2-carboxylato-κ3 N:N′,O)copper(II)], C10H6N4Cu2O4Br Zeitschrift für Kristallographie - New Crystal Structures, 2018, 234, 23-24 |
8105446 | CIF | C20 H16 Li5 N O13 | P n m a | 9.9218; 14.6941; 13.5697 90; 90; 90 | 1978.4 | Li, Ying; Qin, Yu-Cai; Chen, Bao-Kuan The crystal structure of dimethylammonium catena-[di(μ-aqua)-bis(μ9-benzene-1,3,5-tricarboxylato)pentalithium], C20H16Li5NO13 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1289-1291 |
8105287 | CIF | C2.5 H3 Mg0.5 N5 O | P n m a | 12.4217; 7.3444; 10.6063 90; 90; 90 | 967.61 | Li, Ting; Xing, Zheng Crystal structure of catena-poly[diaqua-bis(μ2-5,5′-(1H-imidazole-4,5-diyl)bis(tetrazol-2-ido)-κ4 N,N′:N′′,N′′′)magnesium], C10H8N20O2Mg Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 787-788 |
8105194 | CIF | C16 H20 N4 Ni O14 | P n m a | 7.1945; 16.1805; 17.7912 90; 90; 90 | 2071.08 | Liu, Xu; Meng, Xiang-Ru Crystal structure of [diaqua[2,2′-(1,2-phenylene)bis(1H-imidazole-4-carboxylato-5-carboxy)-κ4 N,N′,O,O′]nickel(II)] tetrahydrate, C16H12N4NiO10·4H2O Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 249-251 |
8105190 | CIF | C4 H7 N3 O3 | P n m a | 14.2289; 6.1881; 7.5592 90; 90; 90 | 665.59 | Cong, Chen; Yun, Xiao; Chong, Li; LiZhen, Chen; Jianlong, Wang The crystal structure of 1-methyl-1H-pyrazol-2-ium nitrate, C4H7O3N3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 237-238 |
8105152 | CIF | C10 H12 N4 O4 S | P n m a | 10.4813; 6.8663; 17.2605 90; 90; 90 | 1242.2 | Al-Obaid, Abdulrahman M.; Syed, Saeed Ali; Ahmed, Bari; Hosten, Eric C. The crystal structure of (Z)-3-hydrazono-5-nitroindolin-2-one – dimethyl sulfoxide (1/1), C8H6N4O3 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 501-502 |
8104989 | CIF | C21 H11 F4 I2 N3 | P n m a | 11.0042; 20.6209; 9.2371 90; 90; 90 | 2096.05 | Wang, Weizhou Halogen bonds in the crystal structure of 4,3′:5′,4″-terpyridine — 1,3-diiodotetrafluorobenzene (1/1), C21H11F4I2N3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 161-163 |
8104873 | CIF | C18 H20 Cl4 N2 O Zr | P n m a | 12.457; 22.806; 7.398 90; 90; 90 | 2101.7 | Bonitatibus, Peter J.; Reiss, Guido J. Preparation and crystal structure of a cationic olefin polymerization precatalyst: (1,7-bis(2,6–dichlorophenyl)-1,7-di-aza-4-oxo-heptan-1,4,7-triyl)dimethyl zirconium(IV), C18H20Cl4N2OZr Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 29-32 |
8104736 | CIF | C24 H16 Br2 N0 O2 | P n m a | 7.407; 44.336; 6.046 90; 90; 90 | 1985.5 | Usman, Rabia; Khan, Arshad; Refat, Moamen S.; Al-Hazmi, Ghaferah H.; He, Nongyue Synthesis and crystal structure of (2E,2′E)-3,3′-(1,3-phenylene)bis(1-(3-bromophenyl)prop-2-en-1-one), C24H16Br2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 863-864 |
8104618 | CIF | C30 H25 Cd N11 O8 | P n m a | 17.9344; 18.2722; 9.5619 90; 90; 90 | 3133.44 | Yin, Wei-Dong; Liu, Qian-Long; Zhao, Ya-Jing; Gong, Xiao-Ru; Li, Gui-Lian Crystal structure of catena-poly[bis(µ2-3,5-bis(1-imidazolyl)pyridine-κ2 N:N′)-(µ2-3-nitrophthalato-k3 O,O′:O″)cadmium(II)] dihydrate, C30H25N11O8Cd Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 899-902 |
8104545 | CIF | Cl Fe2 H3 O3 | P n m a | 6.3373; 6.9892; 9.3457 90; 90; 90 | 413.95 | Natalia V. Zubkova; Igor V. Pekov; Evgeny V. Sereda; Vasiliy O. Yapaskurt; Dmitry Yu. Pushcharovsky The crystal structure of hibbingite, orthorhombic Fe2Cl(OH)3 Zeitschrift fur Kristallographie, 2019, 234, 379-382 |
8104542 | CIF | Ba D0.49 Ge | P n m a | 13.1951; 4.2145; 9.9155 90; 90; 90 | 551.41 | Auer, Henry; Weber, Sebastian; Hansen, Thomas Christian; Többens, Daniel Maria; Kohlmann, Holger Reversible hydrogenation of the Zintl phases BaGe and BaSn studied by in situ diffraction Zeitschrift für Kristallographie - Crystalline Materials, 2018, 233, 399 |
8104517 | CIF | Cl5 Cs2 Tl | P n m a | 9.337; 7.493; 14.861 90; 90; 90 | 1039.71 | Thiele, G.; Richter, R. Crystal structure of dicesium pentachlorothallate Zeitschrift fuer Kristallographie (149,1979-), 1993, 205, 131-132 |
8104496 | CIF | Cs2 Ga Sb2 | P n m a | 18.06; 11.167; 8.358 90; 90; 90 | 1685.61 | Cordier, G.; Ochmann, H. Crystal structure of dicesium catena-diantimonidogallate Zeitschrift fuer Kristallographie (149,1979-), 1991, 195, 310-311 |
8104495 | CIF | Ga Rb2 Sb2 | P n m a | 15.408; 10.776; 9.302 90; 90; 90 | 1544.47 | Cordier, G.; Ochmann, H. Crystal structure of dirubidium diantimonidogallate Zeitschrift fuer Kristallographie (149,1979-), 1991, 195, 125-126 |
8104484 | CIF | C6 Mo O6 | P n m a | 12.019; 11.415; 6.488 90; 90; 90 | 890.133 | Mak, T.C.W. Crystal structure of molybdenum hexacarbonyl Zeitschrift fuer Kristallographie (149,1979-), 1984, 166, 277-281 |
8104482 | CIF | C6 O6 W | P n m a | 11.944; 11.37; 6.459 90; 90; 90 | 877.153 | Heinemann, F.; Schmidt, H.; Thiery, D.; Peters, K. Crystal structure of tungsten hexacarbonyl Zeitschrift fuer Kristallographie (149,1979-), 1992, 198, 123-124 |
8104478 | CIF | As2 K4 Te4 | P n m a | 19.981; 8.29; 9.081 90; 90; 90 | 1504.2 | Eisenmann, B.; Zagler, R.; Jaeger, J. Crystal structure of tetrapotassium tetratellurodiarsenate(II) Zeitschrift fuer Kristallographie (149,1979-), 1991, 197, 259-260 |
8104327 | CIF | Bi4 Cu4 S9 | P n m a | 32.05; 3.951; 11.589 90; 90; 90 | 1467.51 | Takeuchi, Y.; Ozawa, T. The structure of Cu4 Bi4 S9 and its relation to the structures of covellite, CuS and bismuthinite, Bi2 S3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1975, 141, 217-232 |
8104324 | CIF | Bi16 Cu0.48 Pb14 S36 | P n m a | 23.89; 4.057; 19.098 90; 90; 90 | 1851.01 | Srikrishnan, T.; Nowacki, W. A redetermination of the crystal structure of cosalite, Pb2 Bi2 S5 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1974, 140, 114-136 |
8104314 | CIF | Al2.06 Fe0.99 H2 Li1.91 Mg1.98 Na0.06 O24 Si7.92 | P n m a | 18.254; 17.636; 5.27 90; 90; 90 | 1696.56 | Walter, F.; Walitzi, E.M.; Mereiter, K. Verfeinerung der Kristallstruktur von Holmquistit vom Brandruecken/Weinebene, Koralpe, Oesterreich Zeitschrift fuer Kristallographie (149,1979-), 1989, 188, 95-101 |
8104282 | CIF | Ge S | P n m a | 10.481; 3.646; 4.299 90; 90; 90 | 164.281 | Wiedemeier, H.; von Schnering, H.G. Refinement of the structures of Ge S, Ge Se, Sn S, and Sn Se Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1978, 148, 295-303 |
8104281 | CIF | S Sn | P n m a | 11.2; 3.987; 4.334 90; 90; 90 | 193.532 | Wiedemeier, H.; von Schnering, H.G. Refinement of the structures of Ge S, Ge Se, Sn S, and Sn Se Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1978, 148, 295-303 |
8104250 | CIF | S Sn | P n m a | 11.82; 3.988; 4.34 90; 90; 90 | 204.58 | Hofmann, W. Ergebnisse der Strukturbestimmung komplexer Sulfide. I: Sn S und Pb Sn S2 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1935, 92, 161-173 |
8104249 | CIF | S3 Sb2 | P n m a | 11.3; 3.837; 11.22 90; 90; 90 | 486.478 | Hofmann, W. Die Struktur der Minerale der Antimonitgruppe. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1933, 86, 225-245 |
8104234 | CIF | P4 S3 | P n m a | 10.456; 9.548; 13.625 90; 90; 90 | 1360.24 | Chattopadhyay, T.K.; May, W.; von Schnering, H.G.; Pawley, G.S. X-ray and neutron diffraction study of the crystal structure of alpha-P4 S3 Zeitschrift fuer Kristallographie (149,1979-), 1983, 165, 47-64 |
8104208 | CIF | P4.68 Se0.3125 | P n m a | 9.963; 3.231; 13.412 90; 90; 90 | 431.738 | Ruck, M.; Hoppe, D.; Simon, P. Phosphorus-rich phosphorus selenides P(14+x)Se (x = 1, 5) Zeitschrift fuer Kristallographie (149,1979-), 2005, 220, 265-268 |
8104207 | CIF | P4.76 Se0.25 | P n m a | 9.917; 3.23; 13.41 90; 90; 90 | 429.548 | Ruck, M.; Hoppe, D.; Simon, P. Phosphorus-rich phosphorus selenides P(14+x)Se (x = 1, 5) Zeitschrift fuer Kristallographie (149,1979-), 2005, 220, 265-268 |
8104185 | CIF | I4 Li2 Zn | P n m a | 14.828; 8.56; 7.0123 90; 90; 90 | 890.055 | Zhang, Z.; Lutz, H.D. Redetermination of the crystal structures of lithium zinc iodide, Li2 Zn I4, and sodium zinc chloride, Na2 Zn Cl4 Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 691-692 |
8104179 | CIF | Al H9 O12 S2 | P n m a | 9.458; 18.25; 5.358 90; 90; 90 | 924.836 | Fischer, T.; Eisenmann, B.; Kniep, R. Crystal structure of aquaoxonium diaquabis(sulfato)aluminate, H5 O2 (Al (H2 O)2 (S O4)2) Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 466-466 |
8104169 | CIF | Cs2 Mo S4 | P n m a | 10.0479; 7.2463; 12.783 90; 90; 90 | 930.731 | Raymond, C.C.; Miller, S.M.; Dorhout, P.K. Crystal structure of dicesium tetrathiomolybdate, Cs2 Mo S4 Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 775-775 |
8104145 | CIF | Cu Hf Na Se3 | P n m a | 13.46; 3.8284; 10.247 90; 90; 90 | 528.031 | Klepp, K.O.; Sturmayr, D. Crystal structure of sodium copper triselenohafnate(IV) Na Cu Hf Se3 Zeitschrift fuer Kristallographie - New Crystal Structures, 1997, 212, 75-75 |
8104144 | CIF | Fe2 Na3 Se4 | P n m a | 6.902; 10.994; 11.127 90; 90; 90 | 844.323 | Klepp, K.O.; Sparlinek, W. Crystal structure of trisodium tetraseleno diferrate, Na3 Fe2 Se4 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 626-626 |
8104126 | CIF | Co2 Li2 Mo3 O12 | P n m a | 5.086; 10.484; 17.606 90; 90; 90 | 938.781 | Wiesmann, M.; Svoboda, H.; Weitzel, H.; Fuess, H. The Structure of Lithiumcobaltmolybdate Li2 Co2 (Mo O4)3 Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 525-525 |
8104078 | CIF | Br7 Cu Pb3 | P n m a | 7.8998; 23.805; 6.9336 90; 90; 90 | 1303.9 | Oldag, T.; Keller, H.L. Solvothermal Synthesis and Crystal Structure of beta- and gamma- Cu Pb3 Br7 Zeitschrift fuer Kristallographie (149,1979-), 2005, 220, 152-157 |
8104006 | CIF | Al I4 Na | P n m a | 15.051; 8.13; 8.098 90; 90; 90 | 990.909 | Burnus, R.; Hinz, D.J.; Meyer, G. Crystal structure of sodium tetraiodoaluminate (III), NaAlI4 Zeitschrift fuer Kristallographie (149,1979-), 1994, 209, 544-544 |
8104001 | CIF | P2 Zr | P n m a | 6.505; 3.5169; 8.757 90; 90; 90 | 200.338 | Huber, M.; Deiseroth, H.J. Crystal structure of zirconium diphosphide, ZrP2 Zeitschrift fuer Kristallographie (149,1979-), 1994, 209, 370-370 |
8103993 | CIF | Bi Cu S2 | P n m a | 6.125; 3.89; 14.512 90; 90; 90 | 345.767 | Hofmann, W. Die Struktur von Wolfsbergit, Cu Sb S2 und Emplektit, Cu Bi S2 und deren Beziehungen zu der Struktur von Antimonit, Sb2 S3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1933, 84, 177-203 |
8103980 | CIF | I3 Rb Sn | P n m a | 10.184; 4.747; 17.309 90; 90; 90 | 836.777 | Thiele, G.; Serr, B.R. Crystal structure of rubidium triiodostannate(II), Rb Sn I3 Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 64-64 |
8103975 | CIF | Br5 H8 N2 Pr | P n m a | 13.536; 9.291; 8.5832 90; 90; 90 | 1079.45 | Bohnsack, A.; Meyer, G. Crystal structure of ammonium catena-di-mu-bromotribromo-praseodymate(III), (N H4)2 Pr Br5 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 326-326 |
8103942 | CIF | Rb3 S4 Sb | P n m a | 9.602; 11.161; 9.773 90; 90; 90 | 1047.35 | Bensch, W.; Duerichen, P. Crystal structure of rubidium tetrathioantimonate (V), Rb3 Sb S4 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 636-636 |
8103920 | CIF | H P Rb2 | P n m a | 8.415; 5.546; 10.349 90; 90; 90 | 482.984 | Somer, M.; Peters, K.; Carrillo-Cabrera, W.; von Schnering, H.G.; Peters, E.M. Crystal structure of dirubidium hydrogenphosphide, Rb2(PH) Zeitschrift fuer Kristallographie - New Crystal Structures, 1997, 212, 299-299 |
8103915 | CIF | As3 Ba3 In | P n m a | 13.84; 4.601; 14.45 90; 90; 90 | 920.145 | Somer, M.; Carrillo-Cabrera, W.; Peters, K.; von Schnering, H.G.; Cordier, G. Crystal structure of tribarium triarsenidoindate Ba3 In As3 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 632-632 |
8103914 | CIF | Cu Yb | P n m a | 7.5653; 4.2553; 5.7667 90; 90; 90 | 185.645 | Belan, B.D.; Bodak, O.I.; Cerny, R.; Pacheco, J.V.; Yvon, K. Crystal structure of ytterbium copper, YbCu. Zeitschrift fuer Kristallographie - New Crystal Structures, 1997, 212, 508-508 |
8103901 | CIF | As1.6 Sb1.4 Sr5 | P n m a | 12.92; 9.802; 8.563 90; 90; 90 | 1084.43 | Somer, M.; Carrillo-Cabrera, W.; von Schnering, H.G.; Peters, E.M.; Peters, K. Crystal structure of strontium arsenide antimonide (5/1.6/1.4), Sr5 As1.6 Sb1.4 Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 875-875 |
8103886 | CIF | Ba H2 | P n m a | 6.792; 4.168; 7.858 90; 90; 90 | 222.453 | Snyder, G.J.; Borrmann, H.; Simon, A. Crystal structure of barium dihydride, Ba H2 Zeitschrift fuer Kristallographie (149,1979-), 1994, 209, 458-458 |
8103882 | CIF | H11 I5 N3 Sc | P n m a | 15.466; 11.697; 8.105 90; 90; 90 | 1466.24 | Simon, M.; Meyer, G. Crystal structure of diammonium monoamminopentaiodo-scandat(III), (NH4)2(Sc(NH3)I5) Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 327-327 |
8103868 | CIF | Br3 In Mg | P n m a | 9.4395; 3.9538; 15.3744 90; 90; 90 | 573.802 | Scholten, M.; Dronskowski, R. Crystal structure of indium magnesium tribromide, In Mg Br3 Zeitschrift fuer Kristallographie - New Crystal Structures, 1997, 212, 5-5 |
8103844 | CIF | C6 H18 Cl4 O3 Pb2 S3 | P n m a | 13.941; 17.599; 7.441 90; 90; 90 | 1825.63 | Geselle, M.; Fuess, H. Crystal structure of bis-Lead(II)chloride tris-dimethylsulphoxide, (Pb Cl2)2 (S O (C H3)2)3 Zeitschrift fuer Kristallographie - New Crystal Structures, 1997, 212, 236-236 |
8103785 | CIF | Ba0.8 O4 Pb0.2 S | P n m a | 8.792; 5.43; 7.11 90; 90; 90 | 339.435 | Wang, H.-R.; Lee, J.-S.; Yu, S.-C. Synthesis of zoning-free (Ba S O4) - (Pb S O4) solid solution and its structural characterizations Zeitschrift fuer Kristallographie (149,1979-), 2002, 217, 143-148 |
8103784 | CIF | Ba0.977 O4 Pb0.013 S Sr0.01 | P n m a | 8.482; 5.398; 6.959 90; 90; 90 | 318.624 | Wang, H.-R.; Lee, J.-S.; Yu, S.-C. Synthesis of zoning-free (Ba S O4) - (Pb S O4) solid solution and its structural characterizations Zeitschrift fuer Kristallographie (149,1979-), 2002, 217, 143-148 |
8103783 | CIF | Ba0.99 O4 Pb0.01 S | P n m a | 8.884; 5.457; 7.157 90; 90; 90 | 346.971 | Wang, H.-R.; Lee, J.-S.; Yu, S.-C. Synthesis of zoning-free (Ba S O4) - (Pb S O4) solid solution and its structural characterizations Zeitschrift fuer Kristallographie (149,1979-), 2002, 217, 143-148 |
8103770 | CIF | Bi4 Cu4 Se9 | P n m a | 32.692; 4.1198; 12.202 90; 90; 90 | 1643.42 | Makovicky, E.; Karup-Moller, S.; Sotofte, I. The crystal structure of Cu4 Bi4 Se9 Zeitschrift fuer Kristallographie (149,1979-), 2002, 217, 597-604 |
8103731 | CIF | Co0.93 Mn1.07 O4 Si | P n m a | 10.51; 6.129; 4.823 90; 90; 90 | 310.677 | Untersteller, E.; Hellner, E.; Treutmann, W.; Schweiss, P.; Hosoya, S.; Heger, G. Strukturelle und magnetische Untersuchungen an (Mn,Co)-Olivin- Mischkristallem Zeitschrift fuer Kristallographie (149,1979-), 1988, 182, 261-263 |
8103728 | CIF | C H4 N2 S | P n m a | 7.657; 8.588; 5.485 90; 90; 90 | 360.684 | Mullen, D.; Heger, G.; Treutmann, W. Refinement of the structure of thiourea. A neutron diffraction study at 293 K Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1978, 148, 95-100 |
8103709 | CIF | Ba2 Cs N15 | P n m a | 12.928; 10.966; 8.858 90; 90; 90 | 1255.79 | Krischner, H.; Saracoglu, A.I.; Kratky, C. Die Kristallstruktur des Cs Ba2 (N3)5 Zeitschrift fuer Kristallographie (149,1979-), 1982, 159, 225-229 |
8103657 | CIF | Eu2 In | P n m a | 7.445; 5.573; 10.306 90; 90; 90 | 427.606 | Fornasini, M.L.; Cirafici, S. Crystal structures of Eu3 Ga2, Eu Ga,Eu2 In, Eu In and Eu In4 Zeitschrift fuer Kristallographie (149,1979-), 1990, 190, 295-304 |
8103614 | CIF | Cs2 Mo O4 | P n m a | 11.608; 6.562; 8.51 90; 90; 90 | 648.221 | Gonschorek, W.; Hahn, T. Die Kristallstruktur des Caesiummolybdats, Cs2 Mo O4 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1973, 138, 167-176 |
8103601 | CIF | Bi Cl S | P n m a | 7.7508; 3.9955; 9.992 90; 90; 90 | 309.435 | Voutsas, G.P.; Rentzeperis, P.J. The crystal structure of the paraelectric bismuth thiochloride Bi S Cl Zeitschrift fuer Kristallographie (149,1979-), 1980, 152, 109-118 |
8103590 | CIF | Cl2 S5 Sb4 | P n m a | 10.63; 9.489; 11.143 90; 90; 90 | 1123.97 | Schulte-Kellinghaus, M.; Kraemer, V. Die Kristallstruktur des Antimon-Sulfid-Chlorids Sb4 S5 Cl2 Zeitschrift fuer Kristallographie (149,1979-), 1980, 152, 47-56 |
8103539 | CIF | Al Ca2 F7 | P n m a | 7.685; 6.998; 9.549 90; 90; 90 | 513.542 | Domesle, R.; Hoppe, R. The crystal structure of Ca2 Al F7 Zeitschrift fuer Kristallographie (149,1979-), 1980, 153, 317-328 |
8103501 | CIF | Co Li O4 P | P n m a | 10.2001; 5.9199; 4.69 90; 90; 90 | 283.2 | Kubel, F. Crystal structure of lithium cobalt double orthophosphate, LiCoPO4 Zeitschrift für Kristallographie, 1994, 209, 755 |
8103456 | CIF | B F4 Tl | P n m a | 9.207; 5.7217; 7.3649 90; 90; 90 | 387.981 | Lutz, H.D.; Moeller, H. Crystal structure of thallium tetrafluoroborate Zeitschrift fuer Kristallographie (149,1979-), 1992, 201, 285-286 |
8103185 | CIF | Cd3 K2 Se4 | P n m a | 14.312; 10.604; 6.839 90; 90; 90 | 1037.9 | Young-Tae Kim; Hoseop Yun; Kang-Woo Kim Refinement of the crystal structure of dipotassium tricadmium(II) tetraselenide, K2Cd3Se4 Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 157 |
8103149 | CIF | C11 H13 N O3 S | P n m a | 8.4446; 10.9575; 12.084 90; 90; 90 | 1118.2 | Eyad Mallah; Qutaiba Abu-Salem; Wael Abu Dayyih; Mohammed Hamad; Manfred Steimann; Caecilia Maichle-Mössmer Crystal structure of trimethylsulfoxonium phthalimide, [C3H9SO][C8H4NO2] Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 345 |
8103109 | CIF | C28 H22 N4 O5 Zn | P n m a | 14.829; 18.184; 9.493 90; 90; 90 | 2559.79 | Dao-Cheng Xia; Shuai Shi; Ji-Huan Yao; Hui-Xuan Ma; Chang-Qing Han; Li-Ping Wang; Qing-Yang Liu Crystal structure of (4,4'-bis(imidazol-1-ylmethyl)biphenyl)-(5-hydroxyisophthalato)zinc(II), Zn(C20H18N4)(C8H4O5) Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 29 |
8103063 | CIF | Ca2 F Na O4 Si | P n m a | 5.3388; 7.1542; 12.4116 90; 90; 90 | 474.06 | Krüger, Hannes; Kahlenberg, Volker Ca2NaSiO4F: a new monoclinic polymorph Zeitschrift für Kristallographie - Crystalline Materials, 2008, 223, 382-388 |
8103046 | CIF | Ge Pt Zr | P n m a | 6.6581; 3.9752; 7.6648 90; 90; 90 | 202.866 | Sarah-Virginia Ackerbauer; Roman Gumeniuk; Yurii Prots; Horst Borrmann; Franz Weitzer; Andreas Leithe-Jasper Crystal structures of zirconium-platinum-silicon (1:1:1), ZrPtSi, zirconium-platinum-germanium (1:1:1), ZrPtGe and titanium-platinum-silicon (1:1:1), TiPtSi Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 7 |
8103045 | CIF | Pt Si Zr | P n m a | 6.597; 3.9017; 7.5395 90; 90; 90 | 194.063 | Sarah-Virginia Ackerbauer; Roman Gumeniuk; Yurii Prots; Horst Borrmann; Franz Weitzer; Andreas Leithe-Jasper Crystal structures of zirconium-platinum-silicon (1:1:1), ZrPtSi, zirconium-platinum-germanium (1:1:1), ZrPtGe and titanium-platinum-silicon (1:1:1), TiPtSi Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 7 |
8103032 | CIF | O3 Pr Sc | P n m a | 5.7804; 8.025; 5.6077 90; 90; 90 | 260.13 | Thorsten M. Gesing; Reinhard Uecker; J.-Christian Buhl Refinement of the crystal structure of praseodymium orthoscandate, PrScO3 Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 365 |
8103005 | CIF | Ba2 Si4 | P n m a | 8.9326; 6.7262; 11.5335 90; 90; 90 | 692.96 | Thorsten Goebel; Yurii Prots; Frank Haarmann Refinement of the crystal structure of dibarium tetrasilicide, Ba2Si4 Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 7 |
8103004 | CIF | Ce P2 Pt4 | P n m a | 7.3172; 4.1731; 15.421 90; 90; 90 | 470.89 | Pavel S. Chizhov; Yurii Prots; Evgeny V. Antipov Crystal structure of cerium platinum phosphide, CePt4P2 Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 331 |
8102983 | CIF | Ga Pd2 | P n m a | 5.4829; 4.056; 7.7863 90; 90; 90 | 173.16 | Kirill Kovnir; Marcus Schmidt; Christian Waurisch; Marc Armbrüster; Yurii Prots; Yuri Grin Refinement of the crystal structure of dipalladium gallium, Pd2Ga Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 7 |
8102966 | CIF | Cl O3 Pb V | P n m a | 10.022; 5.2875; 7.1714 90; 90; 90 | 380.02 | Sahin, Aytac; Emirdag-Eanes, Mehtap Crystal structure of lead(II) trioxovanadate(V) chloride, Pb[VO~3~] Cl Zeitschrift für Kristallographie - New Crystal Structures, 2007, 222, 159-160 |
8102955 | CIF | B Ni3 | P n m a | 5.2219; 6.6171; 4.3918 90; 90; 90 | 151.754 | Gumeniuk, R.; Borrmann, H.; Leithe-Jasper, A. Refinement of the crystal structures of trinickel boron, Ni~3~B, and tripalladium boron, Pd~3~B Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 425-426 |
8102938 | CIF | Al23 Co10.14 Si8.72 | P n m a | 13.852; 23.055; 7.34 90; 90; 90 | 2344.1 | Richter, K. W.; Prots, Yu. Crystal structure of cobalt aluminum silicide, Co~10+x~Al~23~Si~9- 2x~ (x = 0.14), the φ phase in the Co-Al-Si system Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 112-114 |
8102927 | CIF | H3 La2 O9 P3 | P n m a | 8.305; 14.579; 7.059 90; 90; 90 | 854.7 | Ewald, B.; Prots, Yu.; Kniep, R. Crystal structure of dilanthanum tris(monohydrogenphosphate(III)), La~2~(HPO~3~)~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 533-534 |
8102916 | CIF | Co Si V | P n m a | 5.9536; 3.5964; 6.856 90; 90; 90 | 146.8 | Conrad, M.; Herrmann, B.; Harbrecht, B. Refinement of the crystal structure of monovanadium monocobalt monosilicide, VCoSi Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 319-320 |
8102908 | CIF | C Cl N Pb S | P n m a | 10.166; 4.255; 9.589 90; 90; 90 | 414.78 | A. Gacemi; D. Benbertal; I. Gautier-Luneau; A. Mosset Crystal structure of lead chloride thiocyanate, PbCl(SCN) Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 309-312 |
8102896 | CIF | Cs P Pb S4 | P n m a | 18.1852; 6.8085; 6.3518 90; 90; 90 | 786.44 | I. Belkyal; M. El Azhari; Y.-D. Wu; W. Bensch; K.-F. Hesse; W. Depmeier Crystal structure of cesium lead tetrathiophosphate, CsPbPS~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 127-128 |
8102893 | CIF | P Rb3 S4 | P n m a | 9.277; 10.935; 9.251 90; 90; 90 | 938.46 | L.-B. Wu; F.-Q. Huang Crystal structure of trirubidium tetrathiophosphate, Rb~3~PS~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 122-122 |
8102889 | CIF | K3 P Se4 | P n m a | 9.393; 10.954; 9.578 90; 90; 90 | 985.5 | B. C. Chan; P. L. Feng; Z. Hulvey; P. K. Dorhout Crystal structure of tripotassium tetraselenidophosphate, K~3~PSe~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 11-11 |
8102886 | CIF | Ba O4 Se | P n m a | 8.993; 5.675; 7.349 90; 90; 90 | 375.1 | A. Andara; M. A. Salvadó; Á. Fernández-González; S. García-Granda; M. Prieto Crystal structure of barium selenate, BaSeO~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 5-6 |
8102751 | CIF | C2 H14 N6 O10 Pt2 | P n m a | 12.701; 10.705; 9.942 90; 90; 90 | 1351.8 | Dan Chen; Ai-Guo Zhong; Guo-Liang Dai; Jun-Yong Wu; Shao-Ping Pu Crystal structure of monoaqua(tetraammine)oxalatodiplatinum(II) dinitrate, [Pt2(H2O)(C2O4)(NH3)4][NO3]2 Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 425 |
8102693 | CIF | C7 H8 I2 Pt | P n m a | 12.9207; 8.0332; 9.241 90; 90; 90 | 959.17 | Kwang Ha Crystal structure of [(2,3,5,6-h)-bicyclo[2.2.1]hepta-2,5-diene]diiodoplatinum(II), PtI2(C7H8) Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 319 |
8102655 | CIF | C4 H3 Cs O4 | P n m a | 5.597; 8.7745; 12.5721 90; 90; 90 | 617.4 | Kutalmis Guven; Gamze Bakir Crystal structure of caesium(I) hydrogen maleate, Cs(C4H3O4) Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 197 |
8102632 | CIF | C49 H76 Cd2 N6 O20 | P n m a | 21.618; 21.955; 11.834 90; 90; 90 | 5616.7 | Hong-Ye Bai; Dao-Cheng Xia; Jian-Fang Ma Crystal structure of (hydroxy-m2O)-(benzene-1,3,5-tricarboxylato-m2O)-bis[monoaqua-(1,12,15-triaza-3,4:9,10-dibenzo-5,8-dioxacycloheptadecane- k3N,N',N'')cadmium(II)] heptahydrate, Cd2(OH)(C9H3O6)(H2O)2(C20H27N3O2)2 · 7H2O Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 108 |
8102495 | CIF | C26 H23 Cl2 F12 Fe2 N P2 | P n m a | 13.3181; 14.709; 15.3689 90; 90; 90 | 3010.7 | Michael Hummel; Volker Kahlenberg; Gerhard Laus; Peter Jaitner; Herwig Schottenberger Crystal structure of [bis(h5-cyclopentadienyl)-(h6:h6)-E-4,4'-dichlorostilbene]diiron(II) bis(hexafluorophosphate) — acetonitrile (1:1), [(C5H5)2(C14H10Cl2)Fe2][PF6]2 · CH3CN Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 503 |
8102475 | CIF | C15 H21 Cl N2 O5 | P n m a | 9.4697; 14.452; 13.4624 90; 90; 90 | 1842.4 | Ping Liu; Lian Zhaoxun; Yuhuan Chen Crystal structure of hydrogen methyl ether perchlorate — 1,3-bis(4-pyridyl)propane (1:1), [C2H7O][ClO4] · C13H14N2 Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 571 |
8102400 | CIF | C29 H48 Hf O2 Si2 | P n m a | 16.8546; 14.4139; 12.1421 90; 90; 90 | 2949.81 | Torsten Beweries; Vladimir V. Burlakov; Uwe Rosenthal; Anke Spannenberg Crystal structure of 1,1-bis(pentamethylcyclopentadienyl)-4,5-bis(trimethylsilyl)-1-hafnafuran-3-one, Hf(C10H15)2(Me3SiC2SiMe3CO2) Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 93 |
8102367 | CIF | C36 H30 La2 N6 O18 | P n m a | 14.1852; 21.949; 12.1345 90; 90; 90 | 3778.1 | Chongchen Wang Crystal structure of poly[tetraaqua(2,2'-bipyridine-4,4'-dicarboxylato)-bis(2,2'-bipyridyl-4,4'-dicarboxylato)dilanthanum(III) dihydrate], La2(C12H6O4N2)3(H2O)4 · 2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 475 |
8102273 | CIF | C11 H16 S5 | P n m a | 19.848; 12.904; 5.537 90; 90; 90 | 1418.1 | Fatemeh Darviche; Felora Heshmatpour; Zeynab Emdadi; Hamid Reza Khavasi; Bernhard Neumüller Crystal structure of 5,6,7,8,9,10,11,12-octahydro[1,3] dithiolo[4,5-b][1,4] dithiacyclodecine-2-thione, C11H16S5 Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 235 |
8102108 | CIF | C3 H5 N3 O | P n m a | 6.002; 6.357; 12.288 90; 90; 90 | 468.85 | Irrgang, T.; Friedrich, D.; Clemente, R.; Kutlescha, K.; Glatz, G.; Kempe, R. Crystal structure of 2-amino-5-methyl-1,3,4-oxadiazole, (CH~3~)C~2~N~2~O (NH~2~) Zeitschrift für Kristallographie - New Crystal Structures, 2007, 222, 151-152 |
8102045 | CIF | C16 H20 N2 O14 S | P n m a | 22.9226; 27.208; 6.555 90; 90; 90 | 4088.21 | Wang, G.-X.; Zhang, Q.-W. Crystal structure of bis(5-ammonioisophthalic acid) sulfate dihydrate, (C~8~H~8~NO~4~)~2~[SO~4~] · 2H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 453-454 |
8102031 | CIF | C10 H15 I3 O | P n m a | 13.75; 7.288; 15.14 90; 90; 90 | 1517.2 | Guo, S.; Hauptmann, R.; Beyer, C.; Kollmann, T.; Schneider, J. J. Crystal structure of pentamethylpyrylium triiodide, [(CH~3~)~5~C~5~O] [I~3~] Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 393-394 |
8101715 | CIF | C16 H20 Gd N O11 | P n m a | 7.7843; 21.977; 11.129 90; 90; 90 | 1903.9 | G.-L. Zhao; Y.-L. Feng Crystal structure of triaquabis(vanillin-O,O')nitritogadolinium(III), Gd(H~2~O)~3~(C~8~H~7~O~3~)~2~(NO~2~) Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 99-100 |
8101624 | CIF | Al Rh Yb | P n m a | 6.761; 4.126; 7.893 90; 90; 90 | 220.18 | Cardoso Gil, Raul H.; Trovarelli, Octavio; Geibel, Christoph; Grin, Yuri Crystal structure of ytterbium-rhodium-aluminium [1:1:1], YbRhAl Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 459-459 |
8101614 | CIF | Ca0.75 Si Sr1.25 | P n m a | 8.099; 4.968; 9.22 90; 90; 90 | 370.97 | Zürcher, Fabio; Nesper, Reinhard Crystal structure of di(strontium, calcium) monosilicide, Sr~1.25~Ca~0.75~Si Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 427-427 |
8101599 | CIF | Ge20 Li2.1 Mg17.9 Sr12 | P n m a | 14.607; 4.518; 18.634 90; 90; 90 | 1229.7 | Zürcher, Fabio; Nesper, Reinhard Crystal structure of dodecastrontium octadecamagnesium dilithium eicosagermanide, Sr~12~Mg~17.9~Li~2.1~Ge~20~ Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 411-412 |
8101455 | CIF | Cl N3 Pr6 S4 | P n m a | 11.3987; 4.0235; 26.9993 90; 90; 90 | 1238.26 | Meyer, Monika; Schleid, Thomas Crystal structure of hexapraseodymium(III) trinitride tetrasulfide chloride, Pr~6~N~3~S~4~Cl Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 23-24 |
8101364 | CIF | C12 H12 N2 O4 | P n m a | 21.491; 6.89; 7.8399 90; 90; 90 | 1160.9 | Peters, Karl; Peters, Eva-Maria; Cohrs, Carsten; Reuchlein, Horst; Christl, Manfred Crystal structure of 6,7-dihydro-5,7-methano-5H-cyclopenta[d]pyridazin- 1,4-dicarboxylic acid dimethyl ester, C~12~H~12~N~2~O~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 601-602 |
8101303 | CIF | C Ca3.2 N4 Sr0.8 | P n m a | 11.677; 3.647; 13.911 90; 90; 90 | 592.41 | Höhn, Peter; Niewa, Rainer; Kniep, Rüdiger Crystal structure of tetra(calcium/strontium) cyanamide dinitride, Ca~4‒x~Sr~x~[CN~2~]N~2~ (x = 0.80) Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 323-326 |
8101255 | CIF | C44 H90 F6 K2 O17 Sn4 | P n m a | 17.007; 21.319; 18.343 90; 90; 90 | 6650.7 | Altmann, Reiner; Jurkschat, Klaus; Schürmann, Markus Crystal structure of bis[potassium 18-crown-6-1,2-bis(dimethylfluorostannyl) benzene fluoride] pentahydrate, 2{[K·18-Crown-6]^+^[O-C~6~H~4~(SnMe~2~F) ~2~·F]^‒^} · 5H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 309-311 |
8101236 | CIF | C6 H22 Br5 Cu N6 S2 | P n m a | 8.5897; 20.792; 11.28 90; 90; 90 | 2014.6 | Blachnik, Roger; Wiest, Thomas; Eickmeier, Henning; Dülmer, Ansgar Crystal structure of di-[<i>S</i>-(2-aminoethyl)thiouronium] tribromocuprate dibromide, [C~3~H~11~N~3~S]~2~[CuBr~3~][Br]~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 245-246 |
8101229 | CIF | Fe2 Rb3 Se4 | P n m a | 7.691; 11.403; 12.471 90; 90; 90 | 1094 | Klepp, Kurt O.; Pantschov, Silvio; Boller, Herbert Crystal structure of mixed-valent trirubidium tetraselenidodiferrate, Rb~3~Fe~2~Se~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 5-6 |
8101151 | CIF | Ca8 Ge8 Li1.18 Mg1.82 | P n m a | 21.998; 4.4738; 18.56 90; 90; 90 | 1826.6 | Zürcher, Fabio; Nesper, Reinhard Crystal structure of octacalcium dimagnesium monolithium octasilicide, Ca~8~Mg~2.0~Li~1.0~Si~8~, and of octacalcium dimagnesium monolithium octagermanide, Ca~8~Mg~1.82~Li~1.18~Ge~8~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 507-509 |
8101150 | CIF | Ca8 Li Mg2 Si8 | P n m a | 21.707; 4.4827; 18.456 90; 90; 90 | 1795.9 | Zürcher, Fabio; Nesper, Reinhard Crystal structure of octacalcium dimagnesium monolithium octasilicide, Ca~8~Mg~2.0~Li~1.0~Si~8~, and of octacalcium dimagnesium monolithium octagermanide, Ca~8~Mg~1.82~Li~1.18~Ge~8~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 507-509 |
8101144 | CIF | As3 O Sr3 Ta | P n m a | 6.398; 10.685; 12.966 90; 90; 90 | 886.4 | Derrien, Gaëlle; Tillard, Monique; Belin, Claude Crystal structure of strontium tantalum arsenide oxide, Sr~3~TaAs~3~O, containing the pseudo-tetrahedral anion TaAs~3~O^6‒^ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 499-500 |
8101142 | CIF | Rb3 S4 V | P n m a | 9.396; 10.8892; 9.3639 90; 90; 90 | 958.07 | Emirdag-Eanes, Mehtap; Ibers, James A. Crystal structure of tricesium tetrathiovanadate(V), Cs~3~VS~4~, and of trirubidium tetrathiovanadate(V), Rb~3~VS~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 489-490 |
8101141 | CIF | Cs3 S4 V | P n m a | 9.7097; 11.3627; 9.6824 90; 90; 90 | 1068.24 | Emirdag-Eanes, Mehtap; Ibers,James A. Crystal structure of tricesium tetrathiovanadate(V), Cs~3~VS~4~, and of trirubidium tetrathiovanadate(V), Rb~3~VS~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 489-490 |
8101140 | CIF | K2 Mo S4 | P n m a | 9.3203; 6.843; 12.0806 90; 90; 90 | 770.49 | Emirdag-Eanes, Mehtap; Ibers, James A. Crystal structure of dipotassium tetrathiomolybdate, K~2~MoS~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 484-484 |
8101047 | CIF | C6 H19 Al Cl2 N2 | P n m a | 9.3016; 10.626; 12.1986 90; 90; 90 | 1205.7 | Torrison, L.; Groy, T. L.; Kouvetakis, J. Crystal structure of bis(trimethylamine) dichlorodeuteroalane, [N(CH~3~)~3~]~2~Cl~2~DAl Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 467-468 |
8100916 | CIF | Cs2 H P | P n m a | 8.626; 5.86; 10.759 90; 90; 90 | 543.85 | Somer, Mehmet; Carrillo-Cabrera, Wilder; Grin, Yuri; Peters, Karl; von Schnering, Hans Georg Crystal structure of dicaesium hydrogenphosphide, Cs~2~[PH] Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 42-42 |
8100813 | CIF | Cl4 Ga Rb | P n m a | 11.1699; 7.0882; 9.3003 90; 90; 90 | 736.35 | Mi, Jin-Xiao; Zhang, Hui; Deng, Jin-Feng; Mao, Shao-yu; Zhao, Jing-Tai Crystal structure of rubidium tetrachlorogallate, RbGaCl~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 479-480 |
8100787 | CIF | C6 H12 S6 | P n m a | 9.954; 12.617; 9.716 90; 90; 90 | 1220.3 | Mahjoub, Ahmed; Zantour, Hédi; Masson, Serge Crystal structure of dithioacetic acid trimers, (CH~3~C(SH)S)~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 597-598 |
8100756 | CIF | C6 H14 N2 O7 | P n m a | 10.775; 14.715; 6.165 90; 90; 90 | 977.5 | Andrade, L.C.R.; Costa, M.M.R.; Paixão, J.A.; Santos, M.L.; Agostinho Moreira, J.; Chaves, M.R.; Almeida, A. Crystal structure of diammonium hydrogen-2-hydroxy-1,2,3-propanetricarboxylate, (NH~4~)~2~(C~6~H~6~O~7~) Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 537-538 |
8100734 | CIF | Cl8 O2 Si3 | P n m a | 10.6694; 20.317; 6.1833 90; 90; 90 | 1340.3 | Binnewies, M.; Borrmann, H. Crystal structure of catena-octachlorotrisiloxane, Si~3~O~2~Cl~8~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 324-324 |
8100727 | CIF | Cs3 S4 Sb | P n m a | 9.9398; 11.667; 9.9912 90; 90; 90 | 1158.7 | So, Won-Wook; Martin, Benjamin R.; Dorhout, Peter K. Crystal structure of caesium tetrathioantimonate(V), Cs~3~SbS~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 302-302 |
8100581 | CIF | C Cl Hg N S | P n m a | 10.4018; 4.1843; 10.2021 90; 90; 90 | 444.04 | Mosset, Alain; Bagieu-Beucher, Muriel Redetermination of the crystal structure of mercury chlorothiocyanate, HgClSCN Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 1-2 |
8100562 | CIF | C5 H19 Ca0.18 Cl2 N O6 Sr0.82 | P n m a | 6.7837; 13.178; 15.06 90; 90; 90 | 1346.3 | Andrade, L. C. R.; Costa, M. M. R.; Paixão, J. A.; Santos, M. L.; Agostinho Moreira, J.; Chaves, M. R.; Almeida, A. Crystal structure of calcium doped strontium betaine chloride tetrahydrate, (C~5~NO~2~H~11~)(Ca~0.18~Sr~0.82~)Cl~2~ · 4H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 79-80 |
8100531 | CIF | C20 H30 Cl2 Ti | P n m a | 14.3763; 12.1045; 11.6138 90; 90; 90 | 2021 | Stroot, Jörg; Haase, Detlev; Saak, Wolfgang; Beckhaus, Rüdiger Crystal structure of (eta^5^-pentamethylcyclopentadienyl)(eta^5^-1- (2,2-dimethylpropyl)cyclopentadienyl)titaniumdichloride, C~20~H~30~Cl~2~Ti Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 49-50 |
8100497 | CIF | Na4 Se4 Si | P n m a | 14.182; 9.208; 7.122 90; 90; 90 | 930.1 | Preishuber-Pflügl, Helga; Klepp, O. Kurt Crystal structure of tetrasodium tetraselenidosilicate(IV), Na~4~SiSe~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 383-384 |
8100484 | CIF | C17 H22 Co N2 O5 | P n m a | 7.9443; 14.346; 16.544 90; 90; 90 | 1885.5 | Ling, Hong; Feng, Yun-long Crystal structure of (aqua)(benzimidazole-N)bis(2,4-pentanedionato-O,O') cobalt(II), C~17~H~22~CoN~2~O~5~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 533-534 |
8100468 | CIF | C4 H2 S5 | P n m a | 13.0147; 9.1925; 6.151 90; 90; 90 | 735.89 | Liu, Zhi; Yu, Wen-Tao; Tao, Xu-Tang; Jiang, Min-Hua Crystal structure of 4,5-methylenedithio-1,3-dithiol-2-thione, C~4~H~2~S~5~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 543-544 |
8100419 | CIF | Al2 F2 Ge O4 | P n m a | 8.985; 8.521; 4.755 90; 90; 90 | 364.04 | Mathews, M. D.; Tyagi, A. K.; Koehler, Juergen Crystal structure of dialuminum difluorotetraoxogermanate, Al~2~GeO~4~F~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 276-276 |
8100363 | CIF | Ce Ni10 P4 | P n m a | 9.263; 3.6654; 22.092 90; 90; 90 | 750.08 | Budnyk, Sergii; Prots, Yurii; Kuz'ma, Yurii; Grin, Yuri The crystal structure of cerium decanickel tetraphosphide, CeNi~10~P~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 161-162 |
8100338 | CIF | C16 H20 Er N O11 | P n m a | 7.7439; 21.929; 11.013 90; 90; 90 | 1870.2 | Feng, Yun-Long; Zhao, Guo-Liang Crystal structure of triaquabis(vanillin-O,O')nitritoerbium(III), Er(C~8~H~7~O~3~)~2~(NO~2)~(H~2~O)~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 239-240 |
8100298 | CIF | Ga H O2 | P n m a | 9.7907; 2.9732; 4.5171 90; 90; 90 | 131.491 | Li, S.-J.; Zheng, C.; Lobring, K. C. Refinement of the crystal structure of gallium oxide hydroxide, GaO(OH) Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 11-12 |
8100140 | CIF | C18 H33 I Sn | P n m a | 12.265; 16.707; 10.044 90; 90; 90 | 2058.1 | Reuter, Hans Redetermination of the crystal structure of tricyclohexyltin(IV) iodide, [Sn(C~6~H~11~)~3~]I Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 327-328 |
8100125 | CIF | C6 H11 N2 O4 P | P n m a | 12.102; 6.695; 11.306 90; 90; 90 | 916.1 | Kaabi, Kamel; Khedhiri, Lamia Crystal structure of 2-amino-4-methylpyridinium dihydrogenphosphate, (C~6~H~9~N~2~)H~2~PO~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 255-256 |
8100087 | CIF | Ge2 Li Yb | P n m a | 7.939; 3.8824; 10.524 90; 90; 90 | 324.39 | Xie, Qin-Xing; Nesper, Reinhard Crystal structure of ytterbium lithium digermanide, YbLiGe~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 81-82 |
8100084 | CIF | Cl5 Cr H2 O Rb2 | P n m a | 13.8123; 9.7705; 7.1522 90; 90; 90 | 965.21 | Mi, Jin-Xiao; Zhou, Xi; Zhang, Hui; Mao, Shao-Yu; Zhao, Jing-Tai Crystal structure of dirubidium aquapentachlorochromate(III), Rb~2~ [CrCl~5~(H~2~O)] Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 93-94 |
8100033 | CIF | Ca2 Fe1.66 O5 V0.34 | P n m a | 5.4171; 14.774; 5.584 90; 90; 90 | 446.9 | Harringer, N. A.; Presslinger, H.; Klepp, K. O. Crystal structure of a mixed dicalcium ferrite, Ca~2~Fe~1.66~V~0.34~O~5~ Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 5-6 |
8000502 | CIF | C4 H12 Br3 N O Pb | P n m a | 15.343; 7.8403; 10.165 90; 90; 90 | 1222.8 | Huang, Xue-Qin; Zhang, Hua; Wang, Fang; Gan, Tian; Xu, Zhe-Kun; Wang, Zhong-Xia A Photoluminescent Lead Bromide Hybrid Perovskite Molecular Ferroelastic Semiconductor with Sequential High-<i>T</i><sub>c</sub> Phase Transitions. The journal of physical chemistry letters, 2021, 12, 5221-5227 |
8000483 | CIF | Bi Cl Cs | P n m a | 18.589; 7.6364; 13.203 90; 90; 90 | 1874.2 | Tailor, Naveen Kumar; Maity, Partha; Saidaminov, Makhsud I.; Pradhan, Narayan; Satapathi, Soumitra Dark Self-Healing-Mediated Negative Photoconductivity of a Lead-Free Cs<sub>3</sub>Bi<sub>2</sub>Cl<sub>9</sub> Perovskite Single Crystal. The journal of physical chemistry letters, 2021, 12, 2286-2292 |
8000428 | CIF | C8 H20 Br4 N2 Pb | P n m a | 8.4804; 24.4406; 7.9107 90; 90; 90 | 1639.62 | Su, Binbin; Molokeev, Maxim S.; Xia, Zhiguo Unveiling Mn<sup>2+</sup> Dopant States in Two-Dimensional Halide Perovskite toward Highly Efficient Photoluminescence. The journal of physical chemistry letters, 2020, 11, 2510-2517 |
8000234 | CIF | C H6 I3 N Pb | P n m a | 8.8767; 12.64; 8.5879 90; 90; 90 | 963.58 | G, Sharada; Mahale, Pratibha; Kore, Bhushan P.; Mukherjee, Somdutta; Pavan, Mysore S.; De, Chandan; Ghara, Somnath; Sundaresan, A.; Pandey, Anshu; Guru Row, Tayur N.; Sarma, D. D. Is CH3NH3PbI3 Polar? The journal of physical chemistry letters, 2016, 7, 2412-2419 |
8000218 | CIF | H I Li2 O | P n m a | 10.339; 5.567; 6.643 90; 90; 90 | 382.353 | Gajewski, G.; Mierzwicki, K.; Latajka, Z. Crystal structure and bonding properties of Li2 I (O H) Chemical Physics Letters, 2003, 369, 139-144 |
8000191 | CIF | C4 H6 B F3 N2 | P n m a | 11.538; 6.635; 8.259 90; 90; 90 | 632.3 | Takao, Koichiro; Ikeda, Yasuhisa Alternative Route to Metal Halide Free Ionic Liquids Chemistry Letters, 2008, 37, 682 |
8000069 | CIF | C84 H124 Cu18 N12 O76 P8 | P n m a | 28.958; 30.017; 17.204 90; 90; 90 | 14954 | Takuya Shiga; Kazuya Maruyama; Lingqin Han; Hiroki Oshio Structure and Magnetic Property of an Octadecanuclear Cu(II) Complex Chemistry Letters, 2005, 34, 1648 |
7715752 | CIF | C9 H14 Cu N4 S4 | P n m a | 46.877; 6.963; 8.814 90; 90; 90 | 2876.9 | Geoghegan, Blaise L.; Bilyj, Jessica K.; Bernhardt, Paul V.; DeBeer, Serena; Cutsail, 3rd, George E X-ray absorption and emission spectroscopy of N<sub>2</sub>S<sub>2</sub> Cu(II)/(III) complexes. Dalton transactions (Cambridge, England : 2003), 2024 |
7715731 | CIF | C17 H13 B F2 N2 O2 | P n m a | 15.378; 6.8; 13.574 90; 90; 90 | 1419.4 | Wang, Xiaobai; Rüttger, Franziska; Kretsch, Johannes; Kreyenschmidt, Anne; Herbst-Irmer, Regine; Stalke, Dietmar Boron bis-(4-methylbenzoxazol-2-yl)-methanide complexes Dalton Transactions, 2024 |
7715728 | CIF | C17 H15 B N2 O2 | P n m a | 15.336; 6.707; 13.506 90; 90; 90 | 1389.2 | Wang, Xiaobai; Rüttger, Franziska; Kretsch, Johannes; Kreyenschmidt, Anne; Herbst-Irmer, Regine; Stalke, Dietmar Boron bis-(4-methylbenzoxazol-2-yl)-methanide complexes Dalton Transactions, 2024 |
7715591 | CIF | C4 H8 Cl4 N6 Pb | P n m a | 7.5195; 21.5921; 8.302 90; 90; 90 | 1347.93 | Mączka, Mirosław; Sobczak, Szymon; Ptak, Maciej; Smółka, Szymon; Fedoruk, Katarzyna; Dybała, Filip; Herman, Artur P.; Paraguassu, Waldeci; Zaręba, Jan K; Kudrawiec, Robert; Sieradzki, Adam; Katrusiak, Andrzej Revisiting a (001)-oriented layered lead chloride templated by 1,2,4-triazolium: structural phase transitions, lattice dynamics and broadband photoluminescence. Dalton transactions (Cambridge, England : 2003), 2024, 53, 6906-6919 |
7715590 | CIF | C4 H8 Cl4 N6 Pb | P n m a | 7.4929; 21.5667; 8.3106 90; 90; 90 | 1342.97 | Mączka, Mirosław; Sobczak, Szymon; Ptak, Maciej; Smółka, Szymon; Fedoruk, Katarzyna; Dybała, Filip; Herman, Artur P.; Paraguassu, Waldeci; Zaręba, Jan K; Kudrawiec, Robert; Sieradzki, Adam; Katrusiak, Andrzej Revisiting a (001)-oriented layered lead chloride templated by 1,2,4-triazolium: structural phase transitions, lattice dynamics and broadband photoluminescence. Dalton transactions (Cambridge, England : 2003), 2024, 53, 6906-6919 |
7715588 | CIF | C2.29 H4.57 Cl2.29 N3.43 Pb0.57 | P n m a | 7.4798; 21.5667; 8.3086 90; 90; 90 | 1340.3 | Mączka, Mirosław; Sobczak, Szymon; Ptak, Maciej; Smółka, Szymon; Fedoruk, Katarzyna; Dybała, Filip; Herman, Artur P.; Paraguassu, Waldeci; Zaręba, Jan K; Kudrawiec, Robert; Sieradzki, Adam; Katrusiak, Andrzej Revisiting a (001)-oriented layered lead chloride templated by 1,2,4-triazolium: structural phase transitions, lattice dynamics and broadband photoluminescence. Dalton transactions (Cambridge, England : 2003), 2024, 53, 6906-6919 |
7715523 | CIF | C10 H11 Cl2 N7 O3 S | P n m a | 20.9148; 17.5238; 4.21488 90; 90; 90 | 1544.78 | Lal, Sohan; Staples, Richard J.; Shreeve, Jean'ne M. Azidomethyl-bisoxadiazol-linked-1,2,3-triazole-(ABT)-based potential liquid propellant and energetic plasticizer. Dalton transactions (Cambridge, England : 2003), 2024, 53, 7100-7104 |
7715166 | CIF | C16 H28 Cu N4 O8 P2 | P n m a | 13.4467; 12.0071; 12.9894 90; 90; 90 | 2097.2 | Wang, Jieying; Ping, Yezi; Chen, Yanmei; Liu, Shanshan; Dong, Jinfeng; Ruan, Zhijun; Liang, Xiangming; Lin, Junqi Improvement of electrocatalytic water oxidation activity of novel copper complex by modulating the axial coordination of phosphate on metal center. Dalton transactions (Cambridge, England : 2003), 2024, 53, 5222-5229 |
7715165 | CIF | C16 H22 Cl2 Cu N4 O8 | P n m a | 13.3806; 11.9359; 12.9332 90; 90; 90 | 2065.55 | Wang, Jieying; Ping, Yezi; Chen, Yanmei; Liu, Shanshan; Dong, Jinfeng; Ruan, Zhijun; Liang, Xiangming; Lin, Junqi Improvement of electrocatalytic water oxidation activity of novel copper complex by modulating the axial coordination of phosphate on metal center. Dalton transactions (Cambridge, England : 2003), 2024, 53, 5222-5229 |
7715156 | CIF | C27 H92 Cl6 N12 O40 Zn6 | P n m a | 24.258; 14.863; 18.414 90; 90; 90 | 6639 | Keypour, Hassan; Zeynali, Hamid; Fatemikia, Hojatollah; Ranjbar, Nika; Karamian, Roya; Rezaei, Mohammad Taher; Gable, Robert William Anticancer, antioxidant, and antimicrobial studies and molecular docking of a new hexanuclear Zn(II) complex, together with its X-ray crystal analysis. Dalton transactions (Cambridge, England : 2003), 2024, 53, 4512-4525 |
7715138 | CIF | C29 H43 Cu N2 | P n m a | 15.257; 21.1082; 8.587 90; 90; 90 | 2765.42 | Babula, Dawid J.; Charman, Rex S. C.; Hobson, Josie A.; Mahon, Mary F.; Liptrot, David J. Dial-a-base mechanochemical synthesis of N-heterocyclic carbene copper complexes. Dalton transactions (Cambridge, England : 2003), 2024, 53, 3990-3993 |
7715054 | CIF | Cl5 H2 K2 O Ru | P n m a | 13.5704; 9.633; 7.0067 90; 90; 90 | 915.9 | He, Yu-Ru; Zhang, Mi; Huang, Wen-Hui; Xue, Xiang-Xian; Zhou, Zi-Qin; Feng, Li-Na; Yang, Jian-Hui; Liu, Bin Edge-sharing bi-octahedral diruthenium(IV,IV) compounds containing Ru-Ru bonds chelated and bridged by two carbonate and two oxo groups. Dalton transactions (Cambridge, England : 2003), 2024, 53, 4598-4606 |
7714999 | CIF | C16 H11 Cr Mn N7 | P n m a | 14.3053; 7.2469; 17.0304 90; 90; 90 | 1765.53 | Imamura, Yuki; Yoshino, Haruka; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki A novel style of 2D Hofmann-type coordination polymer incorporated trigonal prismatic coordination geometry with bidentate co-ligands. Dalton transactions (Cambridge, England : 2003), 2024, 53, 3970-3974 |
7714998 | CIF | C16 H12 Mn2 N7 | P n m a | 13.99; 7.058; 16.715 90; 90; 90 | 1650.46 | Imamura, Yuki; Yoshino, Haruka; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki A novel style of 2D Hofmann-type coordination polymer incorporated trigonal prismatic coordination geometry with bidentate co-ligands. Dalton transactions (Cambridge, England : 2003), 2024, 53, 3970-3974 |
7714794 | CIF | C3 H15 Br5 Mn N6 | P n m a | 11.2782; 15.363; 9.5551 90; 90; 90 | 1655.58 | Fateev, Sergey A.; Kozhevnikova, Vladislava Y.; Kuznetsov, Kirill M.; Belikova, Daria E.; Khrustalev, Victor N.; Goodilin, Eugene A.; Tarasov, Alexey B. Optical and scintillation properties of hybrid manganese(II) bromides with formamidinium and acetamidinium cations. Dalton transactions (Cambridge, England : 2003), 2024, 53, 2722-2730 |
7714575 | CIF | C11 H15 B F N O2 | P n m a | 6.7095; 10.7458; 15.4294 90; 90; 90 | 1112.44 | Lenz, Tabea; Hebenbrock, Marian Phenylsilver - an unexpected one-dimensional coordination polymer of silver(I) tetrads. Dalton transactions (Cambridge, England : 2003), 2024, 53, 423-427 |
7714436 | CIF | C5 H6 Cs N7 Ni2 O18 | P n m a | 8.632; 11.859; 18.173 90; 90; 90 | 1860.3 | Vorobyova, Anna; Lyssenko, Konstantin; Chistyakov, Gregory; Morozov, Igor V.; Ovchenkov, Yevgeny; Vasilchikova, Tatyana M.; Koo, Hyun-Joo; Whangbo, Mike; Volkova, Olga S.; Vasiliev, Alexander Combination of Organic and Inorganic Cations in Synthesis of Transition Metal Nitrates: Preparation and Characterization of Canted Rectangular Ising Antiferromagnet (PyH)CsCo2(NO3)6 Dalton Transactions, 2023 |
7714435 | CIF | C5 H10 N8 Ni2 O18 | P n m a | 8.658; 11.869; 17.593 90; 90; 90 | 1807.9 | Vorobyova, Anna; Lyssenko, Konstantin; Chistyakov, Gregory; Morozov, Igor V.; Ovchenkov, Yevgeny; Vasilchikova, Tatyana M.; Koo, Hyun-Joo; Whangbo, Mike; Volkova, Olga S.; Vasiliev, Alexander Combination of Organic and Inorganic Cations in Synthesis of Transition Metal Nitrates: Preparation and Characterization of Canted Rectangular Ising Antiferromagnet (PyH)CsCo2(NO3)6 Dalton Transactions, 2023 |
7714434 | CIF | C5 H6 Co2 Cs N7 O18 | P n m a | 8.6905; 11.9599; 18.386 90; 90; 90 | 1911 | Vorobyova, Anna; Lyssenko, Konstantin; Chistyakov, Gregory; Morozov, Igor V.; Ovchenkov, Yevgeny; Vasilchikova, Tatyana M.; Koo, Hyun-Joo; Whangbo, Mike; Volkova, Olga S.; Vasiliev, Alexander Combination of Organic and Inorganic Cations in Synthesis of Transition Metal Nitrates: Preparation and Characterization of Canted Rectangular Ising Antiferromagnet (PyH)CsCo2(NO3)6 Dalton Transactions, 2023 |
7714429 | CIF | C11 H9 N3 O5 Pb | P n m a | 7.151; 6.596; 25.646 90; 90; 90 | 1209.7 | Lv, Qiu; Guan, Qing Lin; Li, Jin Long; Li, Jin Xiao; Jin, Jing; Bai, Feng Ying; Xing, Yong Heng Smart crystalline framework materials with a triazole carboxylic acid ligand: fluorescence sensing and catalytic reduction of PNP. Dalton transactions (Cambridge, England : 2003), 2023 |
7714368 | CIF | C8 H6 Co2 N6 O5 | P n m a | 11.0584; 6.5961; 16.3424 90; 90; 90 | 1192.1 | Ding, Bo; Liu, Zhong-Yi; Gong, Xin-JIng; Tang, Hui-Min; Wang, Xiu-Guang; Liu, Zheng-Yu; Dong, Hui-Ming; Liu, Jing; Yang, En-Cui Interlayer interaction force-tuned magnetic responses in CoII-tetrazolate-carboxylate system from canted antiferromagnet to field-induced metamagnet Dalton Transactions, 2023 |
7714330 | CIF | C6 H10 I4 N2 Sn | P n m a | 9.496; 12.83; 24.979 90; 90; 90 | 3043.3 | Jung, Mi Hee Diammonium Spacer-Induced Stable Zigzag Type 2D Dion-Jacobson Lead/Tin-Based Perovskite Solar Cells Dalton Transactions, 2023 |
7714323 | CIF | B Ba3 P S7 | P n m a | 8.8167; 6.5913; 21.1218 90; 90; 90 | 1227.46 | Zhou, Jiazheng; Wang, Linan; Wang, Hongshan; Luo, Ling; Li, Junjie; Yu, Feng Ba3(BS3)(PS4): The First Alkaline-Earth Metal Thioborate-Thiophosphate with Strong Optical Anisotropy Originated from Planar [BS3] Units Dalton Transactions, 2023 |
7714125 | CIF | C16 H12 Br I N2 Pt | P n m a | 20.7756; 23.3714; 10.0722 90; 90; 90 | 4890.6 | Gitlina, Anastasiia Yu.; Petrovskii, Stanislav; Luginin, Maksim; Melnikov, Alexei S.; Rychagova, Elena A.; Ketkov, Sergey Yu.; Grachova, Elena V. X/Y Platinum(II) complexes: some features of supramolecular assembly via halogen bonding Dalton Transactions, 2023 |
7714048 | CIF | C28 H44 Bi2 I10 N8 | P n m a | 17.9971; 20.3282; 13.9362 90; 90; 90 | 5098.5 | Abdi, Gisya; Gryl, Marlena; Sławek, Andrzej; Kowalewska, Ewelina; Mazur, Tomasz; Podborska, Agnieszka; Mech, Krzysztof; Zawal, Piotr; Pritam, Anurag; Kmita, Angelika; Alluhaibi, Lulu; Maximenko, Alexey; Chakkooth, Vijayakumar; Szacilowski, Konrad Influence of Crystal Structure and Composition on Optical and Electronic Properties of Pyridinium-based Bismuth Iodide Complexes Dalton Transactions, 2023 |
7713853 | CIF | C4 H6 Ag Cl N4 O5 | P n m a | 9.4181; 6.6865; 14.2531 90; 90; 90 | 897.58 | Zhang, Chao; Wang, Tingwei; Lu, Zu-Jia; Yi, Zhenxin; Kuang, Baolong; Bu, Shu; Xie, Zhiming; Li, Yan; Wang, Kun; Zhang, Jianguo Optimization of Performance and Sensitivity: Preparation of Two Ag(I)-based ECPs by Using Isomeric Ligands Dalton Transactions, 2023 |
7713792 | CIF | C25 H36 Cl2 Co N2 | P n m a | 14.7263; 17.7923; 9.6321 90; 90; 90 | 2523.8 | Fu, Yuan; Tang, Jian; Hua, Jing Ultrahigh Activity and Broad Temperature Resistance of Amine-Imine Cobalt Precatalysts for Butadiene Polymerization Dalton Transactions, 2023 |
7713520 | CIF | Ba4 H6 O18 P6 Zn2 | P n m a | 16.7903; 5.3088; 11.5314 90; 90; 90 | 1027.87 | Zhang, Yu; Liu, Xia; Liu, Qian-Yan; Wang, Jianhua; HU, Ting; Lin, Yan-Mei; Zhang, Jian-Han CaZn(HPO3)2 and Ba2Zn(HPO3)3 : Novel Alkaline-Earth Zincophosphites with Diversified Anionic Frameworks Dalton Transactions, 2023 |
7713519 | CIF | C15 H25 Cl F3 N O9 S | P n m a | 8.8615; 11.5618; 23.392 90; 90; 90 | 2396.6 | Song, Ning; Ying, Ting-Ting; Tan, Yu-Hui; Tang, Yun Zhi; Liao, Juan; Wang, Li Juan; Wang, Fang Xin; Wan, Ming-Yang 2-Chloroethylamine·Trifluoromethanesulfonate Combined with 18-Crown-6: a Ferroelectric with Excellent Dielectric Switching Properties Dalton Transactions, 2023 |
7713354 | CIF | C53 H51 Cl2 F10 N3 O2 Zn | P n m a | 16.6388; 20.2254; 15.4445 90; 90; 90 | 5197.5 | Delgado-Collado, Juan Manuel; Gallardo-Villagrán, Manuel; Alvarez González, Eleuterio; Campora, Juan; Rodríguez Delgado, Antonio Ligand and Metal-Centred Reactivity in 2,6-bis(imino)-1,4-dihydropyridinate Zn(II) alkyls: the dual behaviour of an intriguing type of complex. Dalton Transactions, 2023 |
7713338 | CIF | C10 Cd I4 N2 | P n m a | 14.196; 9.791; 17.224 90; 90; 90 | 2394 | Zhang, Si-Yue; Zhang, Zhi-Cheng; Zhang, Tie; Ni, Hao-Fei; Zhang, Zhixu; Fu, Da-Wei; Lu, Hai-Feng Methyl Regulation Triggers High-Temperature Ferroelastic Phase Transition Dalton Transactions, 2023 |
7713337 | CIF | C12 H32 Cd I4 N2 | P n m a | 14.3623; 9.9781; 17.5752 90; 90; 90 | 2518.7 | Zhang, Si-Yue; Zhang, Zhi-Cheng; Zhang, Tie; Ni, Hao-Fei; Zhang, Zhixu; Fu, Da-Wei; Lu, Hai-Feng Methyl Regulation Triggers High-Temperature Ferroelastic Phase Transition Dalton Transactions, 2023 |
7713335 | CIF | C8 Cd I4 N2 | P n m a | 13.3771; 9.7035; 16.8488 90; 90; 90 | 2187.1 | Zhang, Si-Yue; Zhang, Zhi-Cheng; Zhang, Tie; Ni, Hao-Fei; Zhang, Zhixu; Fu, Da-Wei; Lu, Hai-Feng Methyl Regulation Triggers High-Temperature Ferroelastic Phase Transition Dalton Transactions, 2023 |
7713314 | CIF | C14 H12 N2 Pt S4 | P n m a | 7.8675; 14.825; 12.827 90; 90; 90 | 1496.1 | Pintus, Anna; Pilloni, Cristian; Pippia, Gabriele; Podda, Enrico; Carla Aragoni, M.; Lippolis, Vito; Aloukos, Panagiotis; Potamianos, Dionysios; Chazapis, Nikolaos; Couris, Stelios; Anyfantis, George C.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Arca, Massimiliano A new class of third-order nonlinear optical materials: laser pulse-duration dependant saturable absorption and nonlinear refraction in platinum(II) diimine-dithiolate complexes. Dalton transactions (Cambridge, England : 2003), 2023 |
7713277 | CIF | Cs4 Mn Mo7 O32.25 | P n m a | 23.5716; 10.7966; 12.5938 90; 90; 90 | 3205 | Shang, Jining; Li, Xiang; Ren, Yuanhang; Ding, Hongxin; Cao, Jiapeng; He, Rui; Yue, Bin; He, Heyong An one-dimensional chain of manganese(II) bridged peroxomolybdate isolated from aqueous Mn-polymolybdate-H2O2 system Dalton Transactions, 2023 |
7713276 | CIF | Cs8 Mn2 Mo14 O65 | P n m a | 23.5716; 10.7966; 12.5938 90; 90; 90 | 3205 | Shang, Jining; Li, Xiang; Ren, Yuanhang; Ding, Hongxin; Cao, Jiapeng; He, Rui; Yue, Bin; He, Heyong An one-dimensional chain of manganese(II) bridged peroxomolybdate isolated from aqueous Mn-polymolybdate-H2O2 system Dalton Transactions, 2023 |
7713008 | CIF | C30 H50 Br Cl3 Mn3 N6 O11 | P n m a | 11.7529; 20.8862; 18.2988 90; 90; 90 | 4491.87 | Pražáková, Marie; Ndiaye, Daouda; Toth, Eva J.; Drahoš, Bohuslav Seven-coordinate Mn(II) complex with a pyridine-based 15-membered macrocyclic ligand containing one acetate pendant arm: structure, stability and relaxation properties Dalton Transactions, 2023 |
7712837 | CIF | C28 H63 Br Fe Si9 | P n m a | 17.7129; 18.7916; 12.3172 90; 90; 90 | 4099.8 | Rupf, Susanne M.; Sievers, Robin; Riemann, Paulin S.; Reimann, Marc; Kaupp, Martin; Fasting, Dr. Carlo; Malischewski, Moritz Persilylation of Ferrocene: The Ultimate Discipline in Sterically Overcrowded Metal Complexes Dalton Transactions, 2023 |
7712614 | CIF | C16 H18 B10 N2 | P n m a | 15.7091; 15.5322; 8.0832 90; 90; 90 | 1972.28 | Xu, Shi-Nuo; Zheng, Yan; Ye, Jing-Yao; Chen, Zhong-Yang; Yan, Jian-Feng; Geng, Yan-Hou; Hong, Wenjing; Yuan, Yao-Feng Conductance of <i>o</i>-carborane-based wires with different substitution patterns. Dalton transactions (Cambridge, England : 2003), 2023 |
7712612 | CIF | C23 H28 Ag3 I6 N5 O2 | P n m a | 19.595; 22.8721; 8.1757 90; 90; 90 | 3664.2 | Leng, Feng; Zhang, Xiao; Yu, Jie-Hui Photocatalytic properties of iodometallates with <i>in situ</i>-generated organic bases as countercations. Dalton transactions (Cambridge, England : 2003), 2023, 52, 5127-5140 |
7712611 | CIF | C23 H28 Cu3 I6 N5 O2 | P n m a | 19.4682; 22.7439; 8.0177 90; 90; 90 | 3550.1 | Leng, Feng; Zhang, Xiao; Yu, Jie-Hui Photocatalytic properties of iodometallates with <i>in situ</i>-generated organic bases as countercations. Dalton transactions (Cambridge, England : 2003), 2023, 52, 5127-5140 |
7712536 | CIF | C11 H13 O Se0.5 | P n m a | 18.412; 23.1159; 4.717 90; 90; 90 | 2007.6 | Joshi, Hemant; Kumar, Sunil; Singh, Sohan; Mahala, Suman; Janjani, Prachi; Rajagopala Reddy, S.; Rom, Tanmay; Paul, Avijit; Roy, Partha Palladium complex of macrocyclic selenium ligand: Catalyst for dehydroxymethylation of dihydroxy compounds Dalton Transactions, 2023 |
7712404 | CIF | C6 H4 Ca Fe K2 N6 O2 | P n m a | 12.8405; 13.7735; 7.3358 90; 90; 90 | 1297.4 | Qiao, Xianji; Qiu, Yi; Xin, Junjie; Da, Chen; Ma, Zili; Corkett, Alex; Cai, Guohong; Cai, Guanqun; Qu, Shangqing; Wang, Yuchao; Zhu, Zhenyu; Gao, Yiman; Wang, Zhigang; Dronskowski, Richard; Li, Guobao; Sun, Junliang Synthesis, Crystal Structures and Semiconducting Properties of New Hexacyanidomettallates Dalton Transactions, 2023 |
7711743 | CIF | C4 H3 N7 O3 | P n m a | 13.2552; 6.7087; 7.6337 90; 90; 90 | 678.83 | Shreeve, Jean'ne M.; Chinnam, Ajay Kumar; Tang, Yongxing; Staples, Richard J. Effects of nitric acid concentration for nitration of fused [1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine Dalton Transactions, 2022 |
7711711 | CIF | C10 H16 Mo2 N4 O10 S | P n m a | 13.1969; 23.5561; 5.9279 90; 90; 90 | 1842.79 | Lin, Rong-Yan; Deng, Lan; An, Dong-Li; Zhou, Zhao-Hui Binuclear, tetranuclear and hexadecanuclear thio-oxomolybdenum(V/IV) glycolates with selective adsorptions of gases. Dalton transactions (Cambridge, England : 2003), 2023, 52, 562-571 |
7711692 | CIF | K P S4 Sr | P n m a | 16.849; 6.6365; 6.5607 90; 90; 90 | 733.61 | Huang, Yi; Huang, Junben; Zhang, Yong Wide band gap thiophosphates ASrPS<sub>4</sub> (A = Li, Na, K, Rb, Cs): cation size effect induced successive structural transformation. Dalton transactions (Cambridge, England : 2003), 2022, 51, 15067-15073 |
7711691 | CIF | P Rb S4 Sr | P n m a | 17.3427; 6.6969; 6.513 90; 90; 90 | 756.43 | Huang, Yi; Huang, Junben; Zhang, Yong Wide band gap thiophosphates ASrPS<sub>4</sub> (A = Li, Na, K, Rb, Cs): cation size effect induced successive structural transformation. Dalton transactions (Cambridge, England : 2003), 2022, 51, 15067-15073 |
7711690 | CIF | Cs P S4 Sr | P n m a | 18.0743; 6.7904; 6.4174 90; 90; 90 | 787.62 | Huang, Yi; Huang, Junben; Zhang, Yong Wide band gap thiophosphates ASrPS<sub>4</sub> (A = Li, Na, K, Rb, Cs): cation size effect induced successive structural transformation. Dalton transactions (Cambridge, England : 2003), 2022, 51, 15067-15073 |
7711296 | CIF | C8 H11 Cd Cl4 N | P n m a | 14.446; 6.8496; 12.429 90; 90; 90 | 1229.8 | Liu, Jia; Han, Li-Jun; Shao, Ting; Su, Chang-Yuan; Chen, Ming; Huang, Pei-Zhi; Jia, Qiang-Qiang; Fu, Da-Wei; Lu, Hai-Feng Metal ion induced dual switchable dielectric and luminescent properties in hybrid halides Dalton Transactions, 2022 |
7711256 | CIF | C12 H28 I3 N O6 Pb | P n m a | 8.3103; 15.9036; 18.3037 90; 90; 90 | 2419.1 | Xie, Yu-Xin; Yuan, Guo-Jun; Miao, Ji-Bin; Luan, Ye-Ting; Li, Li; Chen, Hong; Ren, Xiaoming Two-step thermotropic phase transition and dielectric relaxation in 1D supramolecular lead iodide perovskite [NH4@18-crown ether]PbI3 Dalton Transactions, 2022 |
7711058 | CIF | C36 H55 B N2 | P n m a | 19.1631; 19.543; 8.3341 90; 90; 90 | 3121.2 | Kundu, Gargi; Dixit, Ruchi; Tothadi, Srinu; Vanka, Kumar; Sen, Sakya Singha Versatile chemistry of six-membered NHC with boranes: bromination at sp3 borane, activation of B–H bond of HBpin, and ring expansion of NHC Dalton Transactions, 2022 |
7710998 | CIF | C84 H76 Cl8 Co4 N28 O48 | P n m a | 36.8996; 19.0503; 21.1241 90; 90; 90 | 14849.2 | Yang, Qianqian; Wang, Guo-Lu; Zhang, Yi-Quan; Tang, Jinkui Self-assembly of fish-bone and grid-like CoII-based single-molecule magnets using dihydrazone ligands with NNN and NNO pockets Dalton Transactions, 2022 |
7710895 | CIF | C25 H34 N2 | P n m a | 10.4134; 12.3697; 16.5809 90; 90; 90 | 2135.8 | Koneczny, Marvin; Erol, Arife Büsra; Mauduit, Marc; Eisen, Moris S.; Tamm, Matthias Titanium complexes with unsymmetrically substituted imidazolin-2-iminato ligands. Dalton transactions (Cambridge, England : 2003), 2022, 51, 11448-11456 |
7710826 | CIF | C18 H22 B Br N6 O2 W | P n m a | 20.2626; 13.7288; 7.9566 90; 90; 90 | 2213.38 | Burt, Liam K.; Dewhurst, Rian D.; Hill, Anthony F.; Kong, Richard Y.; Nahon, Emily E.; Onn, Chee S. Heterobimetallic μ2-halocarbyne complexes Dalton Transactions, 2022 |
7710822 | CIF | C18 H22 B Br Mo N6 O2 | P n m a | 20.494; 13.7716; 7.9961 90; 90; 90 | 2256.78 | Burt, Liam K.; Dewhurst, Rian D.; Hill, Anthony F.; Kong, Richard Y.; Nahon, Emily E.; Onn, Chee S. Heterobimetallic μ2-halocarbyne complexes Dalton Transactions, 2022 |
7710817 | CIF | C16 H22 B Cl3 N6 W | P n m a | 16.281; 12.8355; 13.3658 90; 90; 90 | 2793.12 | Burt, Liam K.; Dewhurst, Rian D.; Hill, Anthony F.; Kong, Richard Y.; Nahon, Emily E.; Onn, Chee S. Heterobimetallic μ2-halocarbyne complexes Dalton Transactions, 2022 |
7710637 | CIF | C37.33 H33.33 Cl F3 O3 P2 Pd S | P n m a | 19.642; 45.952; 11.984 90; 90; 90 | 10817 | Scattolin, Thomas; Visentin, Fabiano; Bortolamiol, Enrica; Caligiuri, Isabella; Rizzolio, Flavio; Cavallo, Luigi; Zhang, Ziyun; Demitri, Nicola; Fama, Francesco Cationic Palladium(II)-Indenyl complexes bearing phosphines as ancillary ligands: synthesis, study of indenyl amination and anticancer activity Dalton Transactions, 2022 |
7710385 | CIF | C28 H31 N4 Ni O2 | P n m a | 13.2969; 6.7069; 27.78 90; 90; 90 | 2477.4 | Mukhopadhyay, Narottam; Sengupta, Arunava; Vijay, Aswin Kottapurath; Lloret, Francesc; Mukherjee, Rabindranath Ni(ii) complexes of a new tetradentate NN′N′′O picolinoyl-1,2-phenylenediamide-phenolate redox-active ligand at different redox levels Dalton Transactions, 2022 |
7710282 | CIF | C45 H49 Cl Fe N2 | P n m a | 12.3687; 22.9892; 13.9721 90; 90; 90 | 3972.9 | Li, Yuzhu; Xi, Jing; Ferrando-Soria, Jesús; Zhang, Yi-Quan; Wang, Wenyuan; Song, You; Guo, Yan; Pardo, Emilio; Liu, Xiangyu Slow magnetic relaxation in a trigonal-planar mononuclear Fe(ii) complex Dalton Transactions, 2022 |
7710226 | CIF | C59.59 H41.59 Cl6.78 N2 P2 Si2 Zn | P n m a | 11.216; 25.174; 19.437 90; 90; 90 | 5488 | Gildenast, Hans; Gruszien, Lukas; Friedt, Felix; Englert, Ulli Phosphorus or nitrogen – the first phosphatriptycene in coordination polymer chemistry Dalton Transactions, 2022 |
7710164 | CIF | C3 H8 Br2 Cd0.5 N | P n m a | 13.7873; 14.7844; 6.9901 90; 90; 90 | 1424.84 | Gautier, Romain; PARIS, Michael; Massuyeau, Florian Templating Effect of Trans-2,5-dimethylpiperazine (TDMP) on the Structure Dimensionality of Hybrid Metal Halides Dalton Transactions, 2022 |
7710102 | CIF | C6 H6 Cr3 K4 O66 Si Ta W11 | P n m a | 24.4565; 16.0527; 17.0555 90; 90; 90 | 6695.9 | Weng, Zhewei; Ogiwara, Naoki; Yokogawa, Daisuke; Kitao, Takashi; Kikukawa, Yuji; Uchida, Sayaka Basicity of Isostructural Porous Ionic Crystals Composed of Nb/Ta-Substituted Keggin-Type Polyoxotungstates Dalton Transactions, 2022 |
7710101 | CIF | C6 H6 Cr3 K4 Nb O66 Si W11 | P n m a | 24.4216; 16.0494; 17.0259 90; 90; 90 | 6673.34 | Weng, Zhewei; Ogiwara, Naoki; Yokogawa, Daisuke; Kitao, Takashi; Kikukawa, Yuji; Uchida, Sayaka Basicity of Isostructural Porous Ionic Crystals Composed of Nb/Ta-Substituted Keggin-Type Polyoxotungstates Dalton Transactions, 2022 |
7710100 | CIF | C6 H6 B Cr3 K4 O66 W12 | P n m a | 24.3679; 15.9691; 16.9507 90; 90; 90 | 6596.08 | Weng, Zhewei; Ogiwara, Naoki; Yokogawa, Daisuke; Kitao, Takashi; Kikukawa, Yuji; Uchida, Sayaka Basicity of Isostructural Porous Ionic Crystals Composed of Nb/Ta-Substituted Keggin-Type Polyoxotungstates Dalton Transactions, 2022 |
7709816 | CIF | C30 H41 B2 N3 O | P n m a | 17.4262; 9.40374; 17.0884 90; 90; 90 | 2800.3 | Becker, Christian; Schwabedissen, Jan; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W. Frustrated Lewis pair chemistry of hydride sponges Dalton Transactions, 2022 |
7709523 | CIF | C42 H50 Ga N2 | P n m a | 18.7199; 18.2981; 10.5069 90; 90; 90 | 3599.02 | Dodonov, Vladimir Alekseevich; Kushnerova, Olga A.; Rumyantcev, Roman V.; Novikov, Alexander S.; Osmanov, Vladimir K.; Fedushkin, Igor Leonidovich Cycloaddition of isoselenocyanates to sodium and magnesium metallacycles Dalton Transactions, 2022 |
7709493 | CIF | C27 H36 Br2 N2 Se | P n m a | 12.3667; 20.3331; 10.443 90; 90; 90 | 2625.93 | Saab, Marina; Nelson, David J.; Leech, Matthew C.; Lam, Kevin; Nolan, Steven P.; Nahra, Fady; Van Hecke, Kristof Reactions of N-heterocyclic carbene-based chalcogenoureas with halogens: a diverse range of outcomes Dalton Transactions, 2022 |
7709328 | CIF | C4 H12 Cl6 S2 Se3 W2 | P n m a | 13.5882; 19.5279; 6.69716 90; 90; 90 | 1777.08 | Greenacre, Victoria K.; Hector, Andrew L.; Huang, Ruomeng; Levason, William; Sethi, Vikesh; Reid, Gillian Tungsten(vi) selenide tetrachloride, WSeCl4 – synthesis, properties, coordination complexes and application of [WSeCl4(SenBu2)] for CVD growth of WSe2 thin films Dalton Transactions, 2022 |
7709294 | CIF | C29 H42 Cl3 Ga N2 Si | P n m a | 15.7276; 21.0688; 9.4846 90; 90; 90 | 3142.8 | Helling, Christoph; Ganesamoorthy, Chelladurai; Wölper, Christoph; Schulz, Stephan Geminal C-Cl and Si-Cl bond activation of chloromethanes and chlorosilanes by gallanediyl LGa. Dalton transactions (Cambridge, England : 2003), 2022, 51, 2050-2058 |
7709291 | CIF | C30 H42 Cl3 Ga N2 | P n m a | 14.7721; 21.3648; 9.6684 90; 90; 90 | 3051.4 | Helling, Christoph; Ganesamoorthy, Chelladurai; Wölper, Christoph; Schulz, Stephan Geminal C-Cl and Si-Cl bond activation of chloromethanes and chlorosilanes by gallanediyl LGa. Dalton transactions (Cambridge, England : 2003), 2022, 51, 2050-2058 |
7709277 | CIF | C22 H42 K N2 O6 P S2 | P n m a | 17.2868; 13.3235; 13.0097 90; 90; 90 | 2996.4 | Zhao, Minggang; Xue, Tingting; He, Ru-Ru; Ma, Jianping; Zheng, Wenjun Ion-bearing stairs: alkali metal complexes of 1,2-diaza-4-phospholides. Dalton transactions (Cambridge, England : 2003), 2022, 51, 1634-1645 |
7709276 | CIF | C22 H42 K N2 O6 P Se2 | P n m a | 17.1551; 13.4665; 13.0108 90; 90; 90 | 3005.7 | Zhao, Minggang; Xue, Tingting; He, Ru-Ru; Ma, Jianping; Zheng, Wenjun Ion-bearing stairs: alkali metal complexes of 1,2-diaza-4-phospholides. Dalton transactions (Cambridge, England : 2003), 2022, 51, 1634-1645 |
7709114 | CIF | C44 H45 Cl4 N7 O0.5 Pd2 | P n m a | 13.2066; 23.2676; 14.0442 90; 90; 90 | 4315.58 | Yamashita, Yutaro; Tashiro, Shohei; Ishii, Yoshiki; Uchihashi, Takayuki; Matsushita, Nobuyuki; Kubota, Ryou; Shionoya, Mitsuhiko Shape-selective one-step synthesis of branched gold nanoparticles on the crystal surface of redox-active Pd<sup>II</sup>-macrocycles. Dalton transactions (Cambridge, England : 2003), 2022, 51, 1318-1324 |
7708810 | CIF | C33 H50 F11 Fe2 N3 P2 S2 | P n m a | 20.6464; 12.2863; 18.6507 90; 90; 90 | 4731.1 | Xu, Sunlin; Yang, Dawei; Zhao, Jinfeng; Wang, Baomin; Qu, Jingping Formation of thiolate-bridged diiron complexes featuring anionic isocyanide originated from the activation of counterions in the outer sphere Dalton Transactions, 2021 |
7708799 | CIF | C9 H2 Ag N5 O3 | P n m a | 6.17; 10.8301; 16.8422 90; 90; 90 | 1125.42 | Nimax, Patrick; Rotthowe, Nils; Zoller, Florian; Blockhaus, Tobias; Wagner, Friedrich Ernst; Fattakhova-Rohlfing, Dina; Sünkel, Karlheinz Coordination polymers of 5-substituted 1,2,3,4-tetracyanocyclopentadienides: structural and electrochemical properties of complex compounds of 5-amino- and 5-nitro-tetracyanocyclopentadienide Dalton Transactions, 2021 |
7708790 | CIF | C13 H32 B12 Br2 S2 | P n m a | 13.4739; 14.791; 11.65 90; 90; 90 | 2321.76 | Zhong, Minling; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei Diboration of Alkenes and Alkynes with a Carborane-Fused Four-Membered Boracycle Bearing an Electron-Precise B-B Bond Dalton Transactions, 2021 |
7708353 | CIF | C43 H63 Co Mg N2 P2 | P n m a | 16.8079; 20.4351; 11.637 90; 90; 90 | 3996.97 | Kelly, John A.; Gramüller, Johannes; Gschwind, Ruth M.; Wolf, Robert Low-oxidation state cobalt‒magnesium complexes: ion-pairing and reactivity Dalton Transactions, 2021 |
7708331 | CIF | C32 H24 Cu3 I5 N4 S2 | P n m a | 15.4744; 13.3303; 17.5587 90; 90; 90 | 3622 | Li, Meng-Hua; You, Ming-Hua; Lin, Mei-Jin Encapsulating third donors into D‒A hybrid heterostructures to form three-component charge-transfer complexes for enhanced electrical properties Dalton Transactions, 2021 |
7708330 | CIF | C36 H26 Cu3 I5 N4 S2 | P n m a | 15.4877; 13.3252; 18.3914 90; 90; 90 | 3795.6 | Li, Meng-Hua; You, Ming-Hua; Lin, Mei-Jin Encapsulating third donors into D‒A hybrid heterostructures to form three-component charge-transfer complexes for enhanced electrical properties Dalton Transactions, 2021 |
7708031 | CIF | Ba3 Se5 Si | P n m a | 12.436; 9.889; 8.9564 90; 90; 90 | 1101.5 | Cheng, Huanhuan; Tudi, Abudukadi; Wang, Peng; Zhang, Kewang; Yang, Zhihua; Pan, Shilie Design and synthesis of Ba<sub>3</sub>SiSe<sub>5</sub> with suitable birefringence modulated via M<sup>IV</sup> atoms in the Ba-M<sup>IV</sup>-Q (M<sup>IV</sup> = Si, Ge; Q = S, Se) system. Dalton transactions (Cambridge, England : 2003), 2021, 50, 11999-12005 |
7707923 | CIF | C3 H3 I N3 O3 Rb | P n m a | 7.4445; 8.2726; 13.7915 90; 90; 90 | 849.35 | Wang, Jinhui; Zhang, Xinyuan; Liang, Fei; Hu, Zhanggui; Wu, Yicheng Co-crystal AX·(H<sub>3</sub>C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>) (A = Na, Rb, Cs; X = Br, I): a series of strongly anisotropic alkali halide cyanurates with a planar structural motif and large birefringence. Dalton transactions (Cambridge, England : 2003), 2021, 50, 11555-11561 |
7707760 | CIF | C11 H20 B9 Co | P n m a | 13.1174; 7.5074; 15.2749 90; 90; 90 | 1504.2 | Chan, Tek Long; Lu, Zhenpin; Xie, Zuowei Synthesis and structure of metallacarboranes bearing carborane-fused cyclopentenyl and dicarbollyl-fused cyclopentene ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 10615-10620 |
7707391 | CIF | C50 H56 B Dy F18 O6.5 | P n m a | 19.0304; 24.9486; 22.2887 90; 90; 90 | 10582.3 | Long, Jérôme; Tolpygin, Aleksei O.; Lyubov, Dmitry M.; Rad'kova, Natalia Yu; Cherkasov, Anton V.; Nelyubina, Yulia V.; Guari, Yannick; Larionova, Joulia; Trifonov, Alexander A. High magnetization reversal barriers in luminescent dysprosium octahedral and pentagonal bipyramidal single-molecule magnets based on fluorinated alkoxide ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 8487-8496 |
7707302 | CIF | C40 H49 Al Fe N2 O4 | P n m a | 21.9278; 16.6105; 10.6008 90; 90; 90 | 3861.1 | Kong, Richard Y.; Crimmin, Mark R. 1<sup>st</sup> row transition metal aluminylene complexes: preparation, properties and bonding analysis. Dalton transactions (Cambridge, England : 2003), 2021, 50, 7810-7817 |
7706765 | CIF | C5 H12 Cl3 Mo O S2 | P n m a | 12.261; 12.7705; 7.6085 90; 90; 90 | 1191.33 | Smith, Danielle E.; Levason, William; Powell, James; Reid, Gillian Synthesis, properties and structural features of molybdenum(v) oxide trichloride complexes with neutral chalcogenoether ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 4380-4389 |
7706763 | CIF | C5 H12 Cl3 Mo O S2 | P n m a | 12.2795; 12.7576; 7.6118 90; 90; 90 | 1192.44 | Smith, Danielle E.; Levason, William; Powell, James; Reid, Gillian Synthesis, properties and structural features of molybdenum(v) oxide trichloride complexes with neutral chalcogenoether ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 4380-4389 |
7706647 | CIF | C3 H11 B8 Cl | P n m a | 13.042; 9.8661; 7.3139 90; 90; 90 | 941.11 | Bakardjiev, Mario; Holub, Josef; R°užičková, Zdeňka; R°užička, Aleš; Fanfrlík, Jindřich; Štíbr, Bohumil; McKee, Michael L.; Hnyk, Drahomír Transformation of various multicenter bondings within bicapped-square antiprismatic motifs: <i>Z</i>-rearrangement. Dalton transactions (Cambridge, England : 2003), 2021, 50, 12098-12106 |
7706597 | CIF | C2 Cl N2 O2 P | P n m a | 7.2241; 12.227; 6.3593 90; 90; 90 | 561.7 | Hu, Dandan; Lu, Bo; Song, Chao; Zhu, Bifeng; Wang, Lina; Bernhardt, Eduard; Zeng, Xiaoqing Synthesis and characterization of phosphorous(III) diisocyanate and triisocyanate. Dalton transactions (Cambridge, England : 2003), 2021, 50, 3299-3307 |
7706596 | CIF | C3 N3 O3 P | P n m a | 7.2574; 11.2605; 7.153 90; 90; 90 | 584.56 | Hu, Dandan; Lu, Bo; Song, Chao; Zhu, Bifeng; Wang, Lina; Bernhardt, Eduard; Zeng, Xiaoqing Synthesis and characterization of phosphorous(III) diisocyanate and triisocyanate. Dalton transactions (Cambridge, England : 2003), 2021, 50, 3299-3307 |
7706118 | CIF | C29 H42 B F4 N2 P | P n m a | 18.554; 19.0734; 8.1713 90; 90; 90 | 2891.72 | Cicač-Hudi, Mario; Feil, Christoph M.; Birchall, Nicholas; Nieger, Martin; Gudat, Dietrich Proton transfer vs. oligophosphine formation by P-C/P-H σ-bond metathesis: decoding the competing Brønsted and Lewis type reactivities of imidazolio-phosphines. Dalton transactions (Cambridge, England : 2003), 2020, 49, 17401-17413 |
7705811 | CIF | C72 H49 Br4 N15 P2 Pt | P n m a | 12.8291; 30.0209; 17.6145 90; 90; 90 | 6784.1 | Kuzniak-Glanowska, Emilia; Glosz, Dorota; Niedzielski, Grzegorz; Kobylarczyk, Jedrzej; Srebro-Hooper, Monika; Hooper, James G. M.; Podgajny, Robert Binding of anionic Pt(ii) complexes in a dedicated organic matrix: towards new binary crystalline composites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 170-185 |
7705810 | CIF | C72 H49 Cl4 N15 P2 Pt | P n m a | 12.7351; 29.6484; 17.6754 90; 90; 90 | 6673.8 | Kuzniak-Glanowska, Emilia; Glosz, Dorota; Niedzielski, Grzegorz; Kobylarczyk, Jedrzej; Srebro-Hooper, Monika; Hooper, James G. M.; Podgajny, Robert Binding of anionic Pt(ii) complexes in a dedicated organic matrix: towards new binary crystalline composites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 170-185 |
7705801 | CIF | C6 H6 F7 N9 Ti Zn3 | P n m a | 17.5556; 10.091; 9.9786 90; 90; 90 | 1767.7 | Albino, M.; Lhoste, J.; Body, M.; Legein, C.; Hémon-Ribaud, A; Maisonneuve, V.; Leblanc, M. Topotactic desolvation and condensation reactions of 3D Zn<sub>3</sub>TiF<sub>7</sub>(H<sub>2</sub>O)<sub>2</sub>(taz)<sub>3</sub>·S (S = 3H<sub>2</sub>O or C<sub>2</sub>H<sub>5</sub>OH). Dalton transactions (Cambridge, England : 2003), 2020, 49, 17758-17771 |
7705800 | CIF | C8 H16 F7 N9 O3 Ti Zn3 | P n m a | 17.02; 10.292; 11.213 90; 90; 90 | 1964 | Albino, M.; Lhoste, J.; Body, M.; Legein, C.; Hémon-Ribaud, A; Maisonneuve, V.; Leblanc, M. Topotactic desolvation and condensation reactions of 3D Zn<sub>3</sub>TiF<sub>7</sub>(H<sub>2</sub>O)<sub>2</sub>(taz)<sub>3</sub>·S (S = 3H<sub>2</sub>O or C<sub>2</sub>H<sub>5</sub>OH). Dalton transactions (Cambridge, England : 2003), 2020, 49, 17758-17771 |
7705799 | CIF | C6 H10 F7 N9 O2 Ti Zn3 | P n m a | 17.3542; 9.9387; 11.2606 90; 90; 90 | 1942.21 | Albino, M.; Lhoste, J.; Body, M.; Legein, C.; Hémon-Ribaud, A; Maisonneuve, V.; Leblanc, M. Topotactic desolvation and condensation reactions of 3D Zn<sub>3</sub>TiF<sub>7</sub>(H<sub>2</sub>O)<sub>2</sub>(taz)<sub>3</sub>·S (S = 3H<sub>2</sub>O or C<sub>2</sub>H<sub>5</sub>OH). Dalton transactions (Cambridge, England : 2003), 2020, 49, 17758-17771 |
7705730 | CIF | C15 H18 Bi2 I9 N3 | P n m a | 14.6088; 23.6348; 9.9053 90; 90; 90 | 3420.1 | Möbs, Jakob; Gerhard, Marina; Heine, Johanna (HPy)<sub>2</sub>(Py)CuBi<sub>3</sub>I<sub>12</sub>, a low bandgap metal halide photoconductor. Dalton transactions (Cambridge, England : 2003), 2020, 49, 14397-14400 |
7705727 | CIF | C20 H24 Bi2 I14 N4 | P n m a | 18.3316; 32.7986; 8.1963 90; 90; 90 | 4928 | Möbs, Jakob; Gerhard, Marina; Heine, Johanna (HPy)<sub>2</sub>(Py)CuBi<sub>3</sub>I<sub>12</sub>, a low bandgap metal halide photoconductor. Dalton transactions (Cambridge, England : 2003), 2020, 49, 14397-14400 |
7705658 | CIF | C29 H42 Cl2 N2 Pt S | P n m a | 16.2539; 17.7182; 10.1694 90; 90; 90 | 2928.68 | Maliszewski, Benon P.; Tzouras, Nikolaos V.; Guillet, Sébastien G; Saab, Marina; Beliš, Marek; Van Hecke, Kristof; Nahra, Fady; Nolan, Steven P. A general protocol for the synthesis of Pt-NHC (NHC = N-heterocyclic carbene) hydrosilylation catalysts. Dalton transactions (Cambridge, England : 2003), 2020, 49, 14673-14679 |
7705600 | CIF | C16 H18 Cl8 N14 Zn2 | P n m a | 8.787; 16.25; 41.341 90; 90; 90 | 5903 | Parisi, Emmanuele; Capasso, Domenica; Capobianco, Amedeo; Peluso, Andrea; Di Gaetano, Sonia; Fusco, Sandra; Manfredi, Carla; Mozzillo, Rosaria; Pinto, Gabriella; Centore, Roberto Tautomeric and conformational switching in a new versatile N-rich heterocyclic ligand. Dalton transactions (Cambridge, England : 2003), 2020, 49, 14452-14462 |
7705591 | CIF | C34 H30 Ag Cl3 F0 N8 Ni O S | P n m a | 28.136; 17.1992; 7.4871 90; 90; 90 | 3623.1 | Bernd, Marco A.; Bauer, Elisabeth B.; Oberkofler, Jens; Bauer, Andreas; Reich, Robert M.; Kühn, Fritz E Macrocyclic NHC complexes of group 10 elements with enlarged aromaticity for biological studies. Dalton transactions (Cambridge, England : 2003), 2020, 49, 14106-14114 |
7705418 | CIF | C Ba I N O | P n m a | 8.54524; 4.74622; 11.60133 90; 90; 90 | 470.522 | Siai, Amira; Hämmerle, Luzian; Ströbele, Markus; Enseling, David; Jüstel, Thomas; Meyer, Hans-Jürgen Structure, polymorphism and luminescence of cyanate iodides MI(OCN) (M = Ba, Eu, and Sr). Dalton transactions (Cambridge, England : 2003), 2020, 49, 14133-14139 |
7705172 | CIF | B4 Ca2 F2 I0 Li6 O10 | P n m a | 25.685; 3.4697; 5.4404 90; 90; 90 | 484.84 | Ding, Mengmeng; Xu, JingJing; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng Li<sub>3</sub>CaB<sub>2</sub>O<sub>5</sub>F: a unique sandwich-like structure with diverse and wide Li ion diffusion pathways. Dalton transactions (Cambridge, England : 2003), 2020, 49, 12184-12188 |
7705125 | CIF | C24 H26.42 N2 O2.21 | P n m a | 11.2609; 6.7138; 25.8248 90; 90; 90 | 1952.44 | Houlihan, Joanna C. C.; Moratti, Stephen C.; Hanton, Lyall R. Formation of a robust, double-walled LiMOF from an L-shaped di-substituted N-heterocyclic adamantane-based ligand. Dalton transactions (Cambridge, England : 2003), 2020, 49, 12009-12017 |
7705013 | CIF | C32 H40.5 F3 N0.5 O2 P0.5 Pt0.5 S2 | P n m a | 27.474; 29.3018; 10.854 90; 90; 90 | 8737.9 | Mews, N. M.; Reimann, M.; Hörner, G; Kaupp, M.; Schubert, H.; Berkefeld, A. A four-parameter system for rationalising the electronic properties of transition metal-radical ligand complexes. Dalton transactions (Cambridge, England : 2003), 2020, 49, 9735-9742 |
7704857 | CIF | C50 H43 Mo2 N5 O16 | P n m a | 24.2727; 35.951; 7.6427 90; 90; 90 | 6669.2 | Xia, Zhinan; Li, Fengyan; Xu, Lin; Feng, Pingyun A stable and highly selective metalloporphyrin based framework for the catalytic oxidation of cyclohexene. Dalton transactions (Cambridge, England : 2003), 2020, 49, 11157-11162 |
7704687 | CIF | C28 H46 Cl N4 Os P2 | P n m a | 12.6673; 13.6362; 17.3873 90; 90; 90 | 3003.38 | Ramler, Jacqueline; Radacki, Krzysztof; Abbenseth, Josh; Lichtenberg, Crispin Combined experimental and theoretical studies towards mutual osmium-bismuth donor/acceptor bonding. Dalton transactions (Cambridge, England : 2003), 2020, 49, 9024-9034 |
7704679 | CIF | C48 H52 Fe P4 Si | P n m a | 18.4493; 21.2072; 10.7787 90; 90; 90 | 4217.25 | Chang, Guoliang; Zhang, Peng; Yang, Wenjing; Xie, Shangqing; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter Pyridine N-oxide promoted hydrosilylation of carbonyl compounds catalyzed by [PSiP]-pincer iron hydrides. Dalton transactions (Cambridge, England : 2003), 2020, 49, 9349-9354 |
7704618 | CIF | C14 H28.07 Br0.27 Cl1.69 Cu2 N6 O6.93 | P n m a | 11.1587; 22.0003; 17.5957 90; 90; 90 | 4319.7 | Lopera, Alberto; Gil-Martínez, Ariadna; Pitarch-Jarque, Javier; Verdejo, Begoña; Blasco, Salvador; Clares, M. Paz; Jiménez, Hermas R; García-España, Enrique Influence of the chain length and metal : ligand ratio on the self-organization processes of Cu<sup>2+</sup> complexes of [1 + 1] 1H-pyrazole azamacrocycles. Dalton transactions (Cambridge, England : 2003), 2020, 49, 8614-8624 |
7704272 | CIF | C25 H34 Br F6 N2 Ni O P | P n m a | 19.2163; 12.0734; 12.3104 90; 90; 90 | 2856.09 | Shvydkiy, Nikita V.; Dlin, Egor A.; Ivanov, Klimentiy V.; Buyanovskaya, Anastasiya G.; Nelyubina, Yulia V.; Perekalin, Dmitry S. Synthesis and reactivity of cyclobutadiene nickel bromide. Dalton transactions (Cambridge, England : 2003), 2020, 49, 6801-6806 |
7703959 | CIF | B4 Eu2.001 O12 Sr3.001 | P n m a | 7.29913; 15.8333; 8.64504 90; 90; 90 | 999.1 | Li, Gui-Hua; Yang, Nian; Guo, Jian-Gang; Wang, Zheng-Liang; Cai, Ge-Mei; Wang, Xiao-Jun Efficient and stable Sr<sub>3</sub>Eu<sub>2</sub>B<sub>4</sub>O<sub>12</sub> red phosphor benefiting from low symmetry and distorted local environment. Dalton transactions (Cambridge, England : 2003), 2020, 49, 3260-3271 |
7703954 | CIF | C36.73 H43.09 Cl0.64 Co2 I1.36 N6.36 O8 | P n m a | 16.073; 16.52; 16.853 90; 90; 90 | 4474.91 | Anjana, S. S.; Varghese, B.; Murthy, Narasimha N. Coligand modulated oxidative O-demethylation of a methyl ether appended tetradentate N-ligand in Co(ii) complexes. Dalton transactions (Cambridge, England : 2003), 2020, 49, 3187-3197 |
7703859 | CIF | C48 H71 Br2 Co Li N2 O4 | P n m a | 21.7144; 21.179; 10.5333 90; 90; 90 | 4844.2 | Huang, Li-Cheng; Zhang, Jing-Shun; Jia, Teng; Mu, Ying; Gao, Wei Bis(imino)aryl NCN pincer cobalt complexes: synthesis and disproportionation. Dalton transactions (Cambridge, England : 2003), 2020, 49, 5219-5227 |
7703718 | CIF | C88 H76 B Dy N10 | P n m a | 18.2568; 14.37; 26.52 90; 90; 90 | 6957.5 | Long, Jérôme; Selikhov, Alexander N.; Mamontova, Ekaterina; Lyssenko, Konstantin A.; Guari, Yannick; Larionova, Joulia; Trifonov, Alexander A. Single-molecule magnet behavior in luminescent carbazolyl Dy(iii) octahedral complexes with a quasi linear N<sup>-</sup>-Dy-N<sup>-</sup> angle. Dalton transactions (Cambridge, England : 2003), 2020, 49, 4039-4043 |
7703597 | CIF | C26 H30 N2 O2 Pt Se | P n m a | 35.3302; 6.842; 10.3388 90; 90; 90 | 2499.19 | Petrenko, Alla; Leitonas, Karolis; Volyniuk, Dmytro; Baryshnikov, Gleb V.; Belyakov, Sergey; Minaev, Boris F.; Ågren, Hans; Durgaryan, Hranush; GraŽulevičius, Juozas Vidas; Arsenyan, Pavel Benzoselenophenylpyridine platinum complexes: green versus red phosphorescence towards hybrid OLEDs. Dalton transactions (Cambridge, England : 2003), 2020, 49, 3393-3397 |
7703504 | CIF | C44 H52 Co N6 O6 | P n m a | 17.4039; 28.4415; 8.1734 90; 90; 90 | 4045.8 | Ju, Huiyeong; Tenma, Honoka; Iwase, Miki; Lee, Eunji; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi Inclusion of alkyl nitriles by tetra-armed cyclens with styrylmethyl groups. Dalton transactions (Cambridge, England : 2003), 2020, 49, 3112-3119 |
7703407 | CIF | C27 H38 Ti | P n m a | 9.181; 11.4645; 20.7463 90; 90; 90 | 2183.66 | Fischer, Malte; Vincent-Heldt, Lisa; Hillje, Malena; Schmidtmann, Marc; Beckhaus, Ruediger Synthesis of a titanium ethylene complex via C-H-activation and alternative access to Cp<sub>2</sub>Ti(η<sup>2</sup>-Me<sub>3</sub>SiC<sub>2</sub>SiMe<sub>3</sub>). Dalton transactions (Cambridge, England : 2003), 2020, 49, 2068-2072 |
7703366 | CIF | Ge2 O14 Rb2 U3 | P n m a | 10.288; 7.6612; 16.1444 90; 90; 90 | 1272.48 | Li, Haijian; Kegler, Philip; Alekseev, Evgeny V. Crystal growth of novel 3D skeleton uranyl germanium complexes: influence of synthetic conditions on crystal structures. Dalton transactions (Cambridge, England : 2003), 2020, 49, 2244-2257 |
7703362 | CIF | Cs2 Ge2 O14 U3 | P n m a | 10.60811; 7.66072; 16.1437 90; 90; 90 | 1311.93 | Li, Haijian; Kegler, Philip; Alekseev, Evgeny V. Crystal growth of novel 3D skeleton uranyl germanium complexes: influence of synthetic conditions on crystal structures. Dalton transactions (Cambridge, England : 2003), 2020, 49, 2244-2257 |
7703296 | CIF | C20 H48 Cl8 N4 Pb2 | P n m a | 22.4936; 23.8631; 6.1802 90; 90; 90 | 3317.3 | Chai, Siqian; Xiong, Jianbo; Zheng, Yongshen; Shi, Rongchao; Xu, Jialiang Dielectric phase transition of an A<sub>2</sub>BX<sub>4</sub>-type perovskite with a pentahedral to octahedral transformation. Dalton transactions (Cambridge, England : 2003), 2020, 49, 2218-2224 |
7703294 | CIF | C10 H24 Br4 N2 Pb | P n m a | 12.15; 24.9; 6.2 90; 90; 90 | 1876 | Chai, Siqian; Xiong, Jianbo; Zheng, Yongshen; Shi, Rongchao; Xu, Jialiang Dielectric phase transition of an A<sub>2</sub>BX<sub>4</sub>-type perovskite with a pentahedral to octahedral transformation. Dalton transactions (Cambridge, England : 2003), 2020, 49, 2218-2224 |
7703263 | CIF | C10 H15 F2 Sb | P n m a | 10.212; 13.0608; 8.1901 90; 90; 90 | 1092.37 | Coughlin, Omar; Krämer, Tobias; Benjamin, Sophie L. Diverse structure and reactivity of pentamethylcyclopentadienyl antimony(iii) cations. Dalton transactions (Cambridge, England : 2003), 2020, 49, 1726-1730 |
7703229 | CIF | C37 H55 N4 Re Si | P n m a | 17.4379; 19.7759; 10.2741 90; 90; 90 | 3543 | Lohrey, Trevor D.; Bergman, Robert G.; Arnold, John Controlling dinitrogen functionalization at rhenium through alkali metal ion pairing. Dalton transactions (Cambridge, England : 2003), 2019, 48, 17936-17944 |
7702904 | CIF | C12 H16 Cu9 N24 O27 S2 | P n m a | 10.4983; 30.2025; 16.589 90; 90; 90 | 5260 | Sun, Wu-Juan; Li, Lei-Lei; Liu, Xiang-Yu; Liu, Shuang; Ke, Cong-Yu; Zhang, Qun-Zheng; Zhang, Xun-Li A 3D Cu(ii) tetrazolate coordination polymer based on pentanuclear units with a large coercive field. Dalton transactions (Cambridge, England : 2003), 2020, 49, 651-658 |
7702902 | CIF | C14 H27 I3 N O4 S2 Sc | P n m a | 15.29; 11.9434; 14.4913 90; 90; 90 | 2646.3 | Champion, Martin J. D.; Farina, Paolo; Levason, William; Reid, Gillian Trivalent scandium, yttrium and lanthanide complexes with thia-oxa and selena-oxa macrocycles and crown ether coordination. Dalton transactions (Cambridge, England : 2003), 2013, 42, 13179-13189 |
7702899 | CIF | C16 H30 I3 Lu N2 O4 Se2 | P n m a | 15.436; 11.954; 14.804 90; 90; 90 | 2731.7 | Champion, Martin J. D.; Farina, Paolo; Levason, William; Reid, Gillian Trivalent scandium, yttrium and lanthanide complexes with thia-oxa and selena-oxa macrocycles and crown ether coordination. Dalton transactions (Cambridge, England : 2003), 2013, 42, 13179-13189 |
7702897 | CIF | C14 H28 I3 Lu N2 O6 | P n m a | 18.946; 11.146; 11.901 90; 90; 90 | 2513.2 | Champion, Martin J. D.; Farina, Paolo; Levason, William; Reid, Gillian Trivalent scandium, yttrium and lanthanide complexes with thia-oxa and selena-oxa macrocycles and crown ether coordination. Dalton transactions (Cambridge, England : 2003), 2013, 42, 13179-13189 |
7702892 | CIF | C12 H23 I3 La N O5 | P n m a | 21.695; 12.454; 7.9 90; 90; 90 | 2134.5 | Champion, Martin J. D.; Farina, Paolo; Levason, William; Reid, Gillian Trivalent scandium, yttrium and lanthanide complexes with thia-oxa and selena-oxa macrocycles and crown ether coordination. Dalton transactions (Cambridge, England : 2003), 2013, 42, 13179-13189 |
7702886 | CIF | C29 H41 Cl2 Fe N9 O2 | P n m a | 14.3222; 12.9169; 17.1494 90; 90; 90 | 3172.61 | Morin, Tyler J.; Wanniarachchi, Sarath; Gwengo, Chengeto; Makura, Vitales; Tatlock, Heidi M.; Lindeman, Sergey V.; Bennett, Brian; Long, Gary J.; Grandjean, Fernande; Gardinier, James R. Pyrazolyl methyls prescribe the electronic properties of iron(II) tetra(pyrazolyl)lutidine chloride complexes. Dalton transactions (Cambridge, England : 2003), 2011, 40, 8024-8034 |
7702876 | CIF | C14 H30 Mo2 N6 O12 | P n m a | 15.1155; 12.4471; 12.4209 90; 90; 90 | 2336.9 | Lysenko, Andrey B.; Senchyk, Ganna A.; Lincke, Jörg; Lässig, Daniel; Fokin, Andrey A.; Butova, Ekaterina D.; Schreiner, Peter R.; Krautscheid, Harald; Domasevitch, Konstantin V. Metal oxide-organic frameworks (MOOFs), a new series of coordination hybrids constructed from molybdenum(VI) oxide and bitopic 1,2,4-triazole linkers. Dalton transactions (Cambridge, England : 2003), 2010, 39, 4223-4231 |
7702853 | CIF | C26 H36 Al I2 N2 | P n m a | 12.564; 21.284; 10.412 90; 90; 90 | 2784.3 | Baker, Robert J.; Farley, Robert D.; Jones, Cameron; Kloth, Marc; Murphy, Damien M. The reactivity of diazabutadienes toward low oxidation state Group 13 iodides and the synthesis of a new gallium(i) carbene analogue Journal of the Chemical Society, Dalton Transactions, 2002, 3844 |
7702840 | CIF | C21 H45 Cl3 P3 Re | P n m a | 14.409; 15.947; 11.737 90; 90; 90 | 2696.9 | Baker, Robert J.; Edwards, Peter G.; Gracia-Mora, Jes??s; Ingold, Florent; Abdul Malik, K. M. Manganese and rhenium triphosphorus macrocycle complexes and reactions with alkenes Journal of the Chemical Society, Dalton Transactions, 2002, 3985 |
7702669 | CIF | C21 H30 N4 O4 Zn | P n m a | 11.96; 12.15; 15.71 90; 90; 90 | 2282.9 | Liu, Hong-Ke; Hu, Jun; Wang, Tian-Wei; Yu, Xiao-Lan; Liu, Jun; Kang, Beisheng Synthesis and crystal structures of silver(i), palladium(ii), zinc(ii) and cobalt(ii) complexes of the ditoptic ligand 1,3-bis(imidazol-1-ylmethyl)-2,4,6-trimethylbenzene Journal of the Chemical Society, Dalton Transactions, 2001, 3534 |
7702509 | CIF | C13 H20 Ag N5 O3 | P n m a | 20.121; 6.491; 11.417 90; 90; 90 | 1491.1 | Zheng, Shao-Liang; Tong, Ming-Liang; Yu, Xiao-Lan; Chen, Xiao-Ming Syntheses and structures of six chain-, ladder- and grid-like co-ordination polymers constructed from μ-hexamethylenetetramine and silver salts Journal of the Chemical Society, Dalton Transactions, 2001, 586 |
7702428 | CIF | C22 H53 Li N6 Si3 | P n m a | 28.389; 11.343; 10.29 90; 90; 90 | 3313.5 | Boesveld, W. Marco; Hitchcock, Peter B.; Lappert, Michael F. Reactions of 1,3,5-triazine with organolithium compounds containing trimethylsilyl substituents; X-ray structures of 1,3,5-triaza- and 1,3,5,7-tetraaza-heptatrienyllithium compounds † Journal of the Chemical Society, Dalton Transactions, 1999, 4041 |
7702150 | CIF | C30 H54 Fe N12 O9 Tb3 | P n m a | 16.359; 18.917; 14.106 90; 90; 90 | 4365.3 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702147 | CIF | C30 H56 Co Ho3 N12 O10 | P n m a | 24.606; 12.873; 16.083 90; 90; 90 | 5094.3 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702146 | CIF | C30 H54 Fe Gd3 N12 O9 | P n m a | 16.401; 18.919; 14.122 90; 90; 90 | 4381.9 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702145 | CIF | C30 H54 Dy3 Fe N12 O9 | P n m a | 16.325; 18.887; 14.075 90; 90; 90 | 4339.7 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702144 | CIF | C30 H56 Co N12 O10 Y3 | P n m a | 24.568; 12.893; 16.127 90; 90; 90 | 5108 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702143 | CIF | C30 H54 Er3 Fe N12 O9 | P n m a | 16.239; 18.833; 14.043 90; 90; 90 | 4294.8 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702142 | CIF | C30 H56 Co Er3 N12 O10 | P n m a | 24.591; 12.863; 16.091 90; 90; 90 | 5090 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702141 | CIF | C30 H54 Fe Ho3 N12 O9 | P n m a | 16.276; 18.779; 14.043 90; 90; 90 | 4292.2 | Escobedo-Cruz, Francisco V; Hughbanks, Timothy New coordination networks containing trinuclear lanthanide complexes and hexacyanometallates. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6831-6841 |
7702108 | CIF | Br6 I P | P n m a | 9.3739; 7.5698; 15.028 90; 90; 90 | 1066.4 | Hausmann, David; Köppe, Ralf; Wolf, Silke; Roesky, Peter W.; Feldmann, Claus Ionic-liquid-assisted synthesis of the phosphorus interhalides [PBr<sub>4</sub>][IBr<sub>2</sub>] and [PBr<sub>4</sub>][I<sub>5</sub>Br<sub>7</sub>]. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16526-16532 |
7702105 | CIF | C12 H18 Cl4 Nb S2 | P n m a | 19.407; 12.502; 7.084 90; 90; 90 | 1718.8 | Chang, Yao-Pang; Levason, William; Light, Mark E.; Reid, Gillian Niobium tetrachloride complexes with thio-, seleno- and telluro-ether coordination - synthesis and structures. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16262-16274 |
7702008 | CIF | C35.5 H42 Cl3 N8 O18.5 Zn2 | P n m a | 24.2049; 24.8897; 14.9855 90; 90; 90 | 9028.1 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
7701979 | CIF | C34 H50 N7 O40 P W11 Zn | P n m a | 29.6331; 17.9626; 12.3339 90; 90; 90 | 6565.2 | Li, Li; Zou, Yong-Cun; Hua, Yang; Li, Xiao-Nan; Wang, Zhi-Hui; Zhang, Hong Polyoxometalate-viologen photochromic hybrids for rapid solar ultraviolet light detection, photoluminescence-based UV probing and inkless and erasable printing. Dalton transactions (Cambridge, England : 2003), 2020, 49, 89-94 |
7701853 | CIF | C25 H57 Mo18 N8 O59 Sb3 | P n m a | 17.6129; 20.4536; 20.3947 90; 90; 90 | 7347.1 | yu, fang; Xu, Li Highly efficient MoIV3•••SbIII cluster frustrated Lewis pair hydrogenation Dalton Transactions, 2019 |
7701472 | CIF | C51 H45 Cl3 N3 O2 P2 Ru | P n m a | 19.4234; 14.5749; 16.5414 90; 90; 90 | 4682.8 | Maji, Milan; Kundu, Sabuj Cooperative Ruthenium Complex Catalyzed Multicomponent Synthesis of Pyrimidines Dalton Transactions, 2019 |
7701364 | CIF | C66 H70 Cl5 Mn N8 O10 | P n m a | 23.6584; 26.203; 10.5621 90; 90; 90 | 6547.7 | Lippi, Martina; Cametti, Massimo; Marti-Rujas, Javier Ab Initio Powder X-Ray Diffraction Structural Analysis of Bispidine Based 1D Coordination Polymer: Insight into their Guest Responsive Behaviour. Dalton Transactions, 2019 |
7701363 | CIF | C65 H61 Cl5 Mn N9 O12 | P n m a | 23.669; 26.279; 10.8841 90; 90; 90 | 6769.9 | Lippi, Martina; Cametti, Massimo; Marti-Rujas, Javier Ab Initio Powder X-Ray Diffraction Structural Analysis of Bispidine Based 1D Coordination Polymer: Insight into their Guest Responsive Behaviour. Dalton Transactions, 2019 |
7701110 | CIF | C3 H15 Bi2 Cl9 N6 | P n m a | 21.48; 7.668; 13.332 90; 90; 90 | 2196 | Mencel, K.; Starynowicz, P.; Siczek, M.; Piecha-Bisiorek, A; Jakubas, R.; Medycki, W. Symmetry breaking structural phase transitions, dielectric properties and molecular motions of formamidinium cations in 1D and 2D hybrid compounds: (NH<sub>2</sub>CHNH<sub>2</sub>)<sub>3</sub>[Bi<sub>2</sub>Cl<sub>9</sub>] and (NH<sub>2</sub>CHNH<sub>2</sub>)<sub>3</sub>[Bi<sub>2</sub>Br<sub>9</sub>]. Dalton transactions (Cambridge, England : 2003), 2019, 48, 14829-14838 |
7701009 | CIF | C16 H17 Cl F3 N3 O2 Pt S | P n m a | 11.5812; 6.8946; 23.2291 90; 90; 90 | 1854.79 | Puttock, Emma V.; Fradgley, Jack D.; Yufit, Dmitry S.; Williams, J. A. Gareth A family of readily synthesised phosphorescent platinum(ii) complexes based on tridentate N^N^O-coordinating Schiff-base ligands. Dalton transactions (Cambridge, England : 2003), 2019, 48, 15012-15028 |
7700983 | CIF | C14 H31 B2 Co F8 N5 | P n m a | 14.388; 8.818; 16.9008 90; 90; 90 | 2144.26 | Puthiyaveetil Yoosaf, Mohammed Ajmal; Ghosh, Somnath; Narayan, Yatheesh; Yadav, Munendra; Sahoo, Subash Chandra; Kumar, Pankaj Finding a new pathway for acid-induced nitrite reduction reaction: formation of nitric oxide with hydrogen peroxide. Dalton transactions (Cambridge, England : 2003), 2019, 48, 13916-13920 |
7700839 | CIF | C26 H16 Fe2 O8 S2 | P n m a | 12.3381; 19.4322; 10.9337 90; 90; 90 | 2621.4 | Zhong, Wei; Wu, Li; Jiang, Weidong; Li, Yulong; Mookan, Natarajan; Liu, Xiaoming Proton-coupled electron transfer in the reduction of diiron hexacarbonyl complexes and its enhancement on the electrocatalytic reduction of protons by a pendant basic group. Dalton transactions (Cambridge, England : 2003), 2019, 48, 13711-13718 |
7700826 | CIF | C38 H60 Mn2 N20 | P n m a | 10.89; 17.0382; 13.0657 90; 90; 90 | 2424.3 | Mączka, Mirosław; Gągor, Anna; Ptak, Maciej; Stefańska, Dagmara; Macalik, Lucyna; Pikul, Adam; Sieradzki, Adam Structural, phonon, magnetic and optical properties of novel perovskite-like frameworks of TriBuMe[M(dca)<sub>3</sub>] (TriBuMe = tributylmethylammonium; dca = dicyanamide; M = Mn<sup>2+</sup>, Fe<sup>2+</sup>, Co<sup>2+</sup>, Ni<sup>2+</sup>). Dalton transactions (Cambridge, England : 2003), 2019, 48, 13006-13016 |
7700684 | CIF | Al Ba3 Cl Se4 | P n m a | 12.6532; 9.8696; 8.7452 90; 90; 90 | 1092.1 | Tudi, Abudukadi; Han, Shujuan; Abudurusuli, Ailijiang; Yu, Haohai; Yang, Zhihua; Pan, Shilie Structural modulation induced by M<sup>IIIA</sup> metals in Ba<sub>3</sub>MQ<sub>4</sub>X (M = Al, Ga, In; Q = S, Se; X = Cl, Br): an experimental and computational analysis. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12713-12719 |
7700683 | CIF | Al Ba3 Cl S4 | P n m a | 12.2257; 9.5329; 8.4343 90; 90; 90 | 982.99 | Tudi, Abudukadi; Han, Shujuan; Abudurusuli, Ailijiang; Yu, Haohai; Yang, Zhihua; Pan, Shilie Structural modulation induced by M<sup>IIIA</sup> metals in Ba<sub>3</sub>MQ<sub>4</sub>X (M = Al, Ga, In; Q = S, Se; X = Cl, Br): an experimental and computational analysis. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12713-12719 |
7700682 | CIF | Al Ba3 Br Se4 | P n m a | 12.574; 9.858; 8.827 90; 90; 90 | 1094.1 | Tudi, Abudukadi; Han, Shujuan; Abudurusuli, Ailijiang; Yu, Haohai; Yang, Zhihua; Pan, Shilie Structural modulation induced by M<sup>IIIA</sup> metals in Ba<sub>3</sub>MQ<sub>4</sub>X (M = Al, Ga, In; Q = S, Se; X = Cl, Br): an experimental and computational analysis. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12713-12719 |
7700681 | CIF | Al Ba3 Br S4 | P n m a | 12.3743; 9.5728; 8.4609 90; 90; 90 | 1002.3 | Tudi, Abudukadi; Han, Shujuan; Abudurusuli, Ailijiang; Yu, Haohai; Yang, Zhihua; Pan, Shilie Structural modulation induced by M<sup>IIIA</sup> metals in Ba<sub>3</sub>MQ<sub>4</sub>X (M = Al, Ga, In; Q = S, Se; X = Cl, Br): an experimental and computational analysis. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12713-12719 |
7700387 | CIF | Cu N6 | P n m a | 13.486; 3.0841; 9.0857 90; 90; 90 | 377.89 | Shi, Taqing; Xu, Ye; Zou, Ya-Jing; Wang, Zhao-Xi Synthesis, structure and magnetic properties of copper(ii) azide. Dalton transactions (Cambridge, England : 2003), 2019, 48, 11186-11190 |
7700354 | CIF | C6 H18 Br4 Mn S2 | P n m a | 12.571; 8.88; 16.034 90; 90; 90 | 1789.9 | Chen, Xiao-Gang; Zhang, Yao-Zu; Sun, Dong-Sheng; Gao, Ji-Xing; Hua, Xiu-Ni; Liao, Wei-Qiang Above room-temperature dielectric and nonlinear optical switching materials based on [(CH<sub>3</sub>)<sub>3</sub>S]<sub>2</sub>[MBr<sub>4</sub>] (M = Cd, Mn and Zn). Dalton transactions (Cambridge, England : 2003), 2019, 48, 11292-11297 |
7700353 | CIF | C12 H24 Br8 Cd2 S4 | P n m a | 12.547; 8.969; 16.063 90; 90; 90 | 1807.6 | Chen, Xiao-Gang; Zhang, Yao-Zu; Sun, Dong-Sheng; Gao, Ji-Xing; Hua, Xiu-Ni; Liao, Wei-Qiang Above room-temperature dielectric and nonlinear optical switching materials based on [(CH<sub>3</sub>)<sub>3</sub>S]<sub>2</sub>[MBr<sub>4</sub>] (M = Cd, Mn and Zn). Dalton transactions (Cambridge, England : 2003), 2019, 48, 11292-11297 |
7700344 | CIF | C6 H18 B3 F12 N7 O2 Ru | P n m a | 24.6469; 8.6875; 9.7514 90; 90; 90 | 2088 | Roveda, Jr, Antonio C; Santos, Willy G.; Souza, Maykon L.; Adelson, Charles N.; Gonçalves, Felipe S; Castellano, Eduardo E.; Garino, Claudio; Franco, Douglas W.; Cardoso, Daniel R. Light-activated generation of nitric oxide (NO) and sulfite anion radicals (SO<sub>3</sub>˙<sup>-</sup>) from a ruthenium(ii) nitrosylsulphito complex. Dalton transactions (Cambridge, England : 2003), 2019, 48, 10812-10823 |
7700284 | CIF | C19 H31 Co Er O9 P3 | P n m a | 20.9027; 11.9632; 22.3054 90; 90; 90 | 5577.76 | Meng, Yin-Shan; Yang, Mu-Wen; Xu, Ling; Xiong, Jin; Hu, Ji-Yun; Liu, Tao; Wang, Bing-Wu; Gao, Song Design principle of half-sandwich type erbium single-ion magnets through crystal field engineering: a combined magnetic and electronic structure study. Dalton transactions (Cambridge, England : 2003), 2019, 48, 10407-10411 |
7700111 | CIF | C10.5 H12.5 Cl0.5 F3 N P0.5 Rh0.5 | P n m a | 13.882; 12.3599; 13.397 90; 90; 90 | 2298.7 | Lionetti, Davide; Day, Victor W.; Blakemore, James D. Structural and chemical properties of half-sandwich rhodium complexes supported by the bis(2-pyridyl)methane ligand. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12396-12406 |
7700110 | CIF | C92 H112 F48 N12 P8 Rh4 | P n m a | 16.7908; 15.7747; 10.9869 90; 90; 90 | 2910.1 | Lionetti, Davide; Day, Victor W.; Blakemore, James D. Structural and chemical properties of half-sandwich rhodium complexes supported by the bis(2-pyridyl)methane ligand. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12396-12406 |
7700081 | CIF | C6 H14 Cu3 I5 N2 | P n m a | 18.748; 8.3956; 11.0005 90; 90; 90 | 1731.5 | Yue, Cheng-Yang; Lin, Na; Gao, Lu; Jin, Ying-Xue; Liu, Zhao-Yang; Cao, Yao-Yao; Han, Sha-Sha; Lian, Xi-Kai; Hu, Bing; Lei, Xiao-Wu Organic cation directed one-dimensional cuprous halide compounds: syntheses, crystal structures and photoluminescence properties. Dalton transactions (Cambridge, England : 2003), 2019, 48, 10151-10159 |
7700079 | CIF | C6 H14 Br5 Cu3 N2 | P n m a | 17.951; 7.9123; 10.4907 90; 90; 90 | 1490 | Yue, Cheng-Yang; Lin, Na; Gao, Lu; Jin, Ying-Xue; Liu, Zhao-Yang; Cao, Yao-Yao; Han, Sha-Sha; Lian, Xi-Kai; Hu, Bing; Lei, Xiao-Wu Organic cation directed one-dimensional cuprous halide compounds: syntheses, crystal structures and photoluminescence properties. Dalton transactions (Cambridge, England : 2003), 2019, 48, 10151-10159 |
7700078 | CIF | C7 H10 Cu2 I3 N | P n m a | 16.9103; 6.3543; 12.5868 90; 90; 90 | 1352.49 | Yue, Cheng-Yang; Lin, Na; Gao, Lu; Jin, Ying-Xue; Liu, Zhao-Yang; Cao, Yao-Yao; Han, Sha-Sha; Lian, Xi-Kai; Hu, Bing; Lei, Xiao-Wu Organic cation directed one-dimensional cuprous halide compounds: syntheses, crystal structures and photoluminescence properties. Dalton transactions (Cambridge, England : 2003), 2019, 48, 10151-10159 |
7248597 | CIF | C8 H20 I3 N | P n m a | 14.5312; 13.8795; 15.1632 90; 90; 90 | 3058.2 | Hamdouni, Monia; Hrizi, Chakib; Esghaier, Mohsen Ouled Mohamed; Knorr, Michael; Strohmann, Carsten; Chaabouni, Slaheddine Molecular self-assembly of 1D linear and 2D T-shape polyiodide arrangements in two organic ammonium triiodide salts: supramolecular structures and density functional theory-based optical properties CrystEngComm, 2024 |
7248595 | CIF | Cl5 K2 N O Ru | P n m a | 13.126; 10.3284; 6.8375 90; 90; 90 | 926.96 | Mikhailov, Artem A.; Gansmuller, Axel; Konieczny, Krzysztof; Pillet, Sebastien; Kostin, Gennadiy; Klüfers, Peter; Woike, Theo; Schaniel, Dominik Local force constants and charges of the nitrosyl ligand in photoinduced NO linkage isomers in a prototypical ruthenium nitrosyl complex Physical Chemistry Chemical Physics, 2024 |
7248508 | CIF | C8 H20 Ag2 Br3 P | P n m a | 21.3719; 12.2556; 17.2118 90; 90; 90 | 4508.21 | Gawraczynski, Jakub; Leszczynski, Piotr J.; Cyranski, Michal Ksawery; Dobrzycki, Łukasz; Koźmiński, Wiktor; Fijalkowski, Karol J.; Grochala, Wojciech; Jaroń, Tomasz Synthesis and structural trends in a series of simple tetraalkylphosphonium salts CrystEngComm, 2024 |
7248367 | CIF | C8 H5 Br2 N | P n m a | 13.7185; 7.2021; 8.8003 90; 90; 90 | 869.5 | Kupietz, Kamil; Gomila, Rosa M.; Roisnel, Thierry; Frontera, Antonio; Gramage-Doria, Rafael Shortening CN⋯Br–Csp3 halogen bonds via π-stacking CrystEngComm, 2024, 26, 2131-2135 |
7248204 | CIF | C22 H15 Cl2 N3 Zn | P n m a | 11.7879; 15.0748; 11.0619 90; 90; 90 | 1965.7 | Lee, Pei-Chin; Huang, Tzu-Chiao; Wu, Jing-Yun Wavelike zinc coordination polymers: anion-modulated ligand conformation and fluorescence detection of 4-aminobenzylamine CrystEngComm, 2024, 26, 1819-1828 |
7248138 | CIF | Ba2 Mn S3 | P n m a | 8.824; 4.3415; 17.1357 90; 90; 90 | 656.458 | Moore, Benjamin J.; Cui, Z. X.; Liu, Y.; Gutmann, Matthias J.; Teather, E. N.; Orlandi, Fabio; Balz, Christian; Manuel, Pascal; Perry, R. S. Crystal growth of ternary metal sulfides from an open melt: Ba2MnS3 CrystEngComm, 2024, 26, 1444-1452 |
7248137 | CIF | Ba2 Mn S3 | P n m a | 8.8896; 4.3363; 17.221 90; 90; 90 | 663.835 | Moore, Benjamin J.; Cui, Z. X.; Liu, Y.; Gutmann, Matthias J.; Teather, E. N.; Orlandi, Fabio; Balz, Christian; Manuel, Pascal; Perry, R. S. Crystal growth of ternary metal sulfides from an open melt: Ba2MnS3 CrystEngComm, 2024, 26, 1444-1452 |
7247834 | CIF | C34 H24 Cu2 N6 O17 | P n m a | 13.3687; 19.6383; 12.8093 90; 90; 90 | 3362.9 | Duan, Wen-Long; Yan, Ming-Yue; Yan, Feng; Luan, Jian Fabrication of two 5-R-isophthalic acid-modulated Cu-based coordination polymers as urease inhibitors CrystEngComm, 2024, 26, 324-333 |
7247619 | CIF | C12 H10 Ag F6 N2 Sb | P n m a | 12.102; 6.6333; 17.915 90; 90; 90 | 1438.1 | Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214 |
7247457 | CIF | C24 H29 Mn2 N10 O13 | P n m a | 22.1459; 12.0673; 12.5517 90; 90; 90 | 3354.33 | Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548 |
7247283 | CIF | C6 H2 N2 S Se2 | P n m a | 11.2833; 18.088; 4.056 90; 90; 90 | 827.8 | Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323 |
7247281 | CIF | C8 H4 N2 Se2 | P n m a | 11.563; 17.139; 4.8436 90; 90; 90 | 959.9 | Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323 |
7246930 | CIF | C112 H84 Mn4 N16 O26 | P n m a | 37.455; 36.5541; 11.0255 90; 90; 90 | 15095.4 | Yin, Jia-Ling; Yan, Qing-Qing; Liu, Yu-Xin; Yong, Guo-Ping From zero-dimensional metallomacrocycle to three-dimensional metal–organic frameworks mediated by solvent polarity: near-white light emissions and gas adsorption properties CrystEngComm, 2023, 25, 4435-4444 |
7246715 | CIF | C6 H12 Br0.96 I0.98 N2 | P n m a | 21.6028; 7.1603; 5.9684 90; 90; 90 | 923.21 | Torubaev, Yury V.; Howe, Devin; Leitus, Gregory; Rosokha, Sergiy V. The relationship between the crystal habit and the energy framework pattern: a case study involving halogen bonding on the edge of a covalent bond CrystEngComm, 2023, 25, 3380-3390 |
7246714 | CIF | C6 H12 Cl0.95 I1.05 N2 | P n m a | 21.6511; 6.9602; 5.9635 90; 90; 90 | 898.68 | Torubaev, Yury V.; Howe, Devin; Leitus, Gregory; Rosokha, Sergiy V. The relationship between the crystal habit and the energy framework pattern: a case study involving halogen bonding on the edge of a covalent bond CrystEngComm, 2023, 25, 3380-3390 |
7246579 | CIF | C18 H15.5 Cu N2 O4.25 | P n m a | 9.1259; 13.4355; 14.5446 90; 90; 90 | 1783.3 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Novikova, Veronika A.; Knyazev, Daniil A.; Gogoleva, Natalia V.; Blinou, Daniil O.; Efimov, Nikolay N.; Dorovatovskii, Pavel V.; Kiskin, Mikhail A.; Eremenko, Igor L.; Vologzhanina, Anna V. Design and synthesis of copper(ii) malonates with N,N′-containing linkers CrystEngComm, 2023, 25, 2859-2870 |
7246422 | CIF | Cu Eu Gd Te3 | P n m a | 11.3761; 4.3405; 14.3469 90; 90; 90 | 708.42 | Ruseikina, Anna V.; Grigoriev, Maxim V.; Garmonov, Alexander A.; Molokeev, Maxim S.; Schleid, Thomas; Safin, Damir A. Synthesis, structures and magnetic properties of the Eu-based quaternary tellurides EuGdCuTe3 and EuLuCuTe3 CrystEngComm, 2023, 25, 1716-1722 |
7246300 | CIF | Cs3 Cu2 I5 | P n m a | 10.1743; 11.6532; 14.3621 90; 90; 90 | 1702.82 | Jiang, Zhi; Liu, Hezhuang; Zou, Jihua; Huang, Yixuan; Xu, Zhaoquan; Pustovyi, Denys; Vitusevich, Svetlana Scale-up synthesis of high-quality solid-state-processed CsCuX (X = Cl, Br, I) perovskite nanocrystal materials toward near-ultraviolet flexible electronic properties RSC Advances, 2023, 13, 5993-6001 |
7246299 | CIF | Br5 Cs3 Cu2 | P n m a | 9.524; 10.979; 13.648 90; 90; 90 | 1427.09 | Jiang, Zhi; Liu, Hezhuang; Zou, Jihua; Huang, Yixuan; Xu, Zhaoquan; Pustovyi, Denys; Vitusevich, Svetlana Scale-up synthesis of high-quality solid-state-processed CsCuX (X = Cl, Br, I) perovskite nanocrystal materials toward near-ultraviolet flexible electronic properties RSC Advances, 2023, 13, 5993-6001 |
7246298 | CIF | Cl5 Cs3 Cu2 | P n m a | 9.176; 10.505; 13.141 90; 90; 90 | 1266.71 | Jiang, Zhi; Liu, Hezhuang; Zou, Jihua; Huang, Yixuan; Xu, Zhaoquan; Pustovyi, Denys; Vitusevich, Svetlana Scale-up synthesis of high-quality solid-state-processed CsCuX (X = Cl, Br, I) perovskite nanocrystal materials toward near-ultraviolet flexible electronic properties RSC Advances, 2023, 13, 5993-6001 |
7246272 | CIF | C19 H38 Cl N O11 | P n m a | 15.673; 10.8757; 14.278 90; 90; 90 | 2433.8 | Wei, Wen-Juan; Gao, Hong-Qiang; Fang, Ming; Tang, Yun-Zhi; Wei, Yen Revealing the order–disorder type phase transition mechanism in two new supramolecular clathrates CrystEngComm, 2023, 25, 1333-1338 |
7246101 | CIF | C16 H10 Br2 O | P n m a | 6.3129; 30.172; 7.2937 90; 90; 90 | 1389.25 | Dyk, Konrad; Kinzhybalo, Vasyl; Czernel, Grzegorz; Grudziński, Wojciech; Horak, Yuriy; Butenko, Serhii; Kamiński, Daniel M. Solvent induced conformational polymorphism CrystEngComm, 2023, 25, 971-980 |
7246029 | CIF | C7 H10 N2 O4 S | P n m a | 12.6737; 10.861; 6.7004 90; 90; 90 | 922.3 | Yu, Zihong; You, Xiuli; Du, Wenqing; Peng, Ziqin; Guo, Wenjing; Wei, Zhenhong The mechanism of two reversible phase transitions and dielectric anomalies in a single-component organic molecule 1-sulfo-4-dimethylamino-pyridinium CrystEngComm, 2023, 25, 822-827 |
7246028 | CIF | C7 H10 N2 O4 S | P n m a | 12.6831; 10.8758; 6.7333 90; 90; 90 | 928.78 | Yu, Zihong; You, Xiuli; Du, Wenqing; Peng, Ziqin; Guo, Wenjing; Wei, Zhenhong The mechanism of two reversible phase transitions and dielectric anomalies in a single-component organic molecule 1-sulfo-4-dimethylamino-pyridinium CrystEngComm, 2023, 25, 822-827 |
7245812 | CIF | La3 Ni3 Si2 | P n m a | 7.501; 14.316; 6.1485 90; 90; 90 | 660.3 | Pani, Marcella; Provino, Alessia; Smetana, Volodymyr; Shtender, Vitalii; Bernini, Cristina; Mudring, Anja-Verena; Manfrinetti, Pietro Four ternary silicides in the La–Ni–Si system: from polyanionic layers to frameworks CrystEngComm, 2022 |
7245727 | CIF | Fe4 K6 S8 | P n m a | 7.1219; 10.9301; 11.484 90; 90; 90 | 893.95 | Ghazanfari, Mohammad R.; Santhosh, Archa; Vrijmoed, Johannes C.; Siemensmeyer, Konrad; Peters, Bertram; Dehnen, Stefanie; Jerabek, Paul; Thiele, Günther Large-scale synthesis of mixed valence K3[Fe2S4] with high dielectric and ferrimagnetic characteristics RSC Advances, 2022, 12, 30514-30521 |
7245360 | CIF | C14 H12 I N5 S | P n m a | 9.862; 6.3853; 25.0333 90; 90; 90 | 1576.39 | Peloquin, Andrew J.; McMillen, Colin; Pennington, William Isolation of unique heterocycles formed from pyridine-thiocarboxamides as diiodine, iodide, or polyiodide salts CrystEngComm, 2022 |
7245219 | CIF | C27 H20 Cu2 N3 P | P n m a | 14.3364; 19.171; 8.9148 90; 90; 90 | 2450.2 | Iwai, Yudai; Nakaya, Manabu; Ohtsu, Hiroyoshi; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki Zero area thermal expansion of honeycomb layers via double distortion relaxation in (PPh4)[Cu2(CN)3] CrystEngComm, 2022 |
7245218 | CIF | C27 H20 Cu2 N3 P | P n m a | 14.3334; 19.0929; 8.9152 90; 90; 90 | 2439.8 | Iwai, Yudai; Nakaya, Manabu; Ohtsu, Hiroyoshi; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki Zero area thermal expansion of honeycomb layers via double distortion relaxation in (PPh4)[Cu2(CN)3] CrystEngComm, 2022 |
7245217 | CIF | C27 H23 Cu2 N3 P | P n m a | 14.3204; 18.8505; 8.9253 90; 90; 90 | 2409.4 | Iwai, Yudai; Nakaya, Manabu; Ohtsu, Hiroyoshi; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki Zero area thermal expansion of honeycomb layers via double distortion relaxation in (PPh4)[Cu2(CN)3] CrystEngComm, 2022 |
7245216 | CIF | C27 H20 Cu2 N3 P | P n m a | 14.3252; 18.935; 8.9216 90; 90; 90 | 2419.96 | Iwai, Yudai; Nakaya, Manabu; Ohtsu, Hiroyoshi; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki Zero area thermal expansion of honeycomb layers via double distortion relaxation in (PPh4)[Cu2(CN)3] CrystEngComm, 2022 |
7245215 | CIF | C27 H20 Cu2 N3 P | P n m a | 14.325; 19.0152; 8.917 90; 90; 90 | 2428.93 | Iwai, Yudai; Nakaya, Manabu; Ohtsu, Hiroyoshi; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki Zero area thermal expansion of honeycomb layers via double distortion relaxation in (PPh4)[Cu2(CN)3] CrystEngComm, 2022 |
7245214 | CIF | C27 H20 Cu2 N3 P | P n m a | 14.3168; 18.7687; 8.9267 90; 90; 90 | 2398.7 | Iwai, Yudai; Nakaya, Manabu; Ohtsu, Hiroyoshi; Le Ouay, Benjamin; Ohtani, Ryo; Ohba, Masaaki Zero area thermal expansion of honeycomb layers via double distortion relaxation in (PPh4)[Cu2(CN)3] CrystEngComm, 2022 |
7245111 | CIF | C22 H23 N5 O14 | P n m a | 7.5672; 22.2189; 15.2555 90; 90; 90 | 2564.98 | Shimizu, Yuta; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Tetranitro- and Tetraamino- dibenzo[18]crown-6-ether Derivatives: Complexes for Alkali Metal Ions, Redox Potentials, Crystal Structures, Molecular Sorption, and Proton Conducting Behaviors. CrystEngComm, 2022 |
7244955 | CIF | Ag3 B6 I O10 | P n m a | 12.7726; 9.5739; 8.4899 90; 90; 90 | 1038.18 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244954 | CIF | Ag3 B6 I O10 | P n m a | 12.7566; 9.705; 8.4295 90; 90; 90 | 1043.6 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244953 | CIF | B6 I Na3 O10 | P n m a | 12.8162; 9.9063; 7.6762 90; 90; 90 | 974.58 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244952 | CIF | Ag3 B6 I O10 | P n m a | 12.7702; 9.5617; 8.5156 90; 90; 90 | 1039.8 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244951 | CIF | Ag3 B6 I O10 | P n m a | 12.7504; 9.537; 8.5317 90; 90; 90 | 1037.46 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244950 | CIF | Ag3 B6 I O10 | P n m a | 12.7477; 9.5347; 8.5287 90; 90; 90 | 1036.63 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244949 | CIF | Ag3 B6 I O10 | P n m a | 12.7428; 9.5341; 8.5326 90; 90; 90 | 1036.64 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244554 | CIF | C6 H8 Cl N3 | P n m a | 14.9547; 6.2734; 7.8292 90; 90; 90 | 734.51 | Koutsoukos, Spyridon; Philippi, Frederik; Rauber, Daniel; Pugh, David; Kay, Christopher William Michael; Welton, Tom Effect of the cation structure on the properties of homobaric imidazolium ionic liquids Physical Chemistry Chemical Physics, 2022 |
7244546 | CIF | C6 H8 Br N3 | P n m a | 15.5333; 6.3618; 7.9158 90; 90; 90 | 782.24 | Koutsoukos, Spyridon; Philippi, Frederik; Rauber, Daniel; Pugh, David; Kay, Christopher William Michael; Welton, Tom Effect of the cation structure on the properties of homobaric imidazolium ionic liquids Physical Chemistry Chemical Physics, 2022 |
7244535 | CIF | C23 H24 N6 O | P n m a | 29.8656; 7.1127; 10.0461 90; 90; 90 | 2134 | Zhou, Yang; Maisonneuve, Stéphane; Casimiro, Lorenzo; Retailleau, Pascal; Xie, Juan; Maurel, François; Métivier, Rémi Photoisomerization of a 4-dicyanomethylene-2-methyl-6-(p-dimethylaminostyryl)-4H-pyran analog dye: a combined photophysical and theoretical investigation Physical Chemistry Chemical Physics, 2022 |
7244364 | CIF | C5.08 H10.56 B0.78 N1.37 O24 Si11.22 | P n m a | 19.9892; 19.761; 13.3066 90; 90; 90 | 5256.19 | Ma, Yufang; Wang, Lei; Chen, Lei; Shen, Meikun; Yang, Xue; Wang, Tengteng; yuan, feixiang; Zhou, Yu; Wang, Jun; Zhu, Hongjun Anchoring Boron Atom to the Specific Tetrahedral Sites of Borosilicate MFI by Imidazolium-based Molecules CrystEngComm, 2022 |
7244363 | CIF | C3.97 H7.5 B0.79 N1.67 O24 Si11.21 | P n m a | 19.9106; 19.6572; 13.2495 90; 90; 90 | 5185.7 | Ma, Yufang; Wang, Lei; Chen, Lei; Shen, Meikun; Yang, Xue; Wang, Tengteng; yuan, feixiang; Zhou, Yu; Wang, Jun; Zhu, Hongjun Anchoring Boron Atom to the Specific Tetrahedral Sites of Borosilicate MFI by Imidazolium-based Molecules CrystEngComm, 2022 |
7244362 | CIF | C4.91 H9.18 B0.59 N1.11 O24 Si11.44 | P n m a | 19.9997; 19.7849; 13.3278 90; 90; 90 | 5273.7 | Ma, Yufang; Wang, Lei; Chen, Lei; Shen, Meikun; Yang, Xue; Wang, Tengteng; yuan, feixiang; Zhou, Yu; Wang, Jun; Zhu, Hongjun Anchoring Boron Atom to the Specific Tetrahedral Sites of Borosilicate MFI by Imidazolium-based Molecules CrystEngComm, 2022 |
7244361 | CIF | C7.08 H15.34 B0.09 N0.59 O24 Si11.71 | P n m a | 20.0445; 19.9204; 13.3984 90; 90; 90 | 5349.91 | Ma, Yufang; Wang, Lei; Chen, Lei; Shen, Meikun; Yang, Xue; Wang, Tengteng; yuan, feixiang; Zhou, Yu; Wang, Jun; Zhu, Hongjun Anchoring Boron Atom to the Specific Tetrahedral Sites of Borosilicate MFI by Imidazolium-based Molecules CrystEngComm, 2022 |
7244360 | CIF | C4.33 H7.72 B0.64 N1.44 O24 Si11.37 | P n m a | 19.9543; 19.7136; 13.2726 90; 90; 90 | 5221.1 | Ma, Yufang; Wang, Lei; Chen, Lei; Shen, Meikun; Yang, Xue; Wang, Tengteng; yuan, feixiang; Zhou, Yu; Wang, Jun; Zhu, Hongjun Anchoring Boron Atom to the Specific Tetrahedral Sites of Borosilicate MFI by Imidazolium-based Molecules CrystEngComm, 2022 |
7244316 | CIF | Fe Li0.94 N0.16 O3.84 P | P n m a | 10.3261; 6.0071; 4.6943 90; 90; 90 | 291.19 | Mayer, Sergio Federico; de la Calle, Cristina; Fernández-Díaz, María Teresa; Amarilla, José Manuel; Alonso, José Antonio Nitridation effect on lithium iron phosphate cathode for rechargeable batteries RSC Advances, 2022, 12, 3696-3707 |
7244293 | CIF | C11 H13 Br O6 | P n m a | 22.7597; 6.6011; 16.7307 90; 90; 90 | 2513.6 | Edkins, Katharina; Tweedy, Jane; Fung, Stephanie; Edkins, Robert M. Steric influence on solvate formation – a comparison of resorcylic acid and two brominated derivatives CrystEngComm, 2022 |
7243860 | CIF | C13 H15 B F4 Se | P n m a | 13.842; 6.786; 14.296 90; 90; 90 | 1342.85 | Sashida, Haruki; Ohyanagi, Kazuo; Minoura, Mao; Akiba, Kin-ya Studies on tellurium-containing heterocycles. Part 18. Preparation and structure of 2-benzotelluropyrylium salts and 2-benzoselenopyrylium salts Journal of the Chemical Society, Perkin Transactions 1, 2002, 606-612 |
7243859 | CIF | C13 H15 B F4 Te | P n m a | 14.263; 6.745; 14.31 90; 90; 90 | 1376.68 | Sashida, Haruki; Ohyanagi, Kazuo; Minoura, Mao; Akiba, Kin-ya Studies on tellurium-containing heterocycles. Part 18. Preparation and structure of 2-benzotelluropyrylium salts and 2-benzoselenopyrylium salts Journal of the Chemical Society, Perkin Transactions 1, 2002, 606-612 |
7243817 | CIF | C10 H23 Br N4 Ni O2 | P n m a | 15.1276; 8.9116; 11.1889 90; 90; 90 | 1508.39 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
7243691 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.8755; 13.8822; 16.5729 90; 90; 90 | 1811.9 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243690 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.8377; 13.8396; 16.4718 90; 90; 90 | 1786.71 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243689 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.8962; 13.9023; 16.6281 90; 90; 90 | 1825.36 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243688 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.9171; 13.9272; 16.6694 90; 90; 90 | 1838.02 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243687 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.9192; 13.9256; 16.7036 90; 90; 90 | 1842.07 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243686 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.9357; 13.9514; 16.7733 90; 90; 90 | 1857.04 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243685 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.9139; 13.9195; 16.6734 90; 90; 90 | 1836.7 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243684 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.8558; 13.8616; 16.5205 90; 90; 90 | 1798.98 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243683 | CIF | C10 H20 Br3 Na O5 Pb | P n m a | 7.8228; 13.8222; 16.4334 90; 90; 90 | 1776.92 | Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793 |
7243672 | CIF | C22 H28 Cd N2 O5 | P n m a | 14.727; 23.437; 5.987 90; 90; 90 | 2066.5 | Gundlapalli, Suman; Devarapalli, Ramesh; Mudda, Ramesh Reddy; Chennuru, Ramanaiah; Rupakula, Ravichandrababu Novel solid forms of insomnia drug suvorexant with improved solubility and dissolution: accessing salts from a salt solvate route CrystEngComm, 2021, 23, 7739-7749 |
7243669 | CIF | C22 H28 Cd N2 O5 | P n m a | 14.727; 23.437; 5.987 90; 90; 90 | 2066.5 | Soltani, Sajjad; Akhbari, Kamran; White, Jonathan Effect of structural features on the stability and bactericidal potential of two cadmium coordination polymers CrystEngComm, 2021, 23, 7450-7461 |
7243615 | CIF | C16 H21 N2 O6 Zn | P n m a | 18.3597; 30.8839; 11.3262 90; 90; 90 | 6422.2 | Chen, Mao-Long; Qi, Zhen-Li; Jin, Wan-Ting; Xu, Zhou; Cheng, Yun-Hui; Zhou, Zhao-Hui Cation exchange in a fluorescent zinc-based metal–organic framework for cadmium ion detection CrystEngComm, 2021, 23, 7442-7449 |
7243607 | CIF | C65 H34 Cl2 N16 Pr | P n m a | 28.1128; 22.9663; 7.8883 90; 90; 90 | 5093.1 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243605 | CIF | C65 H34 Cl2 N16 Tb | P n m a | 28.0516; 22.9642; 7.8827 90; 90; 90 | 5077.9 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243601 | CIF | C65 H34 Cl2 Er N16 | P n m a | 28.016; 22.942; 7.8678 90; 90; 90 | 5057 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243598 | CIF | C65 H34 Cl2 La N16 | P n m a | 28.0409; 22.944; 7.8783 90; 90; 90 | 5068.7 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243594 | CIF | C65 H34 Cl2 N16 Yb | P n m a | 27.955; 22.921; 7.8802 90; 90; 90 | 5049.3 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243593 | CIF | C65 H34 Cl2 Dy N16 | P n m a | 28.01; 22.923; 7.8994 90; 90; 90 | 5072 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243591 | CIF | C65 H34 Cl2 Gd N16 | P n m a | 28.356; 22.882; 8.046 90; 90; 90 | 5220.6 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243590 | CIF | C65 H34 Cl2 N16 Nd | P n m a | 28.0851; 22.9636; 7.8897 90; 90; 90 | 5088.3 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243587 | CIF | C65 H34 Cl2 N16 Sm | P n m a | 28.1354; 22.945; 7.8933 90; 90; 90 | 5095.7 | Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161 |
7243560 | CIF | C6 H14 Cl5 Cu3 N2 | P n m a | 17.3198; 7.5743; 10.1087 90; 90; 90 | 1326.11 | Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L. In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance CrystEngComm, 2021 |
7243553 | CIF | C6 H14 Cl5 Cu3 N2 | P n m a | 17.3198; 7.5743; 10.1087 90; 90; 90 | 1326.11 | Goreshnik, Evgeny Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers CrystEngComm, 2021, 23, 7171-7178 |
7243268 | CIF | C13 H13 N O5 | P n m a | 10.1584; 6.6612; 18.5993 90; 90; 90 | 1258.56 | Duan, Guiyun; Liu, Hao; Zhang, Liqing; Yuan, Chunhao; Li, Yongchao; Ge, Yanqing Access to 6-hydroxy indolizines and related imidazo[1,5-a]pyridines through the SN2 substitution/condensation/tautomerization cascade process RSC Advances, 2021, 11, 25624-25627 |
7243185 | CIF | Eu P Rb S4 | P n m a | 17.3308; 6.6787; 6.4347 90; 90; 90 | 744.8 | Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248 |
7243166 | CIF | C4 H12 Cl2 Cu O2 S2 | P n m a | 7.9376; 11.4925; 11.3612 90; 90; 90 | 1036.4 | Bernabé Vírseda, Ignacio; Siddiqui, Shiraz Ahmed; Prado-Roller, Alexander; Eisterer, Michael; Shiozawa, Hidetsugu Crystal engineering with copper and melamine RSC Advances, 2021, 11, 23943-23947 |
7242727 | CIF | C9 H11 N O2 | P n m a | 15.113; 7.205; 8.356 90; 90; 90 | 909.9 | Szklarz, Przemysław; Kinzhybalo, Vasyl; Bator, Grażyna Ferroelectricity and switching polarization on the C‒H⋯π bond in a pure organic molecular crystal ‒ 1,3,5-trimethylnitrobenzene CrystEngComm, 2021, 23, 4005-4012 |
7242722 | CIF | C16 H8 Br4 N2 O4 | P n m a | 9.4972; 14.745; 13.181 90; 90; 90 | 1845.8 | Singha, Soumen; Jana, Rajkumar; Mondal, Rituparna; Ray, Partha Pratim; Bag, Partha Pratim; Gupta, Kajal; Pakhira, Nandan; Rizzoli, Corrado; Mallick, Arabinda; Kumar, Sanjay; Saha, Rajat Photo-responsive Schottky diode behavior of a donor‒acceptor co-crystal with violet blue light emission CrystEngComm, 2021, 23, 3510-3523 |
7242579 | CIF | C13 H9 F N4 O | P n m a | 7.4264; 26.8268; 5.6645 90; 90; 90 | 1128.52 | Reason, Thomas E.; Goka, Benjamin; Krause, Jeanette A.; Fionah, Abelline K.; Zahran, Elsayed M.; Rayat, Sundeep Cu2O nanoparticle-catalyzed synthesis of diaryl tetrazolones and investigation of their solid-state properties CrystEngComm, 2021, 23, 3220-3229 |
7242288 | CIF | C24 H30 Br N4 O2 Re | P n m a | 14.2929; 17.3769; 10.1717 90; 90; 90 | 2526.31 | Schindler, Kevin; Crochet, Aurélien; Zobi, Fabio Aerobically stable and substitutionally labile α-diimine rhenium dicarbonyl complexes RSC Advances, 2021, 11, 7511-7520 |
7242287 | CIF | C21 H25 Br Cl4 N2 O2 Re | P n m a | 12.4068; 13.9121; 16.1781 90; 90; 90 | 2792.4 | Schindler, Kevin; Crochet, Aurélien; Zobi, Fabio Aerobically stable and substitutionally labile α-diimine rhenium dicarbonyl complexes RSC Advances, 2021, 11, 7511-7520 |
7242285 | CIF | C29 H42 Br N4 O2 Re | P n m a | 15.1687; 17.1375; 12.0964 90; 90; 90 | 3144.5 | Schindler, Kevin; Crochet, Aurélien; Zobi, Fabio Aerobically stable and substitutionally labile α-diimine rhenium dicarbonyl complexes RSC Advances, 2021, 11, 7511-7520 |
7242225 | CIF | C3 H9 Cl I N O | P n m a | 9.6049; 7.6367; 9.6337 90; 90; 90 | 706.629 | Zarechnaya, Olga M.; Anisimov, Aleksei A.; Belov, Eugenii Yu; Burakov, Nikolai I.; Kanibolotsky, Alexander L.; Mikhailov, Vasilii A. Polycentric binding in complexes of trimethylamine-N-oxide with dihalogens RSC Advances, 2021, 11, 6131-6145 |
7242063 | CIF | C10 H24 Br4 Mn N2 | P n m a | 13.45; 9.1134; 16.4176 90; 90; 90 | 2012.39 | Li, Yanyan; Lin, Liting; Yang, Jie; Qian, Kun; Jiang, Tao; Li, Hong Red/green-light emission in continuous dielectric phase transition materials: [Me3NVinyl]2[MnX4] (X = Cl, Br) RSC Advances, 2021, 11, 2329-2336 |
7242062 | CIF | C10 H24 Cl4 Mn N2 | P n m a | 13.1299; 8.8855; 16.1959 90; 90; 90 | 1889.5 | Li, Yanyan; Lin, Liting; Yang, Jie; Qian, Kun; Jiang, Tao; Li, Hong Red/green-light emission in continuous dielectric phase transition materials: [Me3NVinyl]2[MnX4] (X = Cl, Br) RSC Advances, 2021, 11, 2329-2336 |
7242060 | CIF | C10 H24 Cl4 Mn N2 | P n m a | 13.1016; 9.0403; 16.1804 90; 90; 90 | 1916.4 | Li, Yanyan; Lin, Liting; Yang, Jie; Qian, Kun; Jiang, Tao; Li, Hong Red/green-light emission in continuous dielectric phase transition materials: [Me3NVinyl]2[MnX4] (X = Cl, Br) RSC Advances, 2021, 11, 2329-2336 |
7241997 | CIF | C13 H38 Mg2 N2 O21 Pt S4 | P n m a | 10.4292; 15.3858; 26.9006 90; 90; 90 | 4316.51 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
7241970 | CIF | C8 H18 N6 O7 S2 | P n m a | 21.384; 8.2026; 9.6041 90; 90; 90 | 1684.6 | Abe, Haruka; Kobayashi, Takahiro; Hoshino, Norihisa; Takeda, Takashi; Suzuki, Yasutaka; Kawamata, Jun; Akutagawa, Tomoyuki Dynamic structural reconstruction of (guanidinium+)2(benzene-1,4-disulfonate2−) host crystal by guest adsorption CrystEngComm, 2021, 23, 1149-1157 |
7241923 | CIF | C62 H48 Cu N4 O11 S2 | P n m a | 18.41; 30.209; 12.589 90; 90; 90 | 7001 | Mohanty, Aurobinda; Singh, Udai P.; Ghorai, Arijit; Banerjee, Susanta; Butcher, R. J. Metal‒organic frameworks derived from a semi-rigid anthracene-based ligand and sulfonates: proton conductivity and dye degradation studies CrystEngComm, 2021, 23, 684-693 |
7241921 | CIF | C2 H8 I3 N Pb | P n m a | 8.152; 8.747; 15.148 90; 90; 90 | 1080.1 | Jung, Mi-Hee Exploration of two-dimensional perovskites incorporating methylammonium for high performance solar cells CrystEngComm, 2021, 23, 1181-1200 |
7241808 | CIF | C46 H44 Cu2 N2 O10 | P n m a | 12.159; 31.183; 12.689 90; 90; 90 | 4811.1 | Chahine, Ali Y.; Turner, David R.; Batten, Stuart R. Crystal engineering of coordination polymers using flexible tetracarboxylate linkers with embedded cyclohexyldiamine cores CrystEngComm, 2021, 23, 569-590 |
7241745 | CIF | C8 H12 Cd N2 O2 S4 | P n m a | 13.1254; 13.6595; 8.5225 90; 90; 90 | 1527.97 | Adhikari, Suman; Bhattacharjee, Tirtha; Das, Arijit; Roy, Subhadip; Daniliuc, Constantin Gabriel; Zaręba, Jan K.; Bauzá, Antonio; Frontera, Antonio On the supramolecular properties of neutral, anionic and cationic cadmium complexes harvested from dithiolate‒polyamine binary ligand systems CrystEngComm, 2020, 22, 8023-8035 |
7241648 | CIF | C45 H24 Cl N2 O3 Re | P n m a | 7.2328; 19.384; 25.55 90; 90; 90 | 3582.1 | Qiu, Li-Qi; Chen, Kai-Hong; Yang, Zhi-Wen; He, Liang-Nian A rhenium catalyst with bifunctional pyrene groups boosts natural light-driven CO2 reduction Green Chemistry, 2020, 22, 8614-8622 |
7241565 | CIF | C10 H12 F3 I4 N | P n m a | 21.6106; 7.3407; 11.3729 90; 90; 90 | 1804.2 | Peloquin, Andrew J.; Kobra, Khadijatul; McMillen, Colin D.; Iacono, Scott T.; Pennington, William T. Isolation of hydrazine oxidation products via halogen bonding: C‒I bond scission and crystal polymorphism CrystEngComm, 2021, 23, 419-426 |
7241453 | CIF | C3.61 H1.55 O2.06 S0.26 Zn0.39 | P n m a | 16.9329; 16.7397; 24.8806 90; 90; 90 | 7052.45 | Tu, Qian-Qian; Ren, Ling-Ling; Cheng, Ai-Ling; Gao, En-Qing Fabrication of a dual-emitting RhB@Zn-1 composite as a recyclable luminescent sensor for sensitive detection of nitrofuran antibiotics CrystEngComm, 2021, 23, 629-637 |
7241409 | CIF | C16 H20 N2 O2 | P n m a | 12.863; 7.173; 16.464 90; 90; 90 | 1519.1 | Zhou, Hui; Chen, Wei; Liu, Ji-Hong; Zhang, Wen-Zhen; Lu, Xiao-Bing Highly effective capture and subsequent catalytic transformation of low-concentration CO2 by superbasic guanidines Green Chemistry, 2020, 22, 7832-7838 |
7241134 | CIF | C12 H17 Cl2 F3 Fe N5 O5 S | P n m a | 27.529; 10.302; 7.0168 90; 90; 90 | 1989.99 | Mekhail, Magy A.; Pota, Kristof; Schwartz, Timothy M.; Green, Kayla N. Functionalized pyridine in pyclen-based iron(iii) complexes: evaluation of fundamental properties RSC Advances, 2020, 10, 31165-31170 |
7241114 | CIF | C6 H10 Cs4 N6 O4 S6 | P n m a | 21.961; 11.928; 8.903 90; 90; 90 | 2332.1 | Zhao, Jianmin; Liu, Hongkun; Zhang, Xiaodong; Zhang, Bingbing; Wang, Ying Facile synthesis of a cesium trithiocyanurate with high ionic conductivity and large birefringence properties CrystEngComm, 2020 |
7241101 | CIF | C12 H18 N4 O8 | P n m a | 16.8076; 6.312; 13.8556 90; 90; 90 | 1469.9 | Alvarez-Lorenzo, Carmen; Castineiras, Alfonso; Frontera, Antonio; Garcia-Santos, Isabel; González-Pérez, Josefa Maria; Niclos-Gutierrez, Juan; Rodríguez-González, Iria; Vilchez, Esther; Zaręba, Jan Kazimierz Recurrent motifs in pharmaceutical cocrystals involving Glycolic acid: X-ray characterization, Hirshfeld surface analysis and DFT calculations CrystEngComm, 2020 |
7241020 | CIF | C13 H8 N2 O S4 | P n m a | 6.6912; 20.226; 10.1274 90; 90; 90 | 1370.6 | Bechu, Damien; Petre, Alexandru Mihai; Hosseini, Mir Wais; Baudron, Stéphane Heterometallic coordination polymers based on homo- and heteroleptic Au(III) dithiolene complexes CrystEngComm, 2020 |
7240967 | CIF | C13 H13 N O5 S2 Sr | P n m a | 7.3261; 22.72; 9.936 90; 90; 90 | 1653.8 | Yao, Jun; Liu, Yan-E; Yang, Li-Bo; Dou, Ai-Na; Hou, Cheng-Fu; Xu, Quan-Qing; Huang, Bo; Zhu, Ai-Xin Novel alkaline earth metal-organic frameworks with thiophene group for selective detection of Fe3+ CrystEngComm, 2020 |
7240810 | CIF | C13 H7 F8 N | P n m a | 13.1069; 6.8506; 13.7875 90; 90; 90 | 1237.98 | Cui, Luxia; Ono, Toshikazu; Hossain, Md. Jakir; Hisaeda, Yoshio Electrochemically driven, cobalt‒carbon bond-mediated direct intramolecular cyclic and acyclic perfluoroalkylation of (hetero)arenes using X(CF2)4X RSC Advances, 2020, 10, 24862-24866 |
7240665 | CIF | K2 O21 S3 U2 | P n m a | 11.465; 12.605; 12.944 90; 90; 90 | 1870.6 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Gurzhiy, Vladislav V.; Krivovichev, Sergey V. Dimensional Evolution in Hydrated K±bearing Uranyl Sulfates: From 2D-sheet to 3D-framework CrystEngComm, 2020 |
7240620 | CIF | C12 H11 Br N2 | P n m a | 23.547; 12.0475; 8.0311 90; 90; 90 | 2278.28 | Gugin, Nikita; Presypkina, Eugenia V.; Virovets, Alexander Viktorovich; Davydova, Elena I.; Timoshkin, Alexey Y. Structural Variety of Aluminium and Gallium Coordination Polymers Based on Bis-pyridylethylene: From Molecular Complexes to Ionic Networks CrystEngComm, 2020 |
7240559 | CIF | C H13 Mn N2 O6 P3 | P n m a | 9.4005; 13.299; 8.6191 90; 90; 90 | 1077.54 | Mączka, Mirosław; Gągor, Anna; Pikul, Adam; Stefańska, Dagmara Novel hypophosphite hybrid perovskites of [CH3NH2NH2][Mn(H2POO)3] and [CH3NH2NH2][Mn(H2POO)2.83(HCOO)0.17] exhibiting antiferromagnetic order and red photoluminescence RSC Advances, 2020, 10, 19020-19026 |
7240558 | CIF | C H13 Mn N2 O6 P3 | P n m a | 9.2009; 13.2604; 8.5408 90; 90; 90 | 1042.04 | Mączka, Mirosław; Gągor, Anna; Pikul, Adam; Stefańska, Dagmara Novel hypophosphite hybrid perovskites of [CH3NH2NH2][Mn(H2POO)3] and [CH3NH2NH2][Mn(H2POO)2.83(HCOO)0.17] exhibiting antiferromagnetic order and red photoluminescence RSC Advances, 2020, 10, 19020-19026 |
7240557 | CIF | C1.17 H12.84 Mn N2 O6 P2.83 | P n m a | 9.3938; 13.3012; 8.5716 90; 90; 90 | 1071.01 | Mączka, Mirosław; Gągor, Anna; Pikul, Adam; Stefańska, Dagmara Novel hypophosphite hybrid perovskites of [CH3NH2NH2][Mn(H2POO)3] and [CH3NH2NH2][Mn(H2POO)2.83(HCOO)0.17] exhibiting antiferromagnetic order and red photoluminescence RSC Advances, 2020, 10, 19020-19026 |
7240229 | CIF | C28 H35 N P2 | P n m a | 14.242; 10.3185; 16.3776 90; 90; 90 | 2406.8 | Liang, Wenbin; Nakajima, Kazunari; Nishibayashi, Yoshiaki Synthesis of 1,2,4-azadiphosphole derivatives based on vanadium-catalyzed [2+2+1] cycloaddition reactions of azobenzenes with phosphaalkynes RSC Advances, 2020, 10, 12730-12733 |
7240162 | CIF | B2 H11 Mg N | P n m a | 11.29376; 7.62235; 6.81817 90; 90; 90 | 586.942 | Yan, Yigang; Dononelli, Wilke; Jørgensen, Mathias; Grinderslev, Jakob B.; Lee, Young-Su; Cho, Young Whan; Černý, Radovan; Hammer, Bjørk; Jensen, Torben R. The mechanism of Mg<sup>2+</sup> conduction in ammine magnesium borohydride promoted by a neutral molecule. Physical chemistry chemical physics : PCCP, 2020, 22, 9204-9209 |
7239851 | CIF | C12 H12 Co N10 Na O | P n m a | 18.42; 10.567; 8.8377 90; 90; 90 | 1720.2 | Shi, Chao; Gong, Zhi-Xin; Wang, Qin-Wen; Han, Xiang-Bin; Zhang, Wen Role of the B′-site metal ion in the framework structures and dielectric transitions in host‒guest type cyanometalates (HIm)2[B′Co(CN)6] (HIm = imidazolium cation) CrystEngComm, 2020, 22, 1848-1852 |
7239794 | CIF | C10 H14 Br2 | P n m a | 14.9792; 9.7677; 7.2734 90; 90; 90 | 1064.19 | Négrier, Philippe; Ben Hassine, Bacem; Barrio, Maria; Romanini, Michela; MONDIEIG, DENISE; Tamarit, Josep Lluis Polymorphism of 1,3-X-adamantanes (X=Br, OH, CH3) and the crystal plastic phase formation ability CrystEngComm, 2020 |
7239521 | CIF | C H0 I3 N Pb | P n m a | 8.8362; 12.5804; 8.5551 90; 90; 90 | 951 | Baikie, Tom; Fang, Yanan; Kadro, Jeannette M.; Schreyer, Martin; Wei, Fengxia; Mhaisalkar, Subodh G.; Graetzel, Michael; White, Tim J. Synthesis and crystal chemistry of the hybrid perovskite (CH3NH3)PbI3 for solid-state sensitised solar cell applications Journal of Materials Chemistry A, 2013, 1, 5628 |
7239462 | CIF | C4 Br Cl N2 S2 | P n m a | 8.1226; 6.7318; 13.5987 90; 90; 90 | 743.57 | Kalogirou, Andreas S.; Christoforou, Irene C.; Ioannidou, Heraklidia A.; Manos, Manolis J.; Koutentis, Panayiotis A. Ring transformation of (4-chloro-5H-1,2,3-dithiazol-5-ylidene)acetonitriles to 3-haloisothiazole-5-carbonitriles RSC Adv., 2014, 4, 7735 |
7239452 | CIF | C18 H15 Au Cl P | P n m a | 24.7714; 17.0229; 7.5234 90; 90; 90 | 3172.5 | Moussa, J.; Chamoreau, L. M.; Amouri, H. Gold(i) complexes with a phosphinine ligand: synthesis and structural characterization RSC Advances, 2014, 4, 11539 |
7239217 | CIF | C16 H17 N4 P | P n m a | 11.3573; 12.6287; 10.6515 90; 90; 90 | 1527.72 | Maaliki, Carine; Canac, Yves; Lepetit, Christine; Duhayon, Carine; Chauvin, Remi P-oxidation of gem-dicationic phosphines RSC Advances, 2013, 3, 20391 |
7239137 | CIF | C17 H29 Br2 N7 Pd | P n m a | 8.1484; 18.284; 15.475 90; 90; 90 | 2305.5 | Chen, Qian; Lv, Lanlan; Yu, Meng; Shi, Yanhui; Li, Yuling; Pang, Guangsheng; Cao, Changsheng Simple, efficient and reusable Pd‒NHC catalysts for hydroamination RSC Advances, 2013, 3, 18359 |
7238929 | CIF | C11 H22 Cl7 Mo N2 O3 | P n m a | 18.729; 14.865; 7.6628 90; 90; 90 | 2133.4 | Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano Lactam/MoCl5 interaction in CH2Cl2: synthesis and X-ray characterization of protonated δ-valerolactam salts RSC Advances, 2013, 3, 10007 |
7238893 | CIF | C37 H35 Cl2 N9 O5 | P n m a | 16.0317; 22.181; 10.2433 90; 90; 90 | 3642.5 | Das, Subrata; Thakur, Ashim Jyoti; Medhi, Tapas; Das, Babulal An efficient stereo-controlled synthesis of bis-pyrimido-[4,5-d]-pyrimidine derivatives via aza-Diels‒Alder methodology and their preliminary bioactivity RSC Advances, 2013, 3, 3407 |
7238851 | CIF | C14 H14 B2 Cu2 F8 N4 O8 | P n m a | 15.6203; 11.564; 14.8705 90; 90; 90 | 2686.1 | Abrahams, Brendan F.; Maynard-Casely, Helen E.; Robson, Richard; White, Keith F. Copper(ii) coordination polymers of imdc− (H2imdc+ = the 1,3-bis(carboxymethyl)imidazolium cation): unusual sheet interpenetration and an unexpected single crystal-to-single crystal transformation CrystEngComm, 2013, 15, 9729 |
7238850 | CIF | C17 H28 B2 Cu2 F8 N4 O12 | P n m a | 16.6263; 12.7971; 14.4678 90; 90; 90 | 3078.29 | Abrahams, Brendan F.; Maynard-Casely, Helen E.; Robson, Richard; White, Keith F. Copper(ii) coordination polymers of imdc− (H2imdc+ = the 1,3-bis(carboxymethyl)imidazolium cation): unusual sheet interpenetration and an unexpected single crystal-to-single crystal transformation CrystEngComm, 2013, 15, 9729 |
7238772 | CIF | C34 H31 Co Fe O P2 S2 | P n m a | 16.0226; 21.7926; 8.8475 90; 90; 90 | 3089.3 | Gao, Hui; Huang, Jing; Chen, Limin; Liu, Ruliang; Chen, Jinzhu Synthesis, characterization and computational study of heterobimetallic CoFe complexes for mimicking hydrogenase RSC Advances, 2013, 3, 3557 |
7238749 | CIF | C27 H26 Ca O16 Zn2 | P n m a | 7.35853; 23.5965; 18.7029 90; 90; 90 | 3247.49 | Bo, Qi-Bing; Wang, Hong-Yan; Miao, Jin-Ling; Wang, Da-Qi Fluorescent Zn-based hetero-MOFs design via single metal site substitution RSC Advances, 2012, 2, 11650 |
7238748 | CIF | C27 H26 Cd O16 Zn2 | P n m a | 7.30775; 23.3444; 18.8151 90; 90; 90 | 3209.76 | Bo, Qi-Bing; Wang, Hong-Yan; Miao, Jin-Ling; Wang, Da-Qi Fluorescent Zn-based hetero-MOFs design via single metal site substitution RSC Advances, 2012, 2, 11650 |
7237874 | CIF | C12 H9 N S | P n m a | 7.8739; 20.921; 5.8718 90; 90; 90 | 967.26 | de Sa Pereira, Daniel; Lee, Dong Ryun; Kukhta, Nadzeya A.; Lee, Kyung Hyung; Kim, Cho Long; Batsanov, Andrei S.; Lee, Jun Yeob; Monkman, Andrew P. The effect of a heavy atom on the radiative pathways of an emitter with dual conformation, thermally-activated delayed fluorescence and room temperature phosphorescence Journal of Materials Chemistry C, 2019, 7, 10481 |
7237871 | CIF | C12 H9 N S | P n m a | 7.9; 20.937; 5.8824 90; 90; 90 | 972.96 | de Sa Pereira, Daniel; Lee, Dong Ryun; Kukhta, Nadzeya A.; Lee, Kyung Hyung; Kim, Cho Long; Batsanov, Andrei S.; Lee, Jun Yeob; Monkman, Andrew P. The effect of a heavy atom on the radiative pathways of an emitter with dual conformation, thermally-activated delayed fluorescence and room temperature phosphorescence Journal of Materials Chemistry C, 2019, 7, 10481 |
7237743 | CIF | C32 H20 N4 S2 | P n m a | 8.1825; 27.5249; 12.8511 90; 90; 90 | 2894.36 | Chen, Cheng; Lu, Hai-Yan; Wang, Yin-Feng; Li, Meng; Shen, Yi-Fan; Chen, Chuan-Feng Naphthyridine-based thermally activated delayed fluorescence emitters for multi-color organic light-emitting diodes with low efficiency roll-off Journal of Materials Chemistry C, 2019, 7, 4673 |
7237640 | CIF | K N5 | P n m a | 7.835; 6.304; 7.332 90; 90; 90 | 362.1 | Xu, Yuangang; Tian, Lili; Li, Dongxue; Wang, Pengcheng; Lu, Ming A series of energetic cyclo-pentazolate salts: rapid synthesis, characterization, and promising performance Journal of Materials Chemistry A, 2019, 7, 12468 |
7237617 | CIF | C14 H17 B F2 N2 | P n m a | 11.3643; 7.1999; 16.0342 90; 90; 90 | 1311.95 | Duan, Chong; Zhou, Yibin; Shan, Guo-Gang; Chen, Yuncong; Zhao, Weijun; Yuan, Dandan; Zeng, Lintao; Huang, Xiaobo; Niu, Guangle Bright solid-state red-emissive BODIPYs: facile synthesis and their high-contrast mechanochromic properties Journal of Materials Chemistry C, 2019, 7, 3471 |
7237283 | CIF | C13 H18 N4 O7 | P n m a | 18.2587; 6.7913; 12.8788 90; 90; 90 | 1596.98 | Tao, Kewen; Wu, Zhenyue; Han, Shiguo; Zhang, Jing; Ji, Chengmin; Wang, Yuyin; Zhang, Weichuan; Luo, Junhua; Sun, Zhihua Switchable behaviors of quadratic nonlinear optical properties originating from bi-step phase transitions in a molecule-based crystal Journal of Materials Chemistry C, 2018, 6, 4150 |
7237239 | CIF | C18 H24 Bi2 I9 N3 | P n m a | 15.5976; 23.0812; 11.0806 90; 90; 90 | 3989.1 | Usoltsev, Andrey N.; Elshobaki, Moneim; Adonin, Sergey A.; Frolova, Lyubov A.; Derzhavskaya, Tatiyana; Abramov, Pavel A.; Anokhin, Denis V.; Korolkov, Ilya V.; Luchkin, Sergey Yu.; Dremova, Nadezhda N.; Stevenson, Keith J.; Sokolov, Maxim N.; Fedin, Vladimir P.; Troshin, Pavel A. Polymeric iodobismuthates {[Bi3I10]} and {[BiI4]} with N-heterocyclic cations: promising perovskite-like photoactive materials for electronic devices Journal of Materials Chemistry A, 2019, 7, 5957 |
7237237 | CIF | C23 H33 Bi2 I9 N4 | P n m a | 16.4361; 22.9617; 11.2234 90; 90; 90 | 4235.7 | Usoltsev, Andrey N.; Elshobaki, Moneim; Adonin, Sergey A.; Frolova, Lyubov A.; Derzhavskaya, Tatiyana; Abramov, Pavel A.; Anokhin, Denis V.; Korolkov, Ilya V.; Luchkin, Sergey Yu.; Dremova, Nadezhda N.; Stevenson, Keith J.; Sokolov, Maxim N.; Fedin, Vladimir P.; Troshin, Pavel A. Polymeric iodobismuthates {[Bi3I10]} and {[BiI4]} with N-heterocyclic cations: promising perovskite-like photoactive materials for electronic devices Journal of Materials Chemistry A, 2019, 7, 5957 |
7237208 | CIF | C12 H22 Cu5 I7 N4 | P n m a | 13.2656; 21.421; 10.3192 90; 90; 90 | 2932.3 | Wang, Kangcai; Chinnam, Ajay Kumar; Petrutik, Natan; Komarala, Eswaravara Prasadarao; Zhang, Qinghua; Yan, Qi-Long; Dobrovetsky, Roman; Gozin, Michael Iodocuprate-containing ionic liquids as promoters for green propulsion Journal of Materials Chemistry A, 2018, 6, 22819 |
7237030 | CIF | C10 H4 F2 O2 S | P n m a | 19.8371; 11.5899; 3.7081 90; 90; 90 | 852.53 | Krompiec, Michal P.; Baxter, Sean N.; Klimareva, Elena L.; Yufit, Dmitry S.; Congrave, Daniel G.; Britten, Thomas K.; Perepichka, Igor F. 3,4-Phenylenedioxythiophenes (PheDOTs) functionalized with electron-withdrawing groups and their analogs for organic electronics Journal of Materials Chemistry C, 2018, 6, 3743 |
7237009 | CIF | Au2.66 Cu2.34 Eu In | P n m a | 8.832; 5.3062; 11.059 90; 90; 90 | 518.3 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7237008 | CIF | Ag4.15 Au0.85 Eu In | P n m a | 9.0774; 5.6371; 11.382 90; 90; 90 | 582.42 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7237005 | CIF | Ag3.09 Cu1.91 Eu In | P n m a | 8.8834; 5.3927; 11.243 90; 90; 90 | 538.6 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7237004 | CIF | Ag3.21 Cu1.79 Eu In | P n m a | 8.8995; 5.3795; 11.2661 90; 90; 90 | 539.36 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7237002 | CIF | Au3.03 Cu1.97 Eu In | P n m a | 8.8585; 5.3061; 11.0668 90; 90; 90 | 520.18 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7237001 | CIF | Au3.94 Cu1.06 Eu In | P n m a | 8.9764; 5.4247; 11.1792 90; 90; 90 | 544.36 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7237000 | CIF | Ag3.31 Cu1.69 Eu In | P n m a | 8.9113; 5.387; 11.2599 90; 90; 90 | 540.53 | Smetana, Volodymyr; Mudryk, Yaroslav; Pecharsky, Vitalij K.; Mudring, Anja-Verena Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1,T2)5In (T = Cu, Ag, Au) Journal of Materials Chemistry C, 2018, 6, 1353 |
7236992 | CIF | Br5 Cs2 Fe H0.25 O | P n m a | 14.6652; 10.4144; 7.511 90; 90; 90 | 1147.15 | Wei, Fengxia; Brivio, Federico; Wu, Yue; Sun, Shijing; Bristowe, Paul D.; Cheetham, Anthony K. Synthesis, crystal structure, magnetic and electronic properties of the caesium-based transition metal halide Cs3Fe2Br9 Journal of Materials Chemistry C, 2018, 6, 3573 |
7236990 | CIF | Br4 Cs Fe | P n m a | 12.0861; 7.4271; 9.8187 90; 90; 90 | 881.37 | Wei, Fengxia; Brivio, Federico; Wu, Yue; Sun, Shijing; Bristowe, Paul D.; Cheetham, Anthony K. Synthesis, crystal structure, magnetic and electronic properties of the caesium-based transition metal halide Cs3Fe2Br9 Journal of Materials Chemistry C, 2018, 6, 3573 |
7236977 | CIF | Cd Cs O4 P | P n m a | 9.3971; 5.6764; 9.3171 90; 90; 90 | 496.99 | Shen, Yaoguo; Zhao, Sangen; Wang, Chenxi; Wang, Zujian; Feng, Jianghe; Hong, Maochun; Luo, Junhua An optoelectronic duple bistable phosphate with ultrahigh thermal stability Journal of Materials Chemistry C, 2018, 6, 388 |
7236458 | CIF | C10.5 H4.5 N0.5 O5 Tb0.5 | P n m a | 8.5052; 17.3256; 12.0864 90; 90; 90 | 1781.02 | Yang, Yan; Chen, Lian; Jiang, Feilong; Yu, Muxin; Wan, Xiuyan; Zhang, Bo; Hong, Maochun A family of doped lanthanide metal‒organic frameworks for wide-range temperature sensing and tunable white light emission Journal of Materials Chemistry C, 2017, 5, 1981 |
7236457 | CIF | C21 H9 Gd N O10 | P n m a | 8.5011; 17.2958; 12.0726 90; 90; 90 | 1775.07 | Yang, Yan; Chen, Lian; Jiang, Feilong; Yu, Muxin; Wan, Xiuyan; Zhang, Bo; Hong, Maochun A family of doped lanthanide metal‒organic frameworks for wide-range temperature sensing and tunable white light emission Journal of Materials Chemistry C, 2017, 5, 1981 |
7236456 | CIF | C10.5 H4.5 Eu0.5 N0.5 O5 | P n m a | 8.5023; 17.3319; 12.118 90; 90; 90 | 1785.72 | Yang, Yan; Chen, Lian; Jiang, Feilong; Yu, Muxin; Wan, Xiuyan; Zhang, Bo; Hong, Maochun A family of doped lanthanide metal‒organic frameworks for wide-range temperature sensing and tunable white light emission Journal of Materials Chemistry C, 2017, 5, 1981 |
7236322 | CIF | C36 H15.04 B Cl3.96 N6 | P n m a | 14.9062; 18.3548; 10.7766 90; 90; 90 | 2948.48 | Dang, Jeremy D.; Josey, David S.; Lough, Alan J.; Li, Yiying; Sifate, Alaa; Lu, Zheng-Hong; Bender, Timothy P. The mixed alloyed chemical composition of chloro-(chloro)n-boron subnaphthalocyanines dictates their physical properties and performance in organic photovoltaic devices Journal of Materials Chemistry A, 2016, 4, 9566 |
7236321 | CIF | C36 H16.87 B Cl2.13 N6 | P n m a | 14.623; 18.453; 10.3923 90; 90; 90 | 2804.24 | Dang, Jeremy D.; Josey, David S.; Lough, Alan J.; Li, Yiying; Sifate, Alaa; Lu, Zheng-Hong; Bender, Timothy P. The mixed alloyed chemical composition of chloro-(chloro)n-boron subnaphthalocyanines dictates their physical properties and performance in organic photovoltaic devices Journal of Materials Chemistry A, 2016, 4, 9566 |
7236186 | CIF | C40 H48 Cl3 F6 Ir N P3 | P n m a | 17.5194; 12.9278; 18.8945 90; 90; 90 | 4279.4 | Naicker, Dunesha; Friedrich, Holger B.; Pansuriya, Pramod B. Iridium and rhodium “PNP” aminodiphosphine complexes used as catalysts in the oxidation of styrene RSC Advances, 2016, 6, 31005 |
7236059 | CIF | C16 H6 In N0 O8 | P n m a | 20.305; 10.022; 17.22 90; 90; 90 | 3504.2 | Liu, Lin; Zhang, Xiao-Nan; Han, Zheng-Bo; Gao, Ming-Liang; Cao, Xiao-Man; Wang, Shi-Ming An InIII-based anionic metal‒organic framework: sensitization of lanthanide (III) ions and selective absorption and separation of cationic dyes Journal of Materials Chemistry A, 2015, 3, 14157 |
7236049 | CIF | C33 H27 O7.58 Yb | P n m a | 32.7626; 34.95; 5.7721 90; 90; 90 | 6609.4 | Wang, Xiaoqing; Zhang, Liangliang; Yang, Jie; Liu, Fuling; Dai, Fangna; Wang, Rongming; Sun, Daofeng Lanthanide metal‒organic frameworks containing a novel flexible ligand for luminescence sensing of small organic molecules and selective adsorption Journal of Materials Chemistry A, 2015, 3, 12777 |
7236048 | CIF | C66 H58 O15 Tm2 | P n m a | 32.8303; 34.9113; 5.8318 90; 90; 90 | 6684.1 | Wang, Xiaoqing; Zhang, Liangliang; Yang, Jie; Liu, Fuling; Dai, Fangna; Wang, Rongming; Sun, Daofeng Lanthanide metal‒organic frameworks containing a novel flexible ligand for luminescence sensing of small organic molecules and selective adsorption Journal of Materials Chemistry A, 2015, 3, 12777 |
7236047 | CIF | C66 H54 Eu2 O15 | P n m a | 32.8077; 35.0306; 5.7321 90; 90; 90 | 6587.8 | Wang, Xiaoqing; Zhang, Liangliang; Yang, Jie; Liu, Fuling; Dai, Fangna; Wang, Rongming; Sun, Daofeng Lanthanide metal‒organic frameworks containing a novel flexible ligand for luminescence sensing of small organic molecules and selective adsorption Journal of Materials Chemistry A, 2015, 3, 12777 |
7235942 | CIF | C68 H88 O8 | P n m a | 23.2197; 20.5223; 12.0874 90; 90; 90 | 5759.9 | Al-Azemi, Talal F.; Vinodh, Mickey Effect of the resorcin[4]arene host on the catalytic epoxidation of a Mn(iii)-based resorcin[4]arene‒metalloporphyrin conjugate RSC Advances, 2015, 5, 88154 |
7235941 | CIF | C65 H85 N O8 | P n m a | 23.2226; 20.3406; 12.1702 90; 90; 90 | 5748.7 | Al-Azemi, Talal F.; Vinodh, Mickey Effect of the resorcin[4]arene host on the catalytic epoxidation of a Mn(iii)-based resorcin[4]arene‒metalloporphyrin conjugate RSC Advances, 2015, 5, 88154 |
7235937 | CIF | C26 H29 N2 Nd O9 | P n m a | 18.8575; 21.8147; 12.8837 90; 90; 90 | 5300 | Wang, Chih-Chieh; Yeh, Chang-Tsung; Ke, Szu-Yu; Cheng, Yi-Ting; Yang, Ching-Chun; Lee, Gene-Hsiang; Chang, Chung-Kai; Sheu, Hwo-Shuenn Assembly of three Nd(iii) 2,6-naphthalenedicarboxylates (ndc2−) 3D coordination polymers based on various secondary building units (SBUs): structural diversity and gas sorption properties RSC Advances, 2015, 5, 92378 |
7235933 | CIF | C14 H18 N2 S2 Sn | P n m a | 9.9262; 17.2292; 9.7256 90; 90; 90 | 1663.3 | Tyagi, Adish; Kedarnath, G.; Wadawale, Amey; Jain, Vimal K.; Kumar, Mukesh; Vishwanadh, B. Diorganotin(iv) 2-pyridyl and 2-pyrimidyl thiolates: synthesis, structures and their utility as molecular precursors for the preparation of tin sulfide nanosheets RSC Advances, 2015, 5, 62882 |
7235848 | CIF | C78 H165 Co6 Mo24 N12 O152 P18 | P n m a | 29.209; 23.399; 15.388 90; 90; 90 | 10517 | Gong, Kaining; Wang, Weijie; Yan, Jinshuang; Han, Zhangang Highly reduced molybdophosphate as a noble-metal-free catalyst for the reduction of chromium using formic acid as a reducing agent Journal of Materials Chemistry A, 2015, 3, 6019 |
7235829 | CIF | C3 H6 N7 Na O7 | P n m a | 17.882; 6.0919; 9.281 90; 90; 90 | 1011 | Bian, Chengming; Dong, Xiao; Zhang, Xiuhui; Zhou, Zhiming; Zhang, Man; Li, Chuan The unique synthesis and energetic properties of a novel fused heterocycle: 7-nitro-4-oxo-4,8-dihydro-[1,2,4]triazolo[5,1-d][1,2,3,5]tetrazine 2-oxide and its energetic salts Journal of Materials Chemistry A, 2015, 3, 3594 |
7235808 | CIF | C8 H12 Cl4 O9 Ti2 | P n m a | 12.6154; 18.5017; 7.696 90; 90; 90 | 1796.3 | Liu, Junlei; Cai, Zhiwei; Lv, Yaokang; Zhang, Yujian; Su, Chang; Ouyang, Mi; Zhang, Cheng; Wright, Dominic S. From a polyoxotitanium cage to TiO2/C composites, a novel strategy for nanoporous materials Journal of Materials Chemistry A, 2015, 3, 1837 |
7235655 | CIF | C7 H15.33 Mn N O6 | P n m a | 8.9042; 12.7757; 9.2004 90; 90; 90 | 1046.6 | Liu, Jian-Qiang; Wu, Jian; Wang, Jun; Lu, Lu; Daiguebonne, Carole; Calvez, Guillaume; Guillou, Olivier; Sakiyama, Hiroshi; Weng, Ng Seik; Zeller, Matthias Temperature identification on two 3D Mn(ii) metal‒organic frameworks: syntheses, adsorption and magnetism RSC Advances, 2014, 4, 20605 |
7235622 | CIF | C24 H26 O5 S | P n m a | 9.5532; 24.2453; 9.5232 90; 90; 90 | 2205.77 | Naveen, Naveen; Babu, Srinivasarao Arulananda; Kaur, Gurpreet; Aslam, Nayyar Ahmad; Karanam, Maheswararao Glaser‒Eglinton‒Hay sp‒sp coupling and macrocyclization: construction of a new class of polyether macrocycles having a 1,3-diyne unit RSC Adv., 2014, 4, 18904 |
7235253 | CIF | C7 H9 I2 N | P n m a | 16.0537; 7.2941; 8.9376 90; 90; 90 | 1046.57 | Munir, Naima; Masood, Sara; Liaqat, Faroha; Tahir, Muhammad Nawaz; Yousuf, Sammer; Kalsoom, Saima; Mughal, Ehsan Ullah; Sumrra, Sajjad Hussain; Maalik, Aneela; Zafar, Muhammad Naveed Synthesis of new Pro-PYE ligands as co-catalysts toward Pd-catalyzed Heck‒Mizoroki cross coupling reactions RSC Advances, 2019, 9, 37986 |
7235179 | CIF | C19 H15 F6 N7 Pt | P n m a | 21.8036; 6.7963; 13.7863 90; 90; 90 | 2042.9 | Chung-Hao Tseng; Mark A. Fox; Jia-Ling Liao; Chia-Hao Ku; Zong-Ting Sie; Chih-Hao Chang; Jin-Yun Wang; Zhong-Ning Chen; Gene-Hsiang Lee; Yun Chi Luminescent Pt(ii) complexes featuring imidazolylidene-pyridylidene and dianionic bipyrazolate: from fundamentals to OLED fabrications Journal of Materials Chemistry C, 2017, 5, 1420-1435 |
7235131 | CIF | C4 H9 N Ni O6 | P n m a | 8.1795; 11.5234; 8.0835 90; 90; 90 | 761.92 | B. Pato-Doldan; L. C. Gomez-Aguirre; A. P. Hansen; J. Mira; S. Castro-Garcia; M. Sanchez-Andujar; M. A. Senaris-Rodriguez; V. S. Zapf; J. Singleton Magnetic transitions and isotropic versus anisotropic magnetic behaviour of [CH3NH3][M(HCOO)3] M = Mn2+, Co2+, Ni2+, Cu2+ metal-organic perovskites Journal of Materials Chemistry C, 2016, 4, 11164-11172 |
7235033 | CIF | C6 H12 Cd Cl2 N2 O4 S | P n m a | 16.939; 7.303; 9.723 90; 90; 90 | 1202.8 | Cheng Chen; Wan-Ying Zhang; Heng-Yun Ye; Qiong Ye; Da-Wei Fu Rapid dielectric bistable switching materials without a time/temperature responsive blind area in the linarite-like type molecular large-size single crystals Journal of Materials Chemistry C, 2016, 4, 9009-9020 |
7234798 | CIF | C12 H14 Br4 O6 S2 | P n m a | 9.2133; 25.7139; 8.9323 90; 90; 90 | 2116.15 | Chongboriboon, Nucharee; Samakun, Kodchakorn; Inprasit, Thitirat; Kielar, Filip; Dungkaew, Winya; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Ninković, Dragan B.; Zarić, Snežana D.; Chainok, Kittipong Two-dimensional halogen-bonded organic frameworks based on the tetrabromobenzene-1,4-dicarboxylic acid building molecule CrystEngComm, 2020, 22, 24-34 |
7234797 | CIF | C12 H14 Br4 O6 | P n m a | 9.27849; 23.5754; 8.6023 90; 90; 90 | 1881.7 | Chongboriboon, Nucharee; Samakun, Kodchakorn; Inprasit, Thitirat; Kielar, Filip; Dungkaew, Winya; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Ninković, Dragan B.; Zarić, Snežana D.; Chainok, Kittipong Two-dimensional halogen-bonded organic frameworks based on the tetrabromobenzene-1,4-dicarboxylic acid building molecule CrystEngComm, 2020, 22, 24-34 |
7234795 | CIF | C12 H14 Br4 O6 | P n m a | 9.1624; 23.482; 8.993 90; 90; 90 | 1934.86 | Chongboriboon, Nucharee; Samakun, Kodchakorn; Inprasit, Thitirat; Kielar, Filip; Dungkaew, Winya; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Ninković, Dragan B.; Zarić, Snežana D.; Chainok, Kittipong Two-dimensional halogen-bonded organic frameworks based on the tetrabromobenzene-1,4-dicarboxylic acid building molecule CrystEngComm, 2020, 22, 24-34 |
7234794 | CIF | C12 H14 Br4 O6 S2 | P n m a | 9.24933; 25.7601; 8.66218 90; 90; 90 | 2063.88 | Chongboriboon, Nucharee; Samakun, Kodchakorn; Inprasit, Thitirat; Kielar, Filip; Dungkaew, Winya; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Ninković, Dragan B.; Zarić, Snežana D.; Chainok, Kittipong Two-dimensional halogen-bonded organic frameworks based on the tetrabromobenzene-1,4-dicarboxylic acid building molecule CrystEngComm, 2020, 22, 24-34 |
7234764 | CIF | C30 H83 N6 O75 P2 Re2 W17 | P n m a | 28.1534; 13.4987; 31.1648 90; 90; 90 | 11843.7 | Niu, Jingyang; Lu, Jingkun; Feng, Junwei; Ma, Xinyi; Wang, Ping; Xu, Baijie; He, Peipei; Jia, Jiage; Ma, Pengtao; Wang, Jingping A new phoshotungstate-supported rhenium carbonyl derivative: synthesis, characterization and catalytic selective oxidation of thiophenes CrystEngComm, 2019 |
7234658 | CIF | C21 H21 N O | P n m a | 7.5283; 35.261; 18.8417 90; 90; 90 | 5001.6 | Wenwei Jin; Peter V. Johnston; Delwin L. Elder; Karl T. Manner; Kerry E. Garrett; Werner Kaminsky; Ruimin Xu; Bruce H. Robinson; Larry R. Dalton Structure-function relationship exploration for enhanced thermal stability and electro-optic activity in monolithic organic NLO chromophores Journal of Materials Chemistry C, 2016, 4, 3119-3124 |
7234628 | CIF | C16 H12 N4 | P n m a | 13.0779; 6.7374; 14.8646 90; 90; 90 | 1309.74 | Yang Zhang; Jaume Garcia-Amoros; Burjor Captain; Francisco M. Raymo A fluorescent and halochromic indolizine switch Journal of Materials Chemistry C, 2016, 4, 2744-2747 |
7234581 | CIF | C5 H16 Cl4 Mn N2 | P n m a | 7.149; 24.171; 7.334 90; 90; 90 | 1267.3 | Xing-Hui Lv; Wei-Qiang Liao; Peng-Fei Li; Zhong-Xia Wang; Chen-Yu Mao; Yi Zhang Dielectric and photoluminescence properties of a layered perovskite-type organic-inorganic hybrid phase transition compound: NH3(CH2)5NH3MnCl4 Journal of Materials Chemistry C, 2016, 4, 1881-1885 |
7234568 | CIF | C231 H56 Co2 N8 S6 | P n m a | 25.4112; 23.8293; 22.1557 90; 90; 90 | 13416 | Yu, Wei-Dong; Yan, Qian-Wen; Nie, Yan-Mei; Liang, Shuang; Li, Sang-Hao; Zhang, Yin; Lin, Ming-Yuan; Yan, Jun Discovery of two types of new porphyrin-C70 co-crystals: influence of intermolecular contact on the inherent resistance CrystEngComm, 2019 |
7234550 | CIF | C20 H17 N3 O3 | P n m a | 17.121; 6.9428; 15.446 90; 90; 90 | 1836 | Martin Ipuy; Yuan-Yuan Liao; Erwann Jeanneau; Patrice L. Baldeck; Yann Bretonniere; Chantal Andraud Solid state red biphotonic excited emission from small dipolar fluorophores Journal of Materials Chemistry C, 2016, 4, 766-779 |
7234525 | CIF | C6 H8 Cl5 Fe N2 O3 | P n m a | 12.7268; 17.1535; 7.0352 90; 90; 90 | 1535.85 | Tianliang Chen; Zhihua Sun; Sangen Zhao; Chengmin Ji; Junhua Luo An organic-inorganic hybrid co-crystal complex as a high-performance solid-state nonlinear optical switch Journal of Materials Chemistry C, 2016, 4, 266-271 |
7234474 | CIF | C14 H9 I | P n m a | 23.161; 9.844; 4.833 90; 90; 90 | 1101.9 | Junwei Yang; Moyun Chen; Ji Ma; Wei Huang; Haoyun Zhu; Yuli Huang; Weizhi Wang Boronate ester post-functionalization of PPEs: versatile building blocks for poly(2,2'-(1-(4-(1,2-di(thiophen-2-yl)vinyl)phenyl)-2- (2,5-dioctylphenyl)ethene-1,2-diyl)dithiophene) and application in field effect transistors Journal of Materials Chemistry C, 2015, 3, 10074-10078 |
7234244 | CIF | C52 H112 Mo24 N48 O124 Te4 | P n m a | 28.781; 28.635; 25.14 90; 90; 90 | 20719 | Yanfen Liang; Suzhi Li; Donghui Yang; Pengtao Ma; Jingyang Niu; Jingping Wang Controllable assembly of multicarboxylic acids functionalized heteropolyoxomolybdates and allochroic properties Journal of Materials Chemistry C, 2015, 3, 4632-4639 |
7234064 | CIF | C22 H16 Cl Cu N3 S16 | P n m a | 12.955; 29.9368; 8.4811 90; 90; 90 | 3289.2 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234063 | CIF | C22 H16 Cl Cu N3 S16 | P n m a | 12.9262; 29.848; 8.4661 90; 90; 90 | 3266.4 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234062 | CIF | C22 H16 Cl Cu N3 S16 | P n m a | 12.9062; 29.7595; 8.4509 90; 90; 90 | 3245.8 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234061 | CIF | C22 H16 Cl Cu N3 S16 | P n m a | 12.8917; 29.6686; 8.4335 90; 90; 90 | 3225.6 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234060 | CIF | C22 H16 Cl Cu N3 S16 | P n m a | 12.8852; 29.5759; 8.4161 90; 90; 90 | 3207.3 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234059 | CIF | C22 H16 Br Cu N3 S16 | P n m a | 12.9653; 30.028; 8.5444 90; 90; 90 | 3326.5 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234058 | CIF | C22 H16 Br Cu N3 S16 | P n m a | 12.9342; 29.937; 8.5325 90; 90; 90 | 3303.9 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234057 | CIF | C22 H16 Br Cu N3 S16 | P n m a | 12.9117; 29.845; 8.5178 90; 90; 90 | 3282.3 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234056 | CIF | C22 H16 Br Cu N3 S16 | P n m a | 12.8991; 29.754; 8.5025 90; 90; 90 | 3263.3 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7234055 | CIF | C22 H16 Br Cu N3 S16 | P n m a | 12.8965; 29.651; 8.4826 90; 90; 90 | 3243.7 | Takaaki Hiramatsu; Yukihiro Yoshida; Gunzi Saito; Akihiro Otsuka; Hideki Yamochi; Mitsuhiko Maesato; Yasuhiro Shimizu; Hiroshi Ito; Hideo Kishida Quantum spin liquid: design of a quantum spin liquid next to a superconducting state based on a dimer-type ET Mott insulator Journal of Materials Chemistry C, 2015, 3, 1378-1388 |
7233870 | CIF | C11 H11 Cl3 I N3 | P n m a | 10.65379; 14.07388; 10.48437 90; 90; 90 | 1572.03 | Alexander N. Chernyshev; Dmitry Morozov; Jarkko Mutanen; Vadim Yu Kukushkin; Gerrit Groenhof; Matti Haukka Weak intermolecular interactions promote blue luminescence of protonated 2,2'-dipyridylamine salts Journal of Materials Chemistry C, 2014, 2, 8285-8294 |
7233869 | CIF | C11 H11 Cl3 I N3 | P n m a | 10.5575; 14.04189; 10.3887 90; 90; 90 | 1540.1 | Alexander N. Chernyshev; Dmitry Morozov; Jarkko Mutanen; Vadim Yu Kukushkin; Gerrit Groenhof; Matti Haukka Weak intermolecular interactions promote blue luminescence of protonated 2,2'-dipyridylamine salts Journal of Materials Chemistry C, 2014, 2, 8285-8294 |
7233848 | CIF | C5 H16 N10 Ni O10 | P n m a | 9.6991; 14.573; 11.082 90; 90; 90 | 1566.4 | Wang, Yanna; Yang, Xiaoming; Zhang, Weijing; Li, Haibo; Li, Zhimin; Wang, Lin; Zhang, Tonglai Energetic transition metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazole: syntheses, structures and properties CrystEngComm, 2019, 21, 6452 |
7233847 | CIF | C5 H16 N10 O10 Zn | P n m a | 9.775; 14.662; 11.057 90; 90; 90 | 1584.7 | Wang, Yanna; Yang, Xiaoming; Zhang, Weijing; Li, Haibo; Li, Zhimin; Wang, Lin; Zhang, Tonglai Energetic transition metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazole: syntheses, structures and properties CrystEngComm, 2019, 21, 6452 |
7233846 | CIF | C5 H16 Co N10 O10 | P n m a | 9.826; 14.671; 10.946 90; 90; 90 | 1577.9 | Wang, Yanna; Yang, Xiaoming; Zhang, Weijing; Li, Haibo; Li, Zhimin; Wang, Lin; Zhang, Tonglai Energetic transition metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazole: syntheses, structures and properties CrystEngComm, 2019, 21, 6452 |
7233845 | CIF | C5 H16 Cd N10 O10 | P n m a | 9.916; 14.765; 11.093 90; 90; 90 | 1624.1 | Wang, Yanna; Yang, Xiaoming; Zhang, Weijing; Li, Haibo; Li, Zhimin; Wang, Lin; Zhang, Tonglai Energetic transition metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazole: syntheses, structures and properties CrystEngComm, 2019, 21, 6452 |
7233730 | CIF | C11 H7 Br4 N2 O2 | P n m a | 18.5984; 18.6075; 3.9545 90; 90; 90 | 1368.53 | Molcanov, Kresimir; Milasinovic, Valentina; Ivic, Nives; Stilinović, Vladimir; Kolaric, Dinko; Kojic-Prodic, Biserka Influence of organic cations on stacking of semiquinone radical anions CrystEngComm, 2019 |
7233291 | CIF | C8 H6 N4 O2 | P n m a | 9.3323; 14.8768; 6.3126 90; 90; 90 | 876.41 | Hloušková, Zuzana; Klikar, Milan; Pytela, Oldřich; Almonasy, Numan; Růžička, Aleš; Jandová, Veronika; Bureš, Filip Structural elaboration of dicyanopyrazine: towards push‒pull molecules with tailored photoredox activity RSC Advances, 2019, 9, 23797 |
7233106 | CIF | C4 H16 I2 N4 Ni O4 | P n m a | 7.5456; 18.9706; 10.1902 90; 90; 90 | 1458.67 | Vušak, Darko; Smrečki, Neven; Prugovečki, Biserka; Đilović, Ivica; Kirasić, Inka; Žilić, Dijana; Muratović, Senada; Matković-Čalogović, Dubravka Cobalt, nickel and copper complexes with glycinamide: structural insights and magnetic properties RSC Advances, 2019, 9, 21637 |
7233101 | CIF | C4 H16 Co I2 N4 O4 | P n m a | 7.3966; 19.1784; 10.1512 90; 90; 90 | 1440 | Vušak, Darko; Smrečki, Neven; Prugovečki, Biserka; Đilović, Ivica; Kirasić, Inka; Žilić, Dijana; Muratović, Senada; Matković-Čalogović, Dubravka Cobalt, nickel and copper complexes with glycinamide: structural insights and magnetic properties RSC Advances, 2019, 9, 21637 |
7232987 | CIF | C6 H4 Cl2 N2 Ni | P n m a | 15.90267; 3.53278; 14.08069 90; 90; 90 | 791.06 | Heine, Miriam; Fink, Lothar; Schmidt, Martin U. Coordination compounds built up from MIICl2 and 3-cyanopyridine: double chains, single chains and isolated complexes CrystEngComm, 2019, 21, 4305 |
7232984 | CIF | C6 H4 Cl2 Mn N2 | P n m a | 16.53381; 3.69328; 14.45964 90; 90; 90 | 882.96 | Heine, Miriam; Fink, Lothar; Schmidt, Martin U. Coordination compounds built up from MIICl2 and 3-cyanopyridine: double chains, single chains and isolated complexes CrystEngComm, 2019, 21, 4305 |
7232980 | CIF | C6 H4 Cl2 Co N2 | P n m a | 16.08629; 3.58737; 14.19096 90; 90; 90 | 818.92 | Heine, Miriam; Fink, Lothar; Schmidt, Martin U. Coordination compounds built up from MIICl2 and 3-cyanopyridine: double chains, single chains and isolated complexes CrystEngComm, 2019, 21, 4305 |
7232977 | CIF | C12 H8 Cl2 N4 Zn | P n m a | 10.66526; 20.39976; 6.61154 90; 90; 90 | 1438.46 | Heine, Miriam; Fink, Lothar; Schmidt, Martin U. Coordination compounds built up from MIICl2 and 3-cyanopyridine: double chains, single chains and isolated complexes CrystEngComm, 2019, 21, 4305 |
7232555 | CIF | H8 O32 Pb3.017 U8 | P n m a | 12.551; 8.376; 13.0107 90; 90; 90 | 1367.78 | Ghazisaeed, Seyedayat; Kiefer, Boris; Plášil, Jakub Revealing hydrogen atoms in a highly-absorbing material: an X-ray diffraction study and Torque method calculations for lead-uranyl-oxide mineral curite RSC Advances, 2019, 9, 10058 |
7232513 | CIF | F2 O3 Se Zn2 | P n m a | 7.2758; 10.042; 5.2562 90; 90; 90 | 384.04 | You, Fengguang; Gong, Pifu; Liang, Fei; Jiang, Xingxing; Tu, Heng; Zhao, Ying; Hu, Zhanggui; Lin, Zheshuai M2(SeO3)F2 (M = Zn, Cd): understanding the structure directing effect of [SeO3]2− groups on constructing ordered oxyfluorides CrystEngComm, 2019, 21, 2485 |
7232512 | CIF | Cd2 F2 O3 Se | P n m a | 7.8033; 10.566; 5.7294 90; 90; 90 | 472.39 | You, Fengguang; Gong, Pifu; Liang, Fei; Jiang, Xingxing; Tu, Heng; Zhao, Ying; Hu, Zhanggui; Lin, Zheshuai M2(SeO3)F2 (M = Zn, Cd): understanding the structure directing effect of [SeO3]2− groups on constructing ordered oxyfluorides CrystEngComm, 2019, 21, 2485 |
7232453 | CIF | C11 H14 Ag2 N6 O7 | P n m a | 20.5483; 16.1886; 4.8655 90; 90; 90 | 1618.5 | Baudron, Stéphane A.; Chevreau, Hubert Revisiting Ag‒π interactions with bis((pyrrol-2-yl)methylene)hydrazine: CC versus CN bond complexation CrystEngComm, 2019, 21, 1853 |
7232086 | CIF | C15 H14 O2 | P n m a | 14.073; 6.8273; 12.0491 90; 90; 90 | 1157.68 | Bristow, Jonathan C.; Addicoat, Matthew A.; Wallis, John D. O(−)⋯C interactions and bond formation in 1-naphtholate anions with peri-located electrophilic carbon centres CrystEngComm, 2019, 21, 1009 |
7232059 | CIF | C10 H11 N3 O3 | P n m a | 9.9817; 6.6498; 15.4052 90; 90; 90 | 1022.5 | Wenholz, Daniel S.; Bhadbhade, Mohan; Kandemir, Hakan; Ho, Junming; Kumar, Naresh; Black, David StC. Substituent effects in solid-state assembly of activated benzotriazoles CrystEngComm, 2019, 21, 835 |
7231992 | CIF | C20 H26 Cl F6 Ir N3 O P | P n m a | 13.5409; 12.9814; 13.6168 90; 90; 90 | 2393.6 | Huang, Ming; Li, Yinwu; Liu, Jiahao; Lan, Xiao-Bing; Liu, Yan; Zhao, Cunyuan; Ke, Zhuofeng A bifunctional strategy for N-heterocyclic carbene-stabilized iridium complex-catalyzed N-alkylation of amines with alcohols in aqueous media Green Chemistry, 2019, 21, 219 |
7231955 | CIF | C29 H20 Cr N2 O7 S | P n m a | 8.3302; 23.634; 12.8113 90; 90; 90 | 2522.2 | Tang, Jie; Yao, Pengfei; Wang, Lina; Bian, Hedong; Luo, Meiyi; Huang, Fuping Schiff base complex conjugates of bovine serum albumin as artificial metalloenzymes for eco-friendly enantioselective sulfoxidation RSC Advances, 2018, 8, 40720 |
7231930 | CIF | C44 H32 O10 | P n m a | 27.04; 17.777; 8.1345 90; 90; 90 | 3910.2 | Xiao, Zufeng; Yang, Weiping; Yan, Fengyi; Ji, Lingbo; Li, Wei; Wang, Wei Assembly of calix[4]arene carboxylic acid derivatives by hydrogen bonding CrystEngComm, 2019, 21, 439 |
7231662 | CIF | C7 H14 Cl N O5 | P n m a | 11.7255; 8.2616; 10.4236 90; 90; 90 | 1009.75 | Fan, Guang-Meng; Gao, Ji-Xing; Shi, Chao; Yu, Hui; Ye, Le; Jiang, Jia-Ying; Shuai, Cijun; Zhang, Yi; Ye, Heng-Yun [C7H14NO][ClO4]: order‒disorder structural change induced sudden switchable dielectric behaviour at room temperature CrystEngComm, 2018, 20, 7058 |
7231600 | CIF | C34 H20 Cd N4 O8 | P n m a | 23.835; 10.0215; 12.362 90; 90; 90 | 2952.8 | Fu, Chen; Zhang, Guo-Shuai; Wang, Hai-Yu; Li, Li; Fu, Jia-Wei; Sun, Ya-Nan; Zhang, Hong Different photochromic properties induced by lone pair‒π interactions with varying strengths in two stereocontrolled self-assembly isomeric coordination polymers CrystEngComm, 2018, 20, 6821 |
7231386 | CIF | C32 H37 Cl Co3 N6 O16 | P n m a | 19.582; 20.1291; 12.0113 90; 90; 90 | 4734.5 | Zhou, Lei; Zhou, Baolei; Cui, Zheng; Qin, Bowen; Zhang, Xiaoying; Li, Wenliang; Zhang, Jingping Charge control of the formation of two neutral/cationic metal‒organic frameworks based on neutral/cationic triangular clusters and isonicotinic acid: structure, gas adsorption and magnetism CrystEngComm, 2018, 20, 5402 |
7231343 | CIF | C24 H32 Cd N4 O4 | P n m a | 12.872; 18.867; 9.9383 90; 90; 90 | 2413.6 | LaDuca, Andrew R.; LaDuca, Robert L. Nitroaromatic-detecting cadmium cyclohexyldicarboxylate coordination polymers with bis(4-pyridylmethyl)piperazine coligands and unprecedented 2D and 3D topologies CrystEngComm, 2018, 20, 5677 |
7231286 | CIF | C58 H73 Co3 N14 O20 | P n m a | 18.1925; 40.2091; 9.548 90; 90; 90 | 6984.4 | Gao, Xiang; Zhang, Shan-Shan; Yan, Hui; Li, Yun-Wu; Liu, Qing-Yun; Wang, Xing-Po; Tung, Chen-Ho; Ma, Hui-Yan; Sun, Di A pillar-layered porous CoII-MOF with dual active sites for selective gas adsorption CrystEngComm, 2018, 20, 4905 |
7231087 | CIF | C48 H35 N4 O4 | P n m a | 12.4512; 19.7388; 14.6081 90; 90; 90 | 3590.3 | Ion, Adrian E.; Dogaru, Andreea; Shova, Sergiu; Madalan, Augustin M.; Akintola, Oluseun; Ionescu, Sorana; Voicescu, Mariana; Nica, Simona; Buchholz, Axel; Plass, Winfried; Andruh, Marius Organic co-crystals of 1,3-bis(4-pyridyl)azulene with a series of hydrogen-bond donors CrystEngComm, 2018, 20, 4463 |
7231054 | CIF | C10 H12 N6 S2 Zn | P n m a | 8.4322; 12.5613; 13.9647 90; 90; 90 | 1479.13 | Di Santo, Alejandro; Pérez, Hiram; Echeverría, Gustavo A.; Piro, Oscar E.; Iglesias, Rodrigo A.; Carbonio, Raúl E.; Ben Altabef, Aida; Gil, Diego M. Exploring weak intermolecular interactions in thiocyanate-bonded Zn(ii) and Cd(ii) complexes with methylimidazole: crystal structures, Hirshfeld surface analysis and luminescence properties RSC Advances, 2018, 8, 23891 |
7231021 | CIF | C9 H25 I2 Mn N3 O8 | P n m a | 9.8288; 19.216; 10.2845 90; 90; 90 | 1942.4 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231020 | CIF | C9 H21 Ca0.57 Cl2 N3 O6 Sr0.43 | P n m a | 8.9965; 17.6045; 10.3191 90; 90; 90 | 1634.3 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231019 | CIF | C9 H25 Br2 Mg N3 O8 | P n m a | 9.5844; 18.9445; 9.9448 90; 90; 90 | 1805.7 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231018 | CIF | C9 H21 Br2 Ca N3 O6 | P n m a | 9.2414; 17.6966; 10.3565 90; 90; 90 | 1693.7 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231009 | CIF | C9 H25 I2 Mn N3 O8 | P n m a | 9.8652; 19.267; 10.3186 90; 90; 90 | 1961.3 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231007 | CIF | C9 H21 Br2 Ca0.61 N3 O6 Sr0.4 | P n m a | 9.1728; 17.8422; 10.42 90; 90; 90 | 1705.4 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231005 | CIF | C9 H21 Br2 Ca N3 O6 | P n m a | 9.2414; 17.6966; 10.3565 90; 90; 90 | 1693.7 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7231004 | CIF | C9 H25 Br2 Mg N3 O8 | P n m a | 9.6161; 18.9415; 9.993 90; 90; 90 | 1820.2 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
7230889 | CIF | C8 H8 N4 O5 Zn | P n m a | 7.6089; 7.2802; 18.485 90; 90; 90 | 1024 | Wang, Yan-Qin; Wang, Kun; Gao, En-Qing Mixed metal CoII1−xZnIIx‒organic frameworks based on chains with mixed carboxylate and azide bridges: magnetic coupling and slow relaxation RSC Advances, 2018, 8, 22046 |
7230843 | CIF | C19 H44 N4 O P2 Se2 | P n m a | 20.57; 11.104; 12.117 90; 90; 90 | 2767.6 | Tan, Davin; Ng, Zi Xuan; Sim, Ying; Ganguly, Rakesh; García, Felipe cis-Cyclodiphosph(v/v)azanes as highly stable and robust main group supramolecular building blocks CrystEngComm, 2018, 20, 5998 |
7230838 | CIF | C19 H44 N5 O P2 Se2 | P n m a | 21.8437; 10.7274; 11.5787 90; 90; 90 | 2713.19 | Tan, Davin; Ng, Zi Xuan; Sim, Ying; Ganguly, Rakesh; García, Felipe cis-Cyclodiphosph(v/v)azanes as highly stable and robust main group supramolecular building blocks CrystEngComm, 2018, 20, 5998 |
7230835 | CIF | C18 H44 N4 O P2 S Se2 | P n m a | 20.6757; 10.9903; 11.8544 90; 90; 90 | 2693.7 | Tan, Davin; Ng, Zi Xuan; Sim, Ying; Ganguly, Rakesh; García, Felipe cis-Cyclodiphosph(v/v)azanes as highly stable and robust main group supramolecular building blocks CrystEngComm, 2018, 20, 5998 |
7230810 | CIF | C H6 Cl4 Fe N | P n m a | 11.453; 7.332; 10.107 90; 90; 90 | 848.7 | Yin, Jie; Shi, Shaozhen; Wei, Jiazhen; He, Guohang; Fan, Lin; Guo, Junxue; Zhang, Kaixuan; Xu, Wenli; Yuan, Cang; Wang, Yunying; Wang, Liwen; Pu, Xipeng; Li, Wenzhi; Zhang, Dafeng; Wang, Jie; Ren, Xiaozhen; Ma, Huiyan; Shao, Xin; Zhou, Huawei Earth-abundant and environment friendly organic‒inorganic hybrid tetrachloroferrate salt CH3NH3FeCl4: structure, adsorption properties and photoelectric behavior RSC Advances, 2018, 8, 19958 |
7230737 | CIF | C18 H34 F2 N12 Ni O5 | P n m a | 8.9; 21.14; 15.03 90; 90; 90 | 2827.8 | Jian, Fang Fang; Liu, E.; Ma, Jun Ying Interesting fluorine anion water clusters [F−·(H2O)n] in metal complex crystals CrystEngComm, 2018, 20, 3849 |
7230626 | CIF | C20 H23 Cu0.5 F6 N3 O3 | P n m a | 16.3979; 25.7808; 10.7851 90; 90; 90 | 4559.4 | Gao, Yan-Li; Nishihara, Sadafumi; Inoue, Katsuya Synthesis, crystal structures and magnetic properties of six coordination compounds constructed with pyridine iminomethyl‒TEMPO radicals and [M(hfac)2] (M = CuII and MnII) CrystEngComm, 2018, 20, 2961 |
7230625 | CIF | C40 H46 F12 Mn N6 O6 | P n m a | 16.6043; 26.0628; 10.8332 90; 90; 90 | 4688.1 | Gao, Yan-Li; Nishihara, Sadafumi; Inoue, Katsuya Synthesis, crystal structures and magnetic properties of six coordination compounds constructed with pyridine iminomethyl‒TEMPO radicals and [M(hfac)2] (M = CuII and MnII) CrystEngComm, 2018, 20, 2961 |
7230566 | CIF | Dy O6 Sc2 Tb | P n m a | 5.72409; 7.91013; 5.45235 90; 90; 90 | 246.873 | Guguschev, C.; Hidde, J.; Gesing, T. M.; Gogolin, M.; Klimm, D. Czochralski growth and characterization of TbxGd1−xScO3 and TbxDy1−xScO3 solid-solution single crystals CrystEngComm, 2018, 20, 2868 |
7230501 | CIF | C24 H23 N O2 | P n m a | 14.7181; 10.2605; 12.0651 90; 90; 90 | 1822.01 | Kotha, Sambasivarao; Pulletikurti, Sunil Synthesis of propellanes containing a bicyclo[2.2.2]octene unit via the Diels‒Alder reaction and ring-closing metathesis as key steps RSC Advances, 2018, 8, 14906 |
7230331 | CIF | C15 H11 Br I N2 O | P n m a | 6.1651; 66.924; 6.833 90; 90; 90 | 2819.2 | Sugiyama, Haruki; Uekusa, Hidehiro Relationship between crystal structures and photochromic properties of N-salicylideneaminopyridine derivatives CrystEngComm, 2018, 20, 2144 |
7230277 | CIF | C2 H19 Co Mo N6 O11 | P n m a | 27.0371; 7.9845; 6.4776 90; 90; 90 | 1398.37 | Cindrić, Marina; Stilinović, Vladimir; Rubčić, Mirta; Medak, Glorija; Šišak Jung, Dubravka; Vrdoljak, Višnja Supramolecular assembly of oxalatomolybdates controlled by the hydrogen bonding potential of Co(iii)-ammine cations CrystEngComm, 2018, 20, 1889 |
7230186 | CIF | C13 H20 N4 O7 S | P n m a | 15.0591; 6.7221; 16.0418 90; 90; 90 | 1623.9 | Fu, Qiang; Xu, Xi-kun; Liu, Bao-kai; Guo, Fang Solid state transformations of different stoichiometric forms of an organic salt formed from 5-sulfosalicylic acid and hexamethylenetetramine upon dehydration and rehydration CrystEngComm, 2018, 20, 1844 |
7230093 | CIF | C43 H33 N9 Ni3 O8 | P n m a | 17.9052; 25.3476; 8.9987 90; 90; 90 | 4084.09 | Wang, Kai; Tang, Shen; Hu, Zhao-Bo; Zou, Hua-Hong; Wang, Xiao-Lu; Li, Yan; Zhang, Shu-Hua; Chen, Zi-Lu; Liang, Fu-Pei A family of 3d metal clusters based on N‒N single bonds bridged quasi-linear trinuclear cores: the Mn analogue displaying single-molecule magnet behavior RSC Advances, 2018, 8, 6218 |
7229731 | CIF | C20 H20 O2 S | P n m a | 6.2278; 37.44; 7.3546 90; 90; 90 | 1714.9 | Nguyen, Thanh Binh; Retailleau, Pascal Sulfurative self-condensation of ketones and elemental sulfur: a three-component access to thiophenes catalyzed by aniline acid‒base conjugate pairs Green Chemistry, 2018, 20, 387 |
7229716 | CIF | C41 H33 N3 O3 S | P n m a | 28.24; 20.01; 5.663 90; 90; 90 | 3200 | Karimata, Ayumu; Suzuki, Shuichi; Kozaki, Masatoshi; Okada, Keiji Stereoelectronic control of oxidation potentials of 3,7-bis(diarylamino)phenothiazines RSC Advances, 2017, 7, 56144 |
7229668 | CIF | C2 Cl6 | P n m a | 11.2254; 10.0086; 6.33713 90; 90; 90 | 711.98 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229667 | CIF | C2 Cl6 | P n m a | 11.5358; 10.1791; 6.4013 90; 90; 90 | 751.67 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229666 | CIF | C2 Cl6 | P n m a | 10.864; 9.7573; 6.1183 90; 90; 90 | 648.6 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229665 | CIF | C2 Cl6 | P n m a | 10.502; 9.4708; 5.93353 90; 90; 90 | 590.16 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229664 | CIF | C2 Cl6 | P n m a | 10.618; 9.5461; 5.9958 90; 90; 90 | 607.74 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229663 | CIF | C2 Cl6 | P n m a | 11.2102; 10.0001; 6.33101 90; 90; 90 | 709.73 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229662 | CIF | C2 Cl6 | P n m a | 11.5785; 10.1983; 6.3875 90; 90; 90 | 754.24 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Loose crystals engineered by mismatched halogen bonds in hexachloroethane CrystEngComm, 2018, 20, 328 |
7229537 | CIF | C5 H12 Br3 Cd N | P n m a | 15.322; 7.0479; 10.105 90; 90; 90 | 1091.2 | Sun, Xiao-Fen; Wang, Zhongxia; Liao, Wei-Qiang; Li, Peng-Fei; Gao, Jixing; Huang, Yi-Yang; Chen, Hai-Peng; Ye, Heng-Yun; Zhang, Yi Modulating molecular structures and dielectric transitions in organic‒inorganic hybrid crystals RSC Advances, 2017, 7, 52024 |
7229445 | CIF | C4 H10 I N O2 | P n m a | 9.5887; 6.0522; 12.6513 90; 90; 90 | 734.19 | Rademeyer, Melanie; van der Westhuizen, Belinda Salts of 4-aminobutyric acid and 6-aminohexanoic acid behaving as molecular Velcro CrystEngComm, 2017 |
7229416 | CIF | Ca2 Fe2 O5 | P n m a | 5.42489; 14.78357; 5.59289 90; 90; 90 | 448.546 | Kagomiya, Isao; Hirota, Yuki; Kakimoto, Ken-ichi; Fujii, Kotaro; Shiraiwa, Masahiro; Yashima, Masatomo; Fuwa, Akio; Nakamura, Shin Weak ferromagnetic ordering in brownmillerite Ca2Fe2O5 and its effect on electric field gradients Phys. Chem. Chem. Phys., 2017 |
7229267 | CIF | Ba2 Cd2 O12 Se4 | P n m a | 16.5983; 5.4518; 7.1154 90; 90; 90 | 643.88 | Jia, Ying-Jie; Chen, Yi-Gang; Yao, Xiao-Ni; Zhang, Xian-Ming Alkali Earth MOx (x=6, 7, 9, 12) Polyhedra Tuned Cadmium Selenites with Different Dimensions and Diverse SeO32-Coordinations CrystEngComm, 2017 |
7229262 | CIF | C4.74 H6.84 Cu2 N8 S2 | P n m a | 9.5028; 10.7121; 11.9937 90; 90; 90 | 1220.9 | Tao, Ye; Li, You; Pang, Xuhong; Li, Haiye; Huang, Fu-Ping; Qin, Huangfei; Bian, He-Dong Four CuI(ett) Coordination polymorphs and Changes in XRD Upon Hydrothermal Condition Optimization CrystEngComm, 2017 |
7229212 | CIF | C6 H6.5 F3 N2.5 O2 Zn | P n m a | 14.2627; 13.4623; 9.8745 90; 90; 90 | 1895.99 | Holdt, Hans-Jurgen; Mondal, Suvendu Sekhar; Hovestadt, Maximilian; Dey, Subarna; Paula, Carolin; Glomb, Sebastian; Kelling, Alexandra; Schilde, Uwe; Janiak, Christoph; Hartmann, Martin Synthesis of a partially fluorinated ZIF-8 analog for ethane/ethene separation CrystEngComm, 2017 |
7228849 | CIF | K P S4 Sr | P n m a | 16.8214; 6.6274; 6.5585 90; 90; 90 | 731.16 | Jiang, Jianqiao; Mei, Dajiang; Gong, Pifu; Lin, Zheshuai; Zhong, Junbo; Wu, Yuandong Wide band gap design of new chalcogenide compounds: KSrPS4 and CsBaAsS4 RSC Adv., 2017, 7, 38044 |
7228848 | CIF | As Ba Cs S4 | P n m a | 11.9066; 6.9184; 10.0338 90; 90; 90 | 826.53 | Jiang, Jianqiao; Mei, Dajiang; Gong, Pifu; Lin, Zheshuai; Zhong, Junbo; Wu, Yuandong Wide band gap design of new chalcogenide compounds: KSrPS4 and CsBaAsS4 RSC Adv., 2017, 7, 38044 |
7228817 | CIF | N2 O Pr Ta | P n m a | 5.6848; 8.0116; 5.6808 90; 90; 90 | 258.728 | Hojamberdiev, Mirabbos; Bekheet, Maged F.; Hart, Judy N.; Vequizo, Junie Jhon M.; Yamakata, Akira; Yubuta, Kunio; Gurlo, Aleksander; Hasegawa, Masashi; Domen, Kazunari; Teshima, Katsuya Elucidating the Impact of A-Site Cation Change on Photocatalytic H2 and O2 Evolution Activities of Perovskite-Type LnTaON2 (Ln = La and Pr) Phys. Chem. Chem. Phys., 2017 |
7228736 | CIF | C38 H20 F3 I3 | P n m a | 17.2928; 23.1876; 7.7431 90; 90; 90 | 3104.8 | Li, Li Li; Wang, Hui; Wang, Weizhou; Jin, Wei Jun Interactions between haloperfluorobenzenes and fluoranthene in luminescent cocrystals from π‒hole···π to σ‒hole···π bonds CrystEngComm, 2017 |
7228507 | CIF | C14 H11 N2 O7 Rb S2 | P n m a | 13.113; 6.541; 19.17 90; 90; 90 | 1644 | Karothu, Durga Prasad; Jahovic, Ilma; Jovanovski , Gligor; Kaitner, Branko; Naumov, Pance Ionic Cocrystals of Molecular Saccharin CrystEngComm, 2017 |
7228506 | CIF | C14 H11 Cs N2 O7 S2 | P n m a | 13.297; 6.6748; 19.359 90; 90; 90 | 1718.2 | Karothu, Durga Prasad; Jahovic, Ilma; Jovanovski , Gligor; Kaitner, Branko; Naumov, Pance Ionic Cocrystals of Molecular Saccharin CrystEngComm, 2017 |
7228468 | CIF | Ba Fe1.95 Se3 | P n m a | 11.936; 5.4322; 9.1679 90; 90; 90 | 594.44 | Gao, Juanjuan; Teng, Yifei; Liu, Wei; Chen, Shufan; Tong, Wenming; Li, Min; Zhao, Xudong; Liu, Xiaoyang The synthesis and magnetic properties of BaFe2Se3 single crystals RSC Adv., 2017, 7, 30433 |
7228164 | CIF | C4 H2 Cl I N2 | P n m a | 14.8774; 6.7419; 6.1893 90; 90; 90 | 620.8 | Hübscher, Jörg; Seichter, Wilhelm; Weber, Edwin Intermolecular contacts in the crystal structures of specifically varied halogen and protonic group substituted azines CrystEngComm, 2017 |
7228163 | CIF | C5 H2 Cl2 I N | P n m a | 13.4092; 6.7578; 7.9577 90; 90; 90 | 721.1 | Hübscher, Jörg; Seichter, Wilhelm; Weber, Edwin Intermolecular contacts in the crystal structures of specifically varied halogen and protonic group substituted azines CrystEngComm, 2017 |
7228141 | CIF | C8 H13 I3 N2 Pb | P n m a | 7.8013; 10.2985; 19.117 90; 90; 90 | 1535.9 | Duan, Hai-Bao; Yu, Shan-Shan; Liu, Shao-Xian; Zhang, Hui A multi-functional iodoplumbate-based hybrid crystal: 1-propyl-4-aminopyridinium triiodoplumbate RSC Adv., 2017, 7, 23234 |
7228140 | CIF | C8 H13 I3 N2 Pb | P n m a | 7.8748; 10.405; 19.3554 90; 90; 90 | 1585.9 | Duan, Hai-Bao; Yu, Shan-Shan; Liu, Shao-Xian; Zhang, Hui A multi-functional iodoplumbate-based hybrid crystal: 1-propyl-4-aminopyridinium triiodoplumbate RSC Adv., 2017, 7, 23234 |
7227971 | CIF | C8 H12 O8 P2 Zn2 | P n m a | 22.259; 5.8452; 4.9451 90; 90; 90 | 643.4 | Zhang, Li; Li, Sanying; Liu, Lei; Dong, Jinxiang; Lin, Zhi Four new zinc (II) diphosphonates obtained via an ionothermal route: crystal structures and phase transformation behaviour CrystEngComm, 2017 |
7227927 | CIF | C14 H22 N2 Ni O10 P2 | P n m a | 7.2046; 19.6744; 13.6407 90; 90; 90 | 1933.52 | Demadis, Konstantinos D.; Anagnostou, Zafeiria; Panera, Aggeliki; Mezei, Gellert; Kirillova, Marina V.; Kirillov, Alexander M. Three-component 1D and 2D metal phosphonates: structural variability, topological analysis and catalytic hydrocarboxylation of alkanes RSC Adv., 2017, 7, 17788 |
7227818 | CIF | C H7 Cl Cu N2 O6 | P n m a | 7.4087; 7.8568; 12.3745 90; 90; 90 | 720.3 | Bovill, Sally M.; Dixey, Richard J. C.; Saines, Paul J. Three coordination frameworks with copper formate based low dimensional motifs: synthesis, structure and magnetic properties CrystEngComm, 2017, 19, 1831 |
7227816 | CIF | C15 H19 Cu2 N9 O9 | P n m a | 9.3812; 12.9376; 18.1801 90; 90; 90 | 2206.52 | Bovill, Sally M.; Dixey, Richard J. C.; Saines, Paul J. Three coordination frameworks with copper formate based low dimensional motifs: synthesis, structure and magnetic properties CrystEngComm, 2017, 19, 1831 |
7227813 | CIF | C12 H28 Cd2 Cl6 N2 | P n m a | 6.779; 7.648; 20.8582 90; 90; 90 | 1081.4 | Lu, Yang; Wang, Zhongxia; Chen, Hai-Peng; Ge, Jia-Zhen High temperature structural phase transition and dielectric relaxation in an organic‒inorganic hybrid compound: (4-methylpiperidinium)CdCl3 CrystEngComm, 2017, 19, 1896 |
7227703 | CIF | B16 Gd7.5 O48 Sr12 Yb0.5 | P n m a | 7.3859; 15.9445; 8.7003 90; 90; 90 | 1024.59 | Sun, Shijia; Wei, Qi; Lou, Fei; Huang, Yisheng; Yuan, Feifei; Zhang, Lizhen; Lin, Zhoubin A promising ultrafast pulse laser crystal with a disordered structure: Yb3+:Sr3Gd2(BO3)4 CrystEngComm, 2017, 19, 1620 |
7227534 | CIF | C14 H28 N6 Ni O S3 | P n m a | 14.7144; 7.0324; 21.4403 90; 90; 90 | 2218.59 | González-García, Cristina; Mendiola, M. Antonia; Perles, Josefina; López-Torres, Elena Structural diversity and supramolecular architectures of Zn(ii), Cu(ii) and Ni(ii) complexes by selective control of the degree of deprotonation of diacetyl bis(4-isopropyl-3-thiosemicarbazone) CrystEngComm, 2017, 19, 1035 |
7227499 | CIF | Ba8 Ga2 Se18 Sn7 | P n m a | 12.466; 9.358; 18.136 90; 90; 90 | 2116 | Li, Yan-Yan; Wang, Jin-Qiu; Liu, Peng-Fei; Lin, Hua; Chen, Ling; Wu, Li-Ming Centrosymmetric to noncentrosymmetric structural transformation of new quaternary selenides induced by isolated dimeric [Sn2Se4] units: from Ba8Ga2Sn7Se18 to Ba10Ga2Sn9Se22 RSC Adv., 2017, 7, 8082 |
7227443 | CIF | C4 H6 Cl2 N2 Zn | P n m a | 12.7113; 9.9296; 6.5812 90; 90; 90 | 830.67 | Al-Khafaji, Yahya F.; Elsegood, Mark R. J.; Frese, Josef W. A.; Redshaw, Carl Ring opening polymerization of lactides and lactones by multimetallic alkyl zinc complexes derived from the acids Ph2C(X)CO2H (X = OH, NH2) RSC Adv., 2017, 7, 4510 |
7227106 | CIF | C3 H8 Fe N2 O6 | P n m a | 8.736; 11.763; 7.871 90; 90; 90 | 808.8 | Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP, 2016, 18, 31653-31663 |
7226708 | CIF | C15 H14 N3 O2 | P n m a | 26.012; 6.7475; 16.049 90; 90; 90 | 2816.9 | Feng, Haiyan; Wang, Tao; Chen, Songtao; Huang, Yangfei; Yu, Weijie; huang, yuanyuan; Xiong, Fei Copper-catalyzed [3+2] cycloaddition reaction: Synthesis of substituted pyrazolo[1,5-c]quinazolines with N-iminoquinazolinium ylide and olefin as starting materials RSC Adv., 2016 |
7226661 | CIF | C35 H31 N7 O6 S2 Sn | P n m a | 14.6879; 18.3871; 12.6439 90; 90; 90 | 3414.71 | Sousa-Pedrares, Antonio; Crespo, Augusto; Durán, María L.; García-Vázquez, José A. Directing effects of aminosulfonyl groups on the crystal packing of tin and lead complexes CrystEngComm, 2016, 18, 8419 |
7226597 | CIF | C10 H10 Br6 N2 Pb | P n m a | 8.2011; 24.015; 9.0459 90; 90; 90 | 1781.6 | Gómez, Verónica; Fuhr, Olaf; Ruben, Mario Structural diversity in substituted-pyridinium iodo- and bromoplumbates: a matter of halide and temperature CrystEngComm, 2016, 18, 8207 |
7226595 | CIF | C6 H8 I3 N Pb | P n m a | 7.9441; 10.5453; 15.663 90; 90; 90 | 1312.14 | Gómez, Verónica; Fuhr, Olaf; Ruben, Mario Structural diversity in substituted-pyridinium iodo- and bromoplumbates: a matter of halide and temperature CrystEngComm, 2016, 18, 8207 |
7226484 | CIF | C10 H17 K2 N O8 S2 | P n m a | 8.2498; 22.5592; 8.7439 90; 90; 90 | 1627.32 | Cardona, Maria A.; Kveder, Marina; Baisch, Ulrich; Probert, Michael R.; Magri, David C. Water-soluble β-aminobisulfonate building blocks for pH and Cu2+indicators RSC Adv., 2016, 6, 84712 |
7226392 | CIF | C9 H20 Ho2 O19 | P n m a | 12.0794; 8.0555; 20.207 90; 90; 90 | 1966.3 | Delgado, Fernando S.; Lorenzo-Luís, Pablo; Pasán, Jorge; Cañadillas-Delgado, Laura; Fabelo, Oscar; Hernández-Molina, María; Lozano-Gorrín, Antonio D.; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina Crystal growth and structural remarks on malonate-based lanthanide coordination polymers CrystEngComm, 2016, 18, 7831 |
7226352 | CIF | Co Li O4 P | P n m a | 10.1852; 5.9114; 4.6913 90; 90; 90 | 282.46 | Ludwig, Jennifer; Marino, Cyril; Haering, Dominik; Stinner, Christoph; Nordlund, Dennis; Doeff, Marca; Gasteiger, Hubert A.; Nilges, Tom Facile, ethylene glycol-promoted microwave-assisted solvothermal synthesis of high-performance LiCoPO4as a high-voltage cathode material for lithium-ion batteries RSC Adv., 2016 |
7226351 | CIF | Co Li O4 P | P n m a | 10.1931; 5.9195; 4.6961 90; 90; 90 | 283.35 | Ludwig, Jennifer; Marino, Cyril; Haering, Dominik; Stinner, Christoph; Nordlund, Dennis; Doeff, Marca; Gasteiger, Hubert A.; Nilges, Tom Facile, ethylene glycol-promoted microwave-assisted solvothermal synthesis of high-performance LiCoPO4as a high-voltage cathode material for lithium-ion batteries RSC Adv., 2016 |
7226350 | CIF | Co Li O4 P | P n m a | 10.193; 5.9188; 4.6959 90; 90; 90 | 283.31 | Ludwig, Jennifer; Marino, Cyril; Haering, Dominik; Stinner, Christoph; Nordlund, Dennis; Doeff, Marca; Gasteiger, Hubert A.; Nilges, Tom Facile, ethylene glycol-promoted microwave-assisted solvothermal synthesis of high-performance LiCoPO4as a high-voltage cathode material for lithium-ion batteries RSC Adv., 2016 |
7226283 | CIF | C74 H12 S6 | P n m a | 17.5533; 24.604; 9.7837 90; 90; 90 | 4225.4 | Sun, Yantao; Cui, Zili; Chen, Lichuan; Lu, Xiaofeng; Wu, Yuewei; Zhang, Haoli; Shao, Xiangfeng Aryl-Fused Tetrathianaphthalene (TTN): Synthesis, Structures, Properties, and Cocrystals with Fullerenes RSC Adv., 2016 |
7225978 | CIF | C6 H8 Cl N12 Zn2 | P n m a | 6.8924; 10.06; 19.7902 90; 90; 90 | 1372.2 | Wang, Duo-Zhi; Fan, Jian-Zhong; Jia, Dianzeng; Du, Ceng-Ceng Zinc and cadmium complexes based on bis-(1H-tetrazol-5-ylmethyl/ylethyl)-amine ligands: structures and photoluminescence properties CrystEngComm, 2016, 18, 6708 |
7225725 | CIF | C36 H41 Ag2 B N12 O42 W12 | P n m a | 26.664; 20.022; 12.937 90; 90; 90 | 6907 | Zhao, Chunyan; Li, Shaobin; Ma, Huiyuan; Zhang, Chunjing; Pang, Haijun; Yu, Yan; Zhang, Zhuanfang The factors affecting the assembly of Keggin‒metal‒bimb systems: charge/polarity of Keggin polyanions and coordination modes of metal cations CrystEngComm, 2016, 18, 6233 |
7225723 | CIF | C36 H38 Co2 N12 O42 W12 | P n m a | 26.548; 20.076; 12.964 90; 90; 90 | 6910 | Zhao, Chunyan; Li, Shaobin; Ma, Huiyuan; Zhang, Chunjing; Pang, Haijun; Yu, Yan; Zhang, Zhuanfang The factors affecting the assembly of Keggin‒metal‒bimb systems: charge/polarity of Keggin polyanions and coordination modes of metal cations CrystEngComm, 2016, 18, 6233 |
7225722 | CIF | C36 H34 B Co2 N12 O42 W12 | P n m a | 26.78; 19.963; 12.98 90; 90; 90 | 6939 | Zhao, Chunyan; Li, Shaobin; Ma, Huiyuan; Zhang, Chunjing; Pang, Haijun; Yu, Yan; Zhang, Zhuanfang The factors affecting the assembly of Keggin‒metal‒bimb systems: charge/polarity of Keggin polyanions and coordination modes of metal cations CrystEngComm, 2016, 18, 6233 |
7225721 | CIF | C36 H34 Co2 Ge N12 O42 W12 | P n m a | 26.8635; 20.0627; 13.1107 90; 90; 90 | 7066.1 | Zhao, Chunyan; Li, Shaobin; Ma, Huiyuan; Zhang, Chunjing; Pang, Haijun; Yu, Yan; Zhang, Zhuanfang The factors affecting the assembly of Keggin‒metal‒bimb systems: charge/polarity of Keggin polyanions and coordination modes of metal cations CrystEngComm, 2016, 18, 6233 |
7225449 | CIF | C50 H44 N4 Ni P2 S5 | P n m a | 26.52841; 25.85346; 7.00906 90; 90; 90 | 4807.17 | Aragoni, M. Carla; Arca, Massimiliano; Coles, Simon J.; Crespo Alonso, Miriam; Coles (née Huth), Susanne L.; Davies, Robert P.; Hursthouse, Michael B.; Isaia, Francesco; Lai, Romina; Lippolis, Vito Coordination polymers and polygons using di-pyridyl-thiadiazole spacers and substituted phosphorodithioato NiIIcomplexes: potential and limitations for inorganic crystal engineering CrystEngComm, 2016, 18, 5620 |
7225386 | CIF | C21 H16 Cu N4 O12 | P n m a | 9.4; 19.5102; 14.7022 90; 90; 90 | 2696.32 | Linder-Patton, Oliver M.; Bloch, Witold M.; Coghlan, Campbell J.; Sumida, Kenji; Kitagawa, Susumu; Furukawa, Shuhei; Doonan, Christian J.; Sumby, Christopher J. Particle size effects in the kinetic trapping of a structurally-locked form of a flexible MOF CrystEngComm, 2016, 18, 4172 |
7225385 | CIF | C30 H34 Cu N4 O8 | P n m a | 10.2536; 19.8774; 14.8763 90; 90; 90 | 3032.01 | Linder-Patton, Oliver M.; Bloch, Witold M.; Coghlan, Campbell J.; Sumida, Kenji; Kitagawa, Susumu; Furukawa, Shuhei; Doonan, Christian J.; Sumby, Christopher J. Particle size effects in the kinetic trapping of a structurally-locked form of a flexible MOF CrystEngComm, 2016, 18, 4172 |
7225379 | CIF | C2 H Cl5 | P n m a | 10.21; 11.039; 6.0415 90; 90; 90 | 680.9 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Halogen and hydrogen bonds in compressed pentachloroethane CrystEngComm, 2016, 18, 5393 |
7225378 | CIF | C2 H Cl5 | P n m a | 10.325; 11.063; 6.087 90; 90; 90 | 695.3 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Halogen and hydrogen bonds in compressed pentachloroethane CrystEngComm, 2016, 18, 5393 |
7225322 | CIF | Cl Co H15 N7 O5 | P n m a | 14.896; 7.3587; 9.6062 90; 90; 90 | 1053 | Sidelnikov, A. A.; Chizhik, S. A.; Zakharov, B. A.; Chupakhin, A. P.; Boldyreva, E. V. The effect of thermal expansion on photoisomerisation in the crystals of [Co(NH3)5NO2]Cl(NO3): different strain origins ‒ different outcomes CrystEngComm, 2016, 18, 7276 |
7225321 | CIF | Cl Co H15 N7 O5 | P n m a | 14.881; 7.3506; 9.6096 90; 90; 90 | 1051.1 | Sidelnikov, A. A.; Chizhik, S. A.; Zakharov, B. A.; Chupakhin, A. P.; Boldyreva, E. V. The effect of thermal expansion on photoisomerisation in the crystals of [Co(NH3)5NO2]Cl(NO3): different strain origins ‒ different outcomes CrystEngComm, 2016, 18, 7276 |
7225320 | CIF | Cl Co H15 N7 O5 | P n m a | 14.877; 7.3463; 9.6072 90; 90; 90 | 1050 | Sidelnikov, A. A.; Chizhik, S. A.; Zakharov, B. A.; Chupakhin, A. P.; Boldyreva, E. V. The effect of thermal expansion on photoisomerisation in the crystals of [Co(NH3)5NO2]Cl(NO3): different strain origins ‒ different outcomes CrystEngComm, 2016, 18, 7276 |
7225319 | CIF | Cl Co H15 N7 O5 | P n m a | 14.872; 7.3394; 9.6071 90; 90; 90 | 1048.6 | Sidelnikov, A. A.; Chizhik, S. A.; Zakharov, B. A.; Chupakhin, A. P.; Boldyreva, E. V. The effect of thermal expansion on photoisomerisation in the crystals of [Co(NH3)5NO2]Cl(NO3): different strain origins ‒ different outcomes CrystEngComm, 2016, 18, 7276 |
7225318 | CIF | Cl Co H15 N7 O5 | P n m a | 14.86; 7.3294; 9.6098 90; 90; 90 | 1046.7 | Sidelnikov, A. A.; Chizhik, S. A.; Zakharov, B. A.; Chupakhin, A. P.; Boldyreva, E. V. The effect of thermal expansion on photoisomerisation in the crystals of [Co(NH3)5NO2]Cl(NO3): different strain origins ‒ different outcomes CrystEngComm, 2016, 18, 7276 |
7225317 | CIF | Cl Co H15 N7 O5 | P n m a | 14.851; 7.3236; 9.609 90; 90; 90 | 1045.1 | Sidelnikov, A. A.; Chizhik, S. A.; Zakharov, B. A.; Chupakhin, A. P.; Boldyreva, E. V. The effect of thermal expansion on photoisomerisation in the crystals of [Co(NH3)5NO2]Cl(NO3): different strain origins ‒ different outcomes CrystEngComm, 2016, 18, 7276 |
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