Crystallography Open Database
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COD ID  |
Links | Formula |
Space group  |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1566058 | CIF | C20 H12 N Na Ni O7 | A e a 2 | 27.0821; 25.8325; 5.97853 90; 90; 90 | 4182.57 | Yin, Meng-Ru; Yan, Qing-Qing; Li, Bin; Yong, Guo-Ping Syntheses, structures, luminescence and CO2 gas adsorption properties of four three-dimensional heterobimetallic metal–organic frameworks Journal of Solid State Chemistry, 2022, 305, 122672 |
| 1575557 | CIF | C25 H18 F N O2 | A e a 2 | 19.6637; 25.8655; 7.351 90; 90; 90 | 3738.8 | Liu, Hao; Scott, Harrison M.; Lin, Binzhou; Huang, Xiaolong; Smith, Mark D.; Shimizu, Ken D. Solvent attenuation of dispersion interactions quantified in polar and nonpolar media using rigid CH-π balances. Chemical science, 2025, 16, 17772-17778 |
| 1575593 | CIF | C19 H20.63 N2 O4.31 Zn | A e a 2 | 18.6825; 18.8344; 10.41 90; 90; 90 | 3663 | Jaramillo-García, Jonathan; Sánchez-Mendieta, Víctor; Rosales-Vázquez, Luis D; Morales-Lukie, Raúl A; Martínez-Otero, Diego; German-Acacio, Juan M; Pinzón-Vanegas, Cristian; León-Gómez, Juan Pablo; Dorazco-González, Alejandro Zn-cycloalkyldicarboxylate 2D-coordination polymers bearing 4,4'-trimethylenebipyridine: crystal structures, solid state CPMAS <sup>13</sup>C NMR structural correlations and luminescence sensing of ethanol. Dalton transactions (Cambridge, England : 2003), 2025, 54, 14763-14778 |
| 1575595 | CIF | C19 H20.63 N2 O4.31 Zn | A e a 2 | 18.6825; 18.8344; 10.41 90; 90; 90 | 3663 | Jaramillo-García, Jonathan; Sánchez-Mendieta, Víctor; Rosales-Vázquez, Luis D; Morales-Lukie, Raúl A; Martínez-Otero, Diego; German-Acacio, Juan M; Pinzón-Vanegas, Cristian; León-Gómez, Juan Pablo; Dorazco-González, Alejandro Zn-cycloalkyldicarboxylate 2D-coordination polymers bearing 4,4'-trimethylenebipyridine: crystal structures, solid state CPMAS <sup>13</sup>C NMR structural correlations and luminescence sensing of ethanol. Dalton transactions (Cambridge, England : 2003), 2025, 54, 14763-14778 |
| 1575964 | CIF | C18 H11 N Se | A e a 2 | 16.3563; 20.6009; 7.9397 90; 90; 90 | 2675.3 | Wang, Zetian; Li, Ting; Song, Yongjun; Zhuang, Dajun; Yang, Sen; He, Lei Over 260-fold enhancement of reverse intersystem crossing by a host-guest exciplex for a multiple resonance emitter toward efficient narrowband electroluminescence. Chemical science, 2025, 16, 21068-21078 |
| 2020381 | CIF | B5 H8 O12 Rb | A e a 2 | 11.302; 10.962; 9.335 90; 90; 90 | 1156.54 | Behm, H. Rubidium Pentaborate Tetrahydrate, Rb (B5 O6 (O H)4) (H2 O)2 Acta Crystallographica C (39,1983-), 1984, 40, 217-220 |
| 2023344 | CIF Paper | C H4 N4 O7 Sr | A e a 2 | 9.3527; 9.9701; 17.0496 90; 90; 90 | 1589.83 | Bektursinova, Aysanem; Djumanazarova, Zulfiya; Uzakbergenova, Zamira; Ashurov, Jamshid; Khan, Akram A.; Kadirova, Shakhnoza; Torambetov, Batirbay Synthesis, crystal structure and Hirshfeld surface analysis of [Sr(urea)(NO3)2] n Acta Crystallographica Section E Crystallographic Communications, 2025, 81 |
| 2023425 | CIF | Ca H2 O6 Sn2 | A e a 2 | 5.8502; 15.1396; 5.4376 90; 90; 90 | 481.61 | Bogdan, Tatiana V.; Ivakin, Yurii D.; Chernyshev, Vladimir V.; Mashchenko, Nikolay V.; Koklin, Aleksey E.; Tararushkin, Evgeny V.; Fedoseev, Timofei V.; Skiba, Mariia A.; Bogdan, Viktor I. A new crystal phase of calcium stannate CaSn2O4(OH)2 and its physico-chemical properties Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2025, 81 |
| 2106226 | CIF | C H3 Na2 O6 | A e a 2 | 9.224; 15.805; 6.747 90; 90; 90 | 983.614 | Adams, J.M.; Pritchard, R.G. The crystal structure of sodium percarbonate: An unusual layered solid Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3650-3653 |
| 2243731 | CIF HKL Paper | C26 H22 Cd N8 O4 | A e a 2 | 12.6654; 17.6394; 10.888 90; 90; 90 | 2432.49 | Yang, Ping; Xie, Xiao-Bao; Shi, Qing-Shan Crystal structure of bis{2-hydroxy-<i>N</i>'-[1-(pyrazin-2-yl)ethylidene]benzohydrazidato}cadmium(II) Acta Crystallographica Section E, 2021, 77, 153-157 |
| 2244196 | CIF HKL Paper | C38 H38 Fe N12 O2 | A e a 2 | 12.6854; 26.315; 10.6511 90; 90; 90 | 3555.5 | Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu; Seredyuk, Maksym Crystal structure of bis{3-(3,4-dimethylphenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-4<i>H</i>-1,2,4-triazol-4-ido}iron(II) methanol disolvate Acta Crystallographica Section E, 2022, 78 |
| 2311212 | CIF Paper | C12 H16 Cl2 N4 O4 S2 Zn | A e a 2 | 7.7957; 27.916; 8.2701 90; 90; 90 | 1799.8 | Benmebarek, Sabrina; Boudraa, Mhamed; Bouacida, Sofiane; Merazig, Hocine; Dénès, George Bis(4-amino-benzene-sulfonamide-κN (4))di-chlorido-zinc. Acta crystallographica. Section E, Structure reports online, 2014, 70, m28-9 |
| 2311292 | CIF Paper | C7 H10 N O1.5 | A e a 2 | 12.4859; 14.3697; 7.732 90; 90; 90 | 1387.3 | Nguyen, Dalena M.; Desikan, Vasumathi; Golen, James A.; Manke, David R. Crystal structure of 2,6-dimethyl-4-pyridone hemihydrate. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o533 |
| 2311312 | CIF | C14 H13 N O3 | A e a 2 | 15.337; 21.94; 6.808 90; 90; 90 | 2290.8 | Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Borges, Fernanda A comparison of the structures of some 2- and 3-substituted chromone derivatives: a structural study on the importance of the secondary carboxamide backbone for the inhibitory activity of MAO-B. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1270-1277 |
| 2311859 | CIF Paper | C17 H10 O S2 | A e a 2 | 18.2186; 20.0166; 7.2534 90; 90; 90 | 2645.13 | Katzsch, Felix; Gruber, Tobias; Weber, Edwin Crystal structures of functional building blocks derived from bis(benzo[b]thiophen-2-yl)methane. Acta crystallographica. Section C, Structural chemistry, 2016, 72, 679-684 |
| 2311868 | CIF | C28 H28 F6 Li N4 P | A e a 2 | 24.725; 14.7026; 15.8325 90; 90; 90 | 5755.5 | Jalil, AbdelAziz; Clymer, Rebecca N.; Hamilton, Clifton R.; Vaddypally, Shivaiah; Gau, Michael R.; Zdilla, Michael J. Structure of salts of lithium chloride and lithium hexafluorophosphate as solvates with pyridine and vinylpyridine and structural comparisons: (C<sub>5</sub>H<sub>5</sub>N)LiPF<sub>6</sub>, [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]LiPF<sub>6</sub>, [(C<sub>5</sub>H<sub>5</sub>N)LiCl]<sub>n</sub>, and [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>Li(μ-Cl)<sub>2</sub>Li[p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>. Acta crystallographica. Section C, Structural chemistry, 2017, 73, 264-269 |
| 3500083 | CIF HKL | C24 H52 I N | A e a 2 | 10.0773; 10.0124; 26.219 90; 90; 90 | 2645.4 | Thierry Maris Tetrahexylammonium Iodide Personal communication to COD, 2019 |
| 3500084 | CIF HKL | C28 H60 Br N | A e a 2 | 9.787; 9.7825; 31.3951 90; 90; 90 | 3005.8 | Thierry Maris Tetraheptylammonium bromide Personal communication to COD, 2019 |
| 4003704 | CIF | Ba F2 Mo2 O10 Se2 | A e a 2 | 12.3556; 11.0024; 7.2861 90; 90; 90 | 990.48 | Liang, Ming-Li; Ma, Yun-Xiang; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao Ba(MoO2F)2(QO3)2 (Q = Se, Te): Partial Fluorination of MoO6 Octahedra Enabling Two Polar Solids with Strong and Phase Matchable SHG Response Chemistry of Materials, 2020, 32, 9688-9695 |
| 4003705 | CIF | Ba F2 Mo2 O10 Te2 | A e a 2 | 12.5605; 11.0264; 7.2858 90; 90; 90 | 1009.06 | Liang, Ming-Li; Ma, Yun-Xiang; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao Ba(MoO2F)2(QO3)2 (Q = Se, Te): Partial Fluorination of MoO6 Octahedra Enabling Two Polar Solids with Strong and Phase Matchable SHG Response Chemistry of Materials, 2020, 32, 9688-9695 |
| 4004025 | CIF | Hg3 P2 S8 | A e a 2 | 16.52; 8.223; 9.293 90; 90; 90 | 1262 | Chu, Yu; Wang, Peng; Zeng, Hao; Cheng, Shichao; Su, Xin; Yang, Zhihua; Li, Junjie; Pan, Shilie Hg3P2S8: A New Promising Infrared Nonlinear Optical Material with a Large Second-Harmonic Generation and a High Laser-Induced Damage Threshold Chemistry of Materials, 2021, 33, 6514-6521 |
| 4021104 | CIF | C18 H16 | A e a 2 | 10.625; 17.084; 7.5931 90; 90; 90 | 1378.2 | Gon-Ann Lee; Chih-Yi Chang Novel Ene Trimerization of 1-Phenylcyclopropene Journal of Organic Chemistry, 2004, 69, 8949-8951 |
| 4033826 | CIF | C17 H22 N2 O4 S2 | A e a 2 | 12.1657; 17.8449; 8.3153 90; 90; 90 | 1805.22 | Taschner, Ian S.; Walker, Tia L.; DeHaan, Hunter S.; Schrage, Briana R.; Ziegler, Christopher J.; Taschner, Michael J. Synthesis, Characterization, and Copper(II) Chelates of 1,11-Dithia-4,8-diazacyclotetradecane. The Journal of organic chemistry, 2019, 84, 11091-11102 |
| 4036001 | CIF | C32 H20 Br2 O2 | A e a 2 | 11.2662; 15.6756; 14.1746 90; 90; 90 | 2503.3 | Gawade, Prashant M.; Khose, Vaibhav N.; Badani, Purav M.; Hasan, Mohammed; Kaabel, Sandra; Mobin, Shaikh M.; Borovkov, Victor; Karnik, Anil V. Benzyne-Mediated Nonconcerted Pathway toward Synthesis of Sterically Crowded [5]- and [7]Oxahelicenoids, Stereochemical and Theoretical Studies, and Optical Resolution of Helicenoids. The Journal of organic chemistry, 2019, 84, 860-868 |
| 4061840 | CIF | C8 H20 N2 O2 Sn | A e a 2 | 11.7705; 10.1142; 10.061 90; 90; 90 | 1197.8 | Zemlyansky, Nikolay N.; Borisova, Irina V.; Kuznetsova, Marianna G.; Khrustalev, Victor N.; Ustynyuk, Yuri A.; Nechaev, Mikhael S.; Lunin, Valery V.; Barrau, Jacques; Rima, Ghassoub New Stable Germylenes, Stannylenes, and Related Compounds. 1. Stable Germanium(II) and Tin(II) Compounds M(OCH~2~CH~2~NMe~2~)~2~ (M = Ge, Sn) with Intramolecular Coordination Metal–Nitrogen Bonds. Synthesis and Structure Organometallics, 2003, 22, 1675-1681 |
| 4062039 | CIF | C64 H80 Fe4 N8 O2 | A e a 2 | 20.552; 19.537; 14.2842 90; 90; 90 | 5735.4 | Organometallics, 2003 |
| 4062040 | CIF | C64 H80 Co2 Fe2 N8 O2 | A e a 2 | 20.78; 19.5453; 14.2942 90; 90; 90 | 5805.6 | Organometallics, 2003 |
| 4065373 | CIF | B5 H12 N O12 | A e a 2 | 11.304; 11.02; 9.152 90; 90; 90 | 1140.1 | Fortman, George C.; Slawin, Alexandra M. Z.; Nolan, Steven P. Highly Active Iridium(III)–NHC System for the Catalytic B–N Bond Activation and Subsequent Solvolysis of Ammonia–Borane Organometallics, 2011, 30, 5487 |
| 4066662 | CIF | C18 H3 B F12 | A e a 2 | 8.9262; 17.7039; 10.453 90; 90; 90 | 1651.87 | Ullrich, Matthias; Lough, Alan J.; Stephan, Douglas W. Dihydrogen Activation by B(p-C6F4H)3and Phosphines Organometallics, 2010, 29, 3647 |
| 4074421 | CIF | C16 H34 Cl2 N4 O2 Si | A e a 2 | 8.994; 21.354; 11.089 90; 90; 90 | 2129.7 | Gostevskii, Boris; Zamstein, Noa; Korlyukov, Alexander A.; Baukov, Yuri I.; Botoshansky, Mark; Kaftory, Menahem; Kocher, Nikolaus; Stalke, Dietmar; Kalikhman, Inna; Kost, Daniel Donor-Stabilized Silyl Cations. 11. Bis-Zwitterionic Penta- and Hexacoordinate Silicon Dichelate Complexes Derived from (ClCH2)2SiCl2through Double Internal Displacement of Chloride1 Organometallics, 2006, 25, 5416 |
| 4087434 | CIF | C24 H38 F6 Fe2 P S3 | A e a 2 | 18.018; 20.18; 15.868 90; 90; 90 | 5770 | Li, Ying; Zhang, Yahui; Yang, Dawei; Li, Yang; Sun, Puhua; Wang, Baomin; Qu, Jingping Synthesis and Reactivity of Thioether-Dithiolate-Bridged Multi-iron Complexes Organometallics, 2015, 34, 1661 |
| 4088708 | CIF | C36 H47.5 Ir N P2 | A e a 2 | 16.455; 28.172; 28.44 90; 90; 90 | 13184 | Vilanova, Sean P.; Iluc, Vlad M. Aryl and Benzyl C‒H Activation of N-Substituted PNP Ligands Organometallics, 2016, 35, 2110 |
| 4089688 | CIF | C27 H28 Cl N O5 Ru S | A e a 2 | 17.094; 17.4204; 17.4423 90; 90; 90 | 5194 | Aman, Farhana; Hanif, Muhammad; Siddiqui, Waseeq Ahmad; Ashraf, Adnan; Filak, Lukas K.; Reynisson, Jóhannes; Söhnel, Tilo; Jamieson, Stephen M. F.; Hartinger, Christian G. Anticancer Ruthenium(η6-p-cymene) Complexes of Nonsteroidal Anti-inflammatory Drug Derivatives Organometallics, 2014, 33, 5546 |
| 4110987 | CIF | C120 H160 Al6 Cl12 N4 O22 | A e a 2 | 27.854; 25.16; 18.562 90; 90; 90 | 13008 | Weiping Su; Youngjo Kim; Arkady Ellern; Ilia A. Guzei; John G. Verkade Facile Synthesis of Monomeric Alumatranes Journal of the American Chemical Society, 2006, 128, 13727-13735 |
| 4118230 | CIF | C78 H102 Co3 N13 O2 | A e a 2 | 29.641; 22.626; 10.566 90; 90; 90 | 7086 | Julia Kozhukh; Stephen J. Lippard Influence of Tetraazamacrocyclic Ligands on the Nitric Oxide Reactivity of their Cobalt(II) Complexes Journal of the American Chemical Society, 2012, 134, 11120-11123 |
| 4124996 | CIF | C84 H86 B F20 Li N4 Si2 | A e a 2 | 21.7127; 29.2279; 26.0364 90; 90; 90 | 16523.1 | Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C. Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry. Journal of the American Chemical Society, 2016, 138, 4589-4600 |
| 4127247 | CIF | C16 H16 N2 O2 | A e a 2 | 21.686; 17.836; 7.2977 90; 90; 90 | 2822.7 | Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society, 2019, 141, 8364-8371 |
| 4129594 | CIF | C27 H31 Co N2 | A e a 2 | 16.0692; 16.4154; 8.581 90; 90; 90 | 2263.5 | Chen, Chi; Hecht, Maxwell B.; Kavara, Aydin; Brennessel, William W.; Mercado, Brandon Q.; Weix, Daniel J.; Holland, Patrick L. Rapid, Regioconvergent, Solvent-Free Alkene Hydrosilylation with a Cobalt Catalyst. Journal of the American Chemical Society, 2015, 137, 13244-13247 |
| 4131240 | CIF | C6 H18 Br4 N2 Pb | A e a 2 | 41.685; 23.962; 12 90; 90; 90 | 11986 | Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Wasielewski, Michael R.; Kanatzidis, Mercouri G. White-Light Emission and Structural Distortion in New Corrugated Two-Dimensional Lead Bromide Perovskites. Journal of the American Chemical Society, 2017, 139, 5210-5215 |
| 4131953 | CIF | C24 H26 N2 O7 | A e a 2 | 13.6713; 37.374; 8.2094 90; 90; 90 | 4194.6 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131995 | CIF | C12 H7 F3 N2 | A e a 2 | 14.047; 14.609; 10.026 90; 90; 90 | 2057.5 | Kobayashi, Kensuke; Horiuchi, Sachio; Ishibashi, Shoji; Murakami, Youichi; Kumai, Reiji Field-Induced Antipolar-Polar Structural Transformation and Giant Electrostriction in Organic Crystal. Journal of the American Chemical Society, 2018, 140, 3842-3845 |
| 4134273 | CIF | C10 H20 F4 I4 N2 Pb | A e a 2 | 9.2974; 25.1758; 8.9611 90; 90; 90 | 2097.52 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4134277 | CIF | C10 H20 F4 I4 N2 Pb | A e a 2 | 9.2541; 25.0703; 8.9483 90; 90; 90 | 2076.03 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4134282 | CIF | C10 H20 F4 I4 N2 Pb | A e a 2 | 9.3456; 25.3587; 9.0113 90; 90; 90 | 2135.61 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4301104 | CIF | C84 H132 Cu4 N8 O20 P4 | A e a 2 | 17.8321; 26.9021; 19.4751 90; 90; 90 | 9342.6 | Ramaswamy Murugavel; Subramaniam Kuppuswamy; Amarendra Nath Maity; Mayank Pratap Singh Di-, Tri-, Tetra-, and Hexanuclear Copper(II) Mono-organophosphates: Structure and Nuclearity Dependence on the Choice of Phosphorus Substituents and Auxiliary N-Donor Ligands Inorganic Chemistry, 2009, 48, 183-192 |
| 4304029 | CIF | C58 H72 Cu2 N4 O4 | A e a 2 | 13.677; 34.017; 10.88 90; 90; 90 | 5062 | Atasi Mukherjee; Francesc Lloret; Rabindranath Mukherjee Synthesis and Properties of Diphenoxo-Bridged CoII, NiII, CuII, and ZnII Complexes of a New Tripodal Ligand: Generation and Properties of MII-Coordinated Phenoxyl Radical Species Inorganic Chemistry, 2008, 47, 4471-4480 |
| 4310628 | CIF | C28 H20 Cu N6 | A e a 2 | 8.9282; 8.915; 28.113 90; 90; 90 | 2237.7 | Sara R. Halper; Mitchell R. Malachowski; Heather M. Delaney; Seth M. Cohen Heteroleptic Copper Dipyrromethene Complexes: Synthesis, Structure, and Coordination Polymers Inorganic Chemistry, 2004, 43, 1242-1249 |
| 4311428 | CIF | C16 H30 Cl2 Cu2 N6 | A e a 2 | 16.8277; 12.2576; 9.7062 90; 90; 90 | 2002.07 | Sarah H. Oakley; Martyn P. Coles; Peter B. Hitchcock Structural Consequences of the Prohibition of Hydrogen Bonding in Copper-Guanidine Systems Inorganic Chemistry, 2004, 43, 5168-5172 |
| 4312581 | CIF | C20 H42 Fe N4 | A e a 2 | 14.6874; 13.9418; 11.7564 90; 90; 90 | 2407.3 | Booyong S. Lim; Antti Rahtu; Jin-Seong Park; Roy G. Gordon Synthesis and Characterization of Volatile, Thermally Stable, Reactive Transition Metal Amidinates Inorganic Chemistry, 2003, 42, 7951-7958 |
| 4314054 | CIF | C72 H84 K4 O8 | A e a 2 | 18.178; 19.511; 19.055 90; 90; 90 | 6758.3 | Timothy J. Boyle; Nicholas L. Andrews; Mark A. Rodriguez; Charles Campana; Timothy Yiu Structural Variations of Potassium Aryloxides Inorganic Chemistry, 2003, 42, 5357-5366 |
| 4315821 | CIF | C90 H174 Er2 N12 S2 Si8 | A e a 2 | 19.613; 21.093; 29.578 90; 90; 90 | 12236 | Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides Inorganic Chemistry, 2010, 49, 5715-5722 |
| 4315824 | CIF | C84 H178 Er2 N12 S2 Si8 | A e a 2 | 19.325; 20.926; 29.977 90; 90; 90 | 12123 | Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides Inorganic Chemistry, 2010, 49, 5715-5722 |
| 4315826 | CIF | C84 H178 N12 S2 Si8 Yb2 | A e a 2 | 19.462; 21.004; 29.844 90; 90; 90 | 12200 | Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides Inorganic Chemistry, 2010, 49, 5715-5722 |
| 4315827 | CIF | C84 H178 N12 S2 Si8 Y2 | A e a 2 | 19.299; 20.872; 30.127 90; 90; 90 | 12135 | Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides Inorganic Chemistry, 2010, 49, 5715-5722 |
| 4315828 | CIF | C88 H170 Er2 N12 S2 Si8 | A e a 2 | 19.329; 21.163; 29.585 90; 90; 90 | 12102 | Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides Inorganic Chemistry, 2010, 49, 5715-5722 |
| 4315829 | CIF | C88 H170 N12 S2 Si8 Yb2 | A e a 2 | 19.327; 21.14; 29.528 90; 90; 90 | 12064 | Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides Inorganic Chemistry, 2010, 49, 5715-5722 |
| 4332295 | CIF | C26 H24 I4 P2 | A e a 2 | 15.2158; 15.2876; 12.3342 90; 90; 90 | 2869.1 | Ellis, Bobby D.; Macdonald, Charles L. B. Phosphorus(I) Iodide: A Versatile Metathesis Reagent for the Synthesis of Low Oxidation State Phosphorus Compounds Inorganic Chemistry, 2006, 45, 6864-6874 |
| 4334168 | CIF | C41 H45 N3 O5 P2 | A e a 2 | 22.2182; 15.4755; 10.8569 90; 90; 90 | 3733 | Daniel Rosario-Amorin; Sabrina Ouizem; Diane A. Dickie; Yufeng Wen; Robert T. Paine; Jian Gao; John K. Grey; Ana de Bettencourt-Dias; Benjamin P. Hay; Laetitia H. Delmau Synthesis, Lanthanide Coordination Chemistry, and Liquid-Liquid Extraction Performance of CMPO-Decorated Pyridine and Pyridine N-Oxide Platforms Inorganic Chemistry, 2013, 52, 3063-3083 |
| 4334169 | CIF | C41 H45 N3 O5 P2 | A e a 2 | 22.2568; 15.4841; 10.8479 90; 90; 90 | 3738.5 | Daniel Rosario-Amorin; Sabrina Ouizem; Diane A. Dickie; Yufeng Wen; Robert T. Paine; Jian Gao; John K. Grey; Ana de Bettencourt-Dias; Benjamin P. Hay; Laetitia H. Delmau Synthesis, Lanthanide Coordination Chemistry, and Liquid-Liquid Extraction Performance of CMPO-Decorated Pyridine and Pyridine N-Oxide Platforms Inorganic Chemistry, 2013, 52, 3063-3083 |
| 4339669 | CIF | C36 H50 Ce3 Mn2 N6 O30 | A e a 2 | 22.6707; 14.8735; 15.7286 90; 90; 90 | 5303.6 | Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters. Inorganic chemistry, 2007, 46, 9678-9691 |
| 4342868 | CIF | C62 H56 Cl4 Er N7 O11 | A e a 2 | 18.705; 14.048; 23.527 90; 90; 90 | 6182.1 | Zhang, Kun; Zhang, Lei; Zhang, Song; Hu, Yong; Zheng, Youxuan; Huang, Wei Construction of Identical [2 + 2] Schiff-Base Macrocyclic Ligands by Ln(III) and Zn(II) Template Ions Including Efficient Yb(III) Near-Infrared Sensitizers. Inorganic chemistry, 2015, 54, 5295-5300 |
| 4342869 | CIF | C62 H56 Cl4 N7 O11 Yb | A e a 2 | 18.705; 14.048; 23.527 90; 90; 90 | 6182.1 | Zhang, Kun; Zhang, Lei; Zhang, Song; Hu, Yong; Zheng, Youxuan; Huang, Wei Construction of Identical [2 + 2] Schiff-Base Macrocyclic Ligands by Ln(III) and Zn(II) Template Ions Including Efficient Yb(III) Near-Infrared Sensitizers. Inorganic chemistry, 2015, 54, 5295-5300 |
| 4344458 | CIF | C23 H20 B12 Co2 F12 O | A e a 2 | 19.6; 19.585; 16.583 90; 90; 90 | 6366 | Malischewski, Moritz; Bukovsky, Eric V.; Strauss, Steven H.; Seppelt, Konrad Jahn-Teller Effect in the B12F12 Radical Anion and Energetic Preference of an Octahedral B6(BF2)6 Cluster Structure over an Icosahedral Structure for the Elusive Neutral B12F12. Inorganic chemistry, 2015, 54, 11563-11566 |
| 4346149 | CIF | C18 H22 Fe N6 Se2 | A e a 2 | 13.2; 17.8552; 9.0813 90; 90; 90 | 2140.4 | Luan, Jie; Zhou, Jian; Liu, Zhan; Zhu, Bowen; Wang, Huisi; Bao, Xin; Liu, Wei; Tong, Ming-Liang; Peng, Guo; Peng, Haonan; Salmon, Lionel; Bousseksou, Azzedine Polymorphism-Dependent Spin-Crossover: Hysteretic Two-Step Spin Transition with an Ordered [HS-HS-LS] Intermediate Phase. Inorganic chemistry, 2015, 54, 5145-5147 |
| 4346150 | CIF | C18 H22 Fe N6 Se2 | A e a 2 | 39.457; 17.701; 8.9839 90; 90; 90 | 6274.6 | Luan, Jie; Zhou, Jian; Liu, Zhan; Zhu, Bowen; Wang, Huisi; Bao, Xin; Liu, Wei; Tong, Ming-Liang; Peng, Guo; Peng, Haonan; Salmon, Lionel; Bousseksou, Azzedine Polymorphism-Dependent Spin-Crossover: Hysteretic Two-Step Spin Transition with an Ordered [HS-HS-LS] Intermediate Phase. Inorganic chemistry, 2015, 54, 5145-5147 |
| 4346342 | CIF | C52 H68 Co2 N46 O35 | A e a 2 | 17.9725; 32.179; 15.7563 90; 90; 90 | 9112 | Myers, Thomas W.; Chavez, David E.; Hanson, Susan K.; Scharff, R. Jason; Scott, Brian L.; Veauthier, Jacqueline M.; Wu, Ruilian Independent Control of Optical and Explosive Properties: Pyrazole-Tetrazine Complexes of First Row Transition Metals. Inorganic chemistry, 2015, 54, 8077-8086 |
| 4347097 | CIF | C62 H60 Au2 Br2 N8 O2 | A e a 2 | 19.9551; 20.196; 27.3545 90; 90; 90 | 11024.2 | Penney, Alexander A.; Sizov, Vladimir V.; Grachova, Elena V.; Krupenya, Dmitry V.; Gurzhiy, Vladislav V.; Starova, Galina L.; Tunik, Sergey P. Aurophilicity in Action: Fine-Tuning the Gold(I)-Gold(I) Distance in the Excited State To Modulate the Emission in a Series of Dinuclear Homoleptic Gold(I)-NHC Complexes. Inorganic chemistry, 2016, 55, 4720-4732 |
| 4347106 | CIF | C48 H50 Br4 N6 P2 Pd2 | A e a 2 | 17.937; 25.291; 13.2153 90; 90; 90 | 5995.1 | Kumar, Anuj; Gangwar, Manoj Kumar; Prakasham, A. P.; Mhatre, Darshan; Kalita, Alok Ch; Ghosh, Prasenjit Accessing a Biologically Relevant Benzofuran Skeleton by a One-Pot Tandem Heck Alkynylation/Cyclization Reaction Using Well-Defined Palladium N-Heterocyclic Carbene Complexes. Inorganic chemistry, 2016, 55, 2882-2893 |
| 4347508 | CIF | C36 H20 Fe N10 S4 | A e a 2 | 12.7935; 26.6085; 9.9374 90; 90; 90 | 3382.8 | Yang, Qian; Gao, Chen; Wang, Ye-Xin; Wang, Bing-Wu; Wang, Zhe-Ming; Gao, Song Two Magnetic Switching Complexes Based on the Fe(II) Ion. Inorganic chemistry, 2016, 55, 7805-7807 |
| 4347509 | CIF | C36 H20 Fe N10 S4 | A e a 2 | 13.402; 26.5439; 9.5831 90; 90; 90 | 3409.1 | Yang, Qian; Gao, Chen; Wang, Ye-Xin; Wang, Bing-Wu; Wang, Zhe-Ming; Gao, Song Two Magnetic Switching Complexes Based on the Fe(II) Ion. Inorganic chemistry, 2016, 55, 7805-7807 |
| 4349276 | CIF | C113 H88 O18 Ru8 S2 | A e a 2 | 31.004; 28.866; 22.39 90; 90; 90 | 20038 | Białek, Michał J; Sprutta, Natasza; Latos-Grażyński, Lechosław Coordination-Induced Molecular Tweezing: Ruthenium Clusters Docked at Azuliporphyrinogens. Inorganic chemistry, 2016, 55, 12061-12073 |
| 4349728 | CIF | C4 H16 Bi Cl5 N2 | A e a 2 | 17.5405; 21.767; 7.47911 90; 90; 90 | 2855.55 | Piecha-Bisiorek, Anna; Gągor, Anna; Jakubas, Ryszard; Ciżman, Agnieszka; Janicki, Rafał; Medycki, Wojciech Ferroelectricity in bis(ethylammonium) pentachlorobismuthate(iii): synthesis, structure, polar and spectroscopic properties Inorganic Chemistry Frontiers, 2017, 4, 1281 |
| 4349730 | CIF | C10 H28 Cd Cl4 N2 | A e a 2 | 7.45; 33.85; 7.42 90; 90; 90 | 1871 | Wang, Zhongxia; Lv, Xing-Hui; Liu, Yu-Ling; Lu, Yang; Chen, Hai-Peng; Ge, Jia-Zhen Prominent dielectric transitions in layered organic‒inorganic hybrids: (isoamyl-ammonium)2CdX4 (X = Cl and Br) Inorganic Chemistry Frontiers, 2017, 4, 1330 |
| 4350049 | CIF | C26 H26 Fe N6 S2 | A e a 2 | 15.7067; 18.4252; 8.8199 90; 90; 90 | 2552.5 | Chen, Xiu-Qin; Cai, You-De; Ye, Yi-Shan; Tong, Ming-Liang; Bao, Xin Investigation of SCO property–structural relationships in a family of mononuclear Fe(ii) complexes Inorganic Chemistry Frontiers, 2019, 6, 2194 |
| 4350180 | CIF | C16 H37 Gd1.5 N12.5 O17 Ru2 | A e a 2 | 25.1267; 22.1514; 13.6062 90; 90; 90 | 7573.1 | Herrera, Juan-Manuel; Pope, Simon J. A.; Adams, Harry; Faulkner, Stephen; Ward, Michael D. Structural and photophysical properties of coordination networks combining [Ru(Bpym)(CN)4]2- or [[Ru(CN)4]2(mu-bpym)]4- anions (bpym = 2,2'-bipyrimidine) with lanthanide(III) cations: sensitized near-infrared luminescence from Yb(III), Nd(III), and Er(III) following Ru-to-lanthanide energy transfer. Inorganic chemistry, 2006, 45, 3895-3904 |
| 4350182 | CIF | C16 H36 N12.5 O16.5 Ru2 Yb1.5 | A e a 2 | 24.9856; 21.9719; 13.483 90; 90; 90 | 7401.9 | Herrera, Juan-Manuel; Pope, Simon J. A.; Adams, Harry; Faulkner, Stephen; Ward, Michael D. Structural and photophysical properties of coordination networks combining [Ru(Bpym)(CN)4]2- or [[Ru(CN)4]2(mu-bpym)]4- anions (bpym = 2,2'-bipyrimidine) with lanthanide(III) cations: sensitized near-infrared luminescence from Yb(III), Nd(III), and Er(III) following Ru-to-lanthanide energy transfer. Inorganic chemistry, 2006, 45, 3895-3904 |
| 4350183 | CIF | C16 H37 Eu1.5 N12.5 O17 Ru2 | A e a 2 | 25.16; 22.2; 13.623 90; 90; 90 | 7609 | Herrera, Juan-Manuel; Pope, Simon J. A.; Adams, Harry; Faulkner, Stephen; Ward, Michael D. Structural and photophysical properties of coordination networks combining [Ru(Bpym)(CN)4]2- or [[Ru(CN)4]2(mu-bpym)]4- anions (bpym = 2,2'-bipyrimidine) with lanthanide(III) cations: sensitized near-infrared luminescence from Yb(III), Nd(III), and Er(III) following Ru-to-lanthanide energy transfer. Inorganic chemistry, 2006, 45, 3895-3904 |
| 4350669 | CIF | C18 Cu N3 O8 U | A e a 2 | 27.757; 10.734; 14.194 90; 90; 90 | 4229 | Weng, Zhehui; Zhang, Zhi-hui; Olds, Travis; Sterniczuk, Marcin; Burns, Peter C. Copper(I) and copper(II) uranyl heterometallic hybrid materials. Inorganic chemistry, 2014, 53, 7993-7998 |
| 4501754 | CIF | C29 H25 Ce N9 O16 | A e a 2 | 15.9668; 17.7252; 11.5612 90; 90; 90 | 3271.99 | Das, Babulal; Baruah, Jubaraj B. Protonated Adenine and Cytosine Ribbons Stabilized by Dipicolinato Metal Frameworks Crystal Growth & Design, 2010, 10, 3242 |
| 4513766 | CIF | C20 H26 Cl F6 N3 P Rh | A e a 2 | 28.458; 12.7428; 13.1834 90; 90; 90 | 4780.8 | Ghorai, Debasish; Dutta, Champak; Choudhury, Joyanta Switching of “Rollover Pathway” in Rhodium(III)-Catalyzed C‒H Activation of Chelating Molecules ACS Catalysis, 2015, 709 |
| 4516741 | CIF | C20 H32 Co P4 | A e a 2 | 15.7643; 16.3813; 8.9459 90; 90; 90 | 2310.19 | Jeletic, Matthew S.; Hulley, Elliott B.; Helm, Monte L.; Mock, Michael T.; Appel, Aaron M.; Wiedner, Eric S.; Linehan, John C. Understanding the Relationship Between Kinetics and Thermodynamics in CO2 Hydrogenation Catalysis ACS Catalysis, 2017, 7, 6008 |
| 4517568 | CIF | C17 H14 Cl I N2 O2 | A e a 2 | 31.3169; 13.0613; 7.9634 90; 90; 90 | 3257.34 | Sun, Han-Li; Yang, Fan; Ye, Wei-Ting; Wang, Jun-Jie; Zhu, Rong Dual Cobalt and Photoredox Catalysis Enabled Intermolecular Oxidative Hydrofunctionalization ACS Catalysis, 2020, 10, 4983-4989 |
| 4518151 | CIF | Ba F2 Mo2 O10 Se2 | A e a 2 | 12.3643; 11.0325; 7.2946 90; 90; 90 | 995.1 | Lin, Lin; Jiang, Xingxing; Wu, Chao; Li, Longhua; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi Ba(MoO2F)2(XO3)2 (X = Se and Te): First Cases of Noncentrosymmetric Fluorinated Molybdenum Oxide Selenite/Tellurite Through Unary Substitution for Enlarging Band Gaps and Second Harmonic Generation ACS Applied Materials & Interfaces, 2020 |
| 4518152 | CIF | Ba F2 Mo2 O10 Te2 | A e a 2 | 12.5591; 11.0137; 7.2753 90; 90; 90 | 1006.34 | Lin, Lin; Jiang, Xingxing; Wu, Chao; Li, Longhua; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi Ba(MoO2F)2(XO3)2 (X = Se and Te): First Cases of Noncentrosymmetric Fluorinated Molybdenum Oxide Selenite/Tellurite Through Unary Substitution for Enlarging Band Gaps and Second Harmonic Generation ACS Applied Materials & Interfaces, 2020 |
| 4518923 | CIF | Hg3 P2 S8 | A e a 2 | 16.3786; 8.1613; 9.2723 90; 90; 90 | 1239.43 | Xing, Wenhao; Liang, Fei; Tang, Chunlan; Uykur, Ece; Lin, Zheshuai; Yao, Jiyong; Yin, Wenlong; Kang, Bin Highly Distorted [HgS<sub>4</sub>] Motif-Driven Structural Symmetry Degradation and Strengthened Second-Harmonic Generation Response in the Defect Diamond-Like Chalcogenide Hg<sub>3</sub>P<sub>2</sub>S<sub>8</sub>. ACS applied materials & interfaces, 2021 |
| 4519415 | CIF | C15 H12 F3 N O2 | A e a 2 | 26.638; 13.754; 7.5085 90; 90; 90 | 2751 | Ashfaq, Muhammad; Khalid, Muhammad; Tahir, Muhammad Nawaz; Ali, Akbar; Arshad, Muhammad Nadeem; Asiri, Abdullah M. Synthesis of Crystalline Fluoro-Functionalized Imines, Single Crystal Investigation, Hirshfeld Surface Analysis, and Theoretical Exploration. ACS omega, 2022, 7, 9867-9878 |
| 7036967 | CIF | C16 H24 B2 Fe N6 | A e a 2 | 14.3553; 15.2389; 8.8543 90; 90; 90 | 1937 | Zhou, Jian; Zhu, Bo-Wen; Luan, Jie; Liu, Zhan; Fang, Jing-Kun; Bao, Xin; Peng, Guo; Tucek, Jiri; Bao, Song-Song; Zheng, Li-Min In air a spin crossover active iron(ii) complex of amine/NCBH3(-) ligands is converted to a low spin complex of imine/CN(-) ligands. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20551-20561 |
| 7036968 | CIF | C16 H24 B2 Fe N6 | A e a 2 | 14.3196; 15.4416; 9.451 90; 90; 90 | 2089.8 | Zhou, Jian; Zhu, Bo-Wen; Luan, Jie; Liu, Zhan; Fang, Jing-Kun; Bao, Xin; Peng, Guo; Tucek, Jiri; Bao, Song-Song; Zheng, Li-Min In air a spin crossover active iron(ii) complex of amine/NCBH3(-) ligands is converted to a low spin complex of imine/CN(-) ligands. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20551-20561 |
| 7036970 | CIF | C16 H24 B2 N6 Ni | A e a 2 | 14.329; 15.405; 9.2136 90; 90; 90 | 2033.8 | Zhou, Jian; Zhu, Bo-Wen; Luan, Jie; Liu, Zhan; Fang, Jing-Kun; Bao, Xin; Peng, Guo; Tucek, Jiri; Bao, Song-Song; Zheng, Li-Min In air a spin crossover active iron(ii) complex of amine/NCBH3(-) ligands is converted to a low spin complex of imine/CN(-) ligands. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20551-20561 |
| 7038038 | CIF | C145 H167 Br14 Co14 N28 O44 | A e a 2 | 19.02; 30.995; 31.396 90; 90; 90 | 18509 | Zhang, Yanping; Lv, Rui; Wang, Jingyao; Yang, Linyan; Liao, Shengyun; Tian, Jinlei; Gu, Wen; Liu, Xin Two novel μ6-O2- bridged Co14/Ni14 hydroxamate Clusters packed in distorted face-centered cubic patterns Dalton Transactions, 2016, 45, 3247-3250 |
| 7040916 | CIF | C69 H78 Cl2 N4 O12 Re4 S4 | A e a 2 | 38.243; 11.6015; 16.5828 90; 90; 90 | 7357.4 | Beltrán, Tomás F; Zaragoza, Guillermo; Delaude, Lionel Synthesis, characterization, and gas-phase fragmentation of rhenium-carbonyl complexes bearing imidazol(in)ium-2-dithiocarboxylate ligands. Dalton transactions (Cambridge, England : 2003), 2016, 45, 18346-18355 |
| 7040918 | CIF | C69 H74 Cl2 N4 O12 Re4 S4 | A e a 2 | 37.853; 11.623; 16.6584 90; 90; 90 | 7329.1 | Beltrán, Tomás F; Zaragoza, Guillermo; Delaude, Lionel Synthesis, characterization, and gas-phase fragmentation of rhenium-carbonyl complexes bearing imidazol(in)ium-2-dithiocarboxylate ligands. Dalton transactions (Cambridge, England : 2003), 2016, 45, 18346-18355 |
| 7041693 | CIF | C69 H74 Cl2 Mn4 N4 O12 S4 | A e a 2 | 38.0525; 11.428; 16.6104 90; 90; 90 | 7223.3 | Beltrán, Tomás F; Zaragoza, Guillermo; Delaude, Lionel Mono- and bimetallic manganese-carbonyl complexes and clusters bearing imidazol(in)ium-2-dithiocarboxylate ligands. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1779-1788 |
| 7041694 | CIF | C69 H78 Cl2 Mn4 N4 O12 S4 | A e a 2 | 38.3937; 11.4255; 16.4614 90; 90; 90 | 7221.1 | Beltrán, Tomás F; Zaragoza, Guillermo; Delaude, Lionel Mono- and bimetallic manganese-carbonyl complexes and clusters bearing imidazol(in)ium-2-dithiocarboxylate ligands. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1779-1788 |
| 7042123 | CIF | C26 H32 Br15 Cu11 N4 | A e a 2 | 19.9166; 24.7493; 10.2572 90; 90; 90 | 5056 | Lei, Xiao-Wu; Yue, Cheng-Yang; Wang, Sai; Gao, Hui; Wang, Wei; Wang, Ning; Yin, Yun-Dong Di-pyridyl organic cation directed hybrid cuprous halogenides: syntheses, crystal structures and photochromism and photocatalysis. Dalton transactions (Cambridge, England : 2003), 2017, 46, 4209-4217 |
| 7042126 | CIF | C26 H32 Cu11 I15 N4 | A e a 2 | 20.623; 25.633; 10.6807 90; 90; 90 | 5646.1 | Lei, Xiao-Wu; Yue, Cheng-Yang; Wang, Sai; Gao, Hui; Wang, Wei; Wang, Ning; Yin, Yun-Dong Di-pyridyl organic cation directed hybrid cuprous halogenides: syntheses, crystal structures and photochromism and photocatalysis. Dalton transactions (Cambridge, England : 2003), 2017, 46, 4209-4217 |
| 7044484 | CIF | C29.5 H41 Cl2 F6 Ir N2 O0.5 P | A e a 2 | 14.0362; 29.3317; 32.4846 90; 90; 90 | 13374.1 | Li, Juanjuan; Guo, Lihua; Tian, Zhenzhen; Tian, Meng; zhang, shumiao; Xu, Ke; Qian, Yuchuan; Liu, Zhe Novel half-sandwich iridium(III) imino-pyridyl complexes showing remarkable in vitro anticancer activity Dalton Trans., 2017 |
| 7047118 | CIF | C44 H84 Cl6 N2 P4 Zr2 | A e a 2 | 14.8731; 14.7823; 25.3833 90; 90; 90 | 5580.7 | Sekiguchi, Yoshiya; Meng, Fanqiang; Tanaka, Hiromasa; Eizawa, Aya; Arashiba, Kazuya; Nakajima, Kazunari; Yoshizawa, Kazunari; Nishibayashi, Yoshiaki Synthesis and reactivity of titanium- and zirconium-dinitrogen complexes bearing anionic pyrrole-based PNP-type pincer ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 11322-11326 |
| 7047948 | CIF | B4 H20 N2 Sr | A e a 2 | 8.59299; 13.68873; 8.50066 90; 90; 90 | 999.91 | Jørgensen, Mathias; Lee, Young-Su; Bjerring, Morten; Jepsen, Lars H.; Akbey, Ümit; Cho, Young Whan; Jensen, Torben R. Disorder induced polymorphic transitions in the high hydrogen density compound Sr(BH<sub>4</sub>)<sub>2</sub>(NH<sub>3</sub>BH<sub>3</sub>)<sub>2</sub>. Dalton transactions (Cambridge, England : 2003), 2018, 47, 16737-16746 |
| 7056118 | CIF | C18 H22 Cl2 Cu N8 O3 | A e a 2 | 17.6722; 17.3463; 7.397 90; 90; 90 | 2267.53 | Lavrenova, Ludmila G.; Kuz'menko, Tatyana A.; Ivanova, Alina D.; Smolentsev, Anton I.; Komarov, Vladislav; Bogomyakov, Artem Stepanovich; Sheludyakova, Lilia A.; Vorontsova, Elena V. Synthesis, magnetic and cytotoxic properties of copper(II) halide complexes with 1,2,4-triazolo[1,5-a] benzimidazoles New J. Chem., 2017, 41, 4341-4347 |
| 7059110 | CIF | C32 H40 Cu4 I2 N10 | A e a 2 | 15.1031; 17.648; 13.8061 90; 90; 90 | 3679.9 | Jana, Oishi; Mani, Ganesan New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand New Journal of Chemistry, 2017, 41, 9361 |
| 7059117 | CIF | C5 H14 N14 O7 | A e a 2 | 21.595; 18.986; 7.676 90; 90; 90 | 3147.2 | Huang, Haifeng; Li, Ying; Yang, Jun; Pan, Renming; Lin, Xiangyang Materials with good energetic properties resulting from the smart combination of nitramino and dinitromethyl group with furazan New Journal of Chemistry, 2017, 41, 7697 |
| 7059126 | CIF | C23 H23 N3 O3 | A e a 2 | 25.339; 10.4719; 15.6589 90; 90; 90 | 4155 | Huang, Ying; Min, Wei; Wu, Qiu-Wen; Sun, Jing; Shi, Da-Hua; Yan, Chao-Guo Facile one-pot synthesis of spirooxindole-pyrrolidine derivatives and their antimicrobial and acetylcholinesterase inhibitory activities New Journal of Chemistry, 2018, 42, 16211 |
| 7061629 | CIF | C7 H15 N2 O4 Re | A e a 2 | 13.725; 13.75; 10.9708 90; 90; 90 | 2070.4 | You, Xiuli; Rao, Wenjun; Han, Keke; Wang, Lingyu; Zhang, Mengxia; Wei, Zhenhong Two quasi-spherical molecules [1,4-diazabicyclo(3.2.2)nonane]X (X = ClO4, ReO4) exhibit switchable phase transition, dielectric and second-harmonic-generation properties New Journal of Chemistry, 2022, 46, 14404-14409 |
| 7063866 | CIF | C20 H18 Cu F12 N8 | A e a 2 | 17.982; 17.969; 15.915 90; 90; 90 | 5142.4 | Uvarova, Marina A.; Dolgushin, Fedor M.; Babeshkin, Konstantin A.; Efimov, Nikolay N.; Pettinari, Claudio; Eremenko, Igor L.; Nefedov, Sergey E. Uncommon mononuclear pyrazole–pyrazolate complexes of CoII, CuII and Zn New Journal of Chemistry, 2025, 49, 13007-13014 |
| 7100572 | CIF | C22 H26 N2 O | A e a 2 | 12.149; 20.4254; 7.2291 90; 90; 90 | 1793.89 | Ebran, Jean-Philippe; Hazell, Rita G.; Skrydstrup, Troels Samarium diiodide-induced intramolecular pinacol coupling of dinitrones: synthesis of cyclic cis-vicinal diamines Chemical Communications (Cambridge, United Kingdom), 2005, 5402-5404 |
| 7118054 | CIF | C22 H15 I N4 O | A e a 2 | 22.3839; 36.433; 10.0332 90; 90; 90 | 8182.2 | Hu, Yancheng; Yi, Ruxia; Yu, Xinzhang; Xin, Xiaoyi; Wang, Chunxiang; Wan, Boshun O-Transfer-facilitated cyclizations of propargylamides with TMSN3: selective synthesis of tetrazoles and dihydroimidazoles. Chemical communications (Cambridge, England), 2015, 51, 15398-15401 |
| 7118696 | CIF | C38 H51 Co N2 O | A e a 2 | 23.5831; 17.9998; 16.1483 90; 90; 90 | 6854.8 | Andjaba, John M.; Tye, Jesse W.; Yu, Pony; Pappas, Iraklis; Bradley, Christopher A. Cp*Co(IPr): synthesis and reactivity of an unsaturated Co(i) complex. Chemical communications (Cambridge, England), 2016, 52, 2469-2472 |
| 7120325 | CIF | C29 H28 N4 O4 | A e a 2 | 11.3361; 48.595; 9.4566 90; 90; 90 | 5209.4 | Tian, Xiaohe; Zhu, Yingzhong; Zhang, Qiong; Zhang, Ruilong; Wu, Jieying; Tian, Yupeng Halides Tuning Subcellular-Targeting in Two-Photon Emissive Complexes via Different Uptake Mechanisms Chem. Commun., 2017 |
| 7123437 | CIF | C18 H20 O4 | A e a 2 | 8.05576; 24.7866; 15.4543 90; 90; 90 | 3085.84 | Nambu, Hisanori; Onuki, Yuta; Ono, Naoki; Tsuge, Kiyoshi; Yakura, Takayuki Ring-opening cyclization of spirocyclopropanes with stabilized sulfonium ylides for the construction of a chromane skeleton Chemical Communications, 2019 |
| 7125353 | CIF | C24 H20 S4 | A e a 2 | 10.8663; 8.5571; 22.5617 90; 90; 90 | 2097.88 | Phan, Ngoc-Minh; Zakharov, Lev N.; Johnson, Darren W. Copper(ii) serves as an efficient additive for metal-directed self-assembly of over 20 thiacyclophanes. Chemical communications (Cambridge, England), 2018, 54, 13419-13422 |
| 7125562 | CIF | C11 H19 I7 N3 Pb2 S2 | A e a 2 | 8.838; 41.52; 8.769 90; 90; 90 | 3218 | Zhu, Xu-Hui; Mercier, Nicolas; Riou, Amédée; Blanchard, Philippe; Frère, Pierre (C4H3SCH2NH3)2(CH3NH3)Pb2I7: non-centrosymmetrical crystal structure of a bilayer hybrid perovskite. Chemical communications (Cambridge, England), 2002, 2160-2161 |
| 7125842 | CIF | C56 H59 N | A e a 2 | 15.828; 16.995; 16.819 90; 90; 90 | 4524 | Vrána, Jan; Samsonov, Maksim A.; Němec, Vlastimil; R°uŽička, Aleš Access to the most sterically crowded anilines via non-catalysed C-C coupling reactions. Chemical communications (Cambridge, England), 2020, 56, 2487-2490 |
| 7126188 | CIF | C150 H130 Cl4 Co3 N24 O24 | A e a 2 | 13.2673; 66.3212; 19.2434 90; 90; 90 | 16932.3 | Wang, Hao; Sayed, Sayed Youssef; Zhou, Yuqiao; Olsen, Brian C.; Luber, Erik J.; Buriak, Jillian M. Water-soluble pH-switchable cobalt complexes for aqueous symmetric redox flow batteries. Chemical communications (Cambridge, England), 2020, 56, 3605-3608 |
| 7127827 | CIF | C19 H15 N | A e a 2 | 16.7467; 21.6002; 7.8088 90; 90; 90 | 2824.69 | Qi, Zhi-Chao; Lou, Qin-Xin; Niu, Yuan; Yang, Shang-Dong Temporary (P[double bond, length as m-dash]O) directing group enabled carbazole ortho arylation via palladium catalysis. Chemical communications (Cambridge, England), 2021, 57, 2021-2024 |
| 7130092 | CIF | C48 H24 N16 O20 Zn8 | A e a 2 | 32.3895; 27.404; 28.0141 90; 90; 90 | 24865.4 | Li, Jia-Li; Xiong, Xiao; Luo, Dong; Wei, Yu-Bai; Lu, Weigang; Li, Dan Formaldehyde recognition through aminal formation in a luminescent metal–organic framework Chemical Communications, 2022 |
| 7131424 | CIF | C8 H6 Cu N4 O2 | A e a 2 | 7.915; 13.333; 8.8132 90; 90; 90 | 930.1 | Jung, Cheolwon; Choi, Sang Beom; Park, Jaewoo; Jung, Minji; Kim, Jonghoon; Oh, Hyunchul; Kim, Jaheon Porous zeolitic imidazolate frameworks assembled with highly-flattened tetrahedral copper(II) centres and 2-nitroimidazolates. Chemical communications (Cambridge, England), 2023, 59, 4040-4043 |
| 7132161 | CIF | C28 H32 N6 O2 | A e a 2 | 11.4339; 9.3891; 24.5636 90; 90; 90 | 2637 | Xiong, Shenglun; Zhang, Yi; Jiang, Yunqi; Wang, Fei; Zhou, Wei; Li, Aimin; Zhang, Qinpeng; Wang, Qiuan; He, Qing Photo–Controllable Binding and Release of HP2O73– Using an Azobenzene based Smart Macrocycle Chemical Communications, 2023 |
| 7134381 | CIF | C54 H595 Mo154 N6 Na11 O730 | A e a 2 | 30.3874; 56.1686; 50.1012 90; 90; 90 | 85513.6 | Guo, Haiyang; He, Donglin; Long, De-Liang; Cronin, Leroy Robotic exploration of amino-acid functionalised molybdenum blue polyoxometalate nanoclusters Chemical Communications, 2025, 61, 7121-7124 |
| 7158112 | CIF | C10 H16 F5 N O4 S | A e a 2 | 13.4208; 26.557; 8.6349 90; 90; 90 | 3077.6 | Dudziński, Piotr; Husstedt, Wibke S.; Matsnev, Andrej V.; Thrasher, Joseph S.; Haufe, Günter Synthesis and [3,3]-sigmatropic rearrangements of 5-(pentafluorosulfanyl)-pent-3-en-2-ol, its homologues, and trifluoromethyl analogues. Organic & biomolecular chemistry, 2021, 19, 5607-5623 |
| 7158793 | CIF | C45 H38 Cl2 F2 N6 O6 | A e a 2 | 22.524; 24.034; 7.426 90; 90; 90 | 4020 | Thadem, Nagender; Rajesh, Manda; Balaboina, Harikrishna; Das, Saibal Synthesis of bridgehead-azacycles <i>via</i> dual C-N/C-C annulation of α-amino acids, aminals and maleimides. Organic & biomolecular chemistry, 2022 |
| 7160317 | CIF | C23 H31 Al N2 O4 | A e a 2 | 14.4662; 21.9361; 15.0299 90; 90; 90 | 4769.5 | Yan, Wenliang; Ma, Xiaoli; Li, Qifeng; Pang, Ziyuan; Yang, Xiaobo; Chen, Yiwen; Yang, Zhi Aluminum-catalyzed anti-Markovnikov hydroamination of aromatic alkenes with aromatic amines. Organic & biomolecular chemistry, 2025, 23, 1347-1353 |
| 7160526 | CIF | C26 H22 N2 O | A e a 2 | 12.6782; 24.5075; 12.7134 90; 90; 90 | 3950.2 | Wei, Minghui; Wang, Xujia; Zhang, Jintao; Chen, Jiankun; Liu, Chengkou; Yang, Zhao; Li, Yuguang; Qin, Hong; Fang, Zheng; Guo, Kai Synthesis of pyridino[2,1-<i>b</i>]quinazolinones <i>via</i> a visible light-induced functionalization of alkynes/nitrile insertion/cyclization tandem sequences in continuous-flow technology. Organic & biomolecular chemistry, 2025, 23, 5203-5207 |
| 7223536 | CIF | C84 H89.5 Fe2 N20 O8.75 | A e a 2 | 14.6547; 34.5808; 35.0669 90; 90; 90 | 17770.9 | Papadakis, Raffaello; Deligkiozi, Ioanna; Giorgi, Michel; Faure, Bruno; Tsolomitis, Athanase Supramolecular complexes involving non-symmetric viologen cations and hexacyanoferrate(II) anions. A spectroscopic, crystallographic and computational study. RSC Advances, 2015, 6, 575-585 |
| 7223564 | CIF | C24 H18 Cl2 F2 Mn N4 O2 | A e a 2 | 13.476; 19.011; 9.349 90; 90; 90 | 2395.1 | Khavasi, Hamid Reza; Ghanbarpour, Alireza; Azhdari Tehrani, Alireza The role of intermolecular interactions involving halogens in the supramolecular architecture of a series of Mn(II) coordination compounds RSC Adv., 2015 |
| 7229249 | CIF | C10 H20 N2 O14 P4 Zn3 | A e a 2 | 10.2729; 18.1781; 10.7119 90; 90; 90 | 2000.36 | Paul, Avijit Kumar; Kanagaraj, Rajendiran; Jana, Ajay; Maji, Pradip Novel Amine Templated Three-Dimensional Zinc-Organophosphonates with Variable Pore-Openings CrystEngComm, 2017 |
| 7229719 | CIF | C37 H29 N3 S | A e a 2 | 21.784; 27.581; 9.343 90; 90; 90 | 5614 | Karimata, Ayumu; Suzuki, Shuichi; Kozaki, Masatoshi; Okada, Keiji Stereoelectronic control of oxidation potentials of 3,7-bis(diarylamino)phenothiazines RSC Advances, 2017, 7, 56144 |
| 7233773 | CIF | C31 H33 Ir N4 O6 | A e a 2 | 15.1324; 19.6891; 9.9117 90; 90; 90 | 2953.12 | Jieun Lee; Hankook Oh; Jinho Kim; Ki-Min Park; Kyoung Soo Yook; Jun Yeob Lee; Youngjin Kang Fluorine-free blue phosphorescent emitters for efficient phosphorescent organic light emitting diodes Journal of Materials Chemistry C, 2014, 2, 6040-6047 |
| 7234942 | CIF | C22.86 H14.62 N0.6 O8.12 Zn2 | A e a 2 | 41.3632; 18.7393; 17.7052 90; 90; 90 | 13723.6 | Pan, Ying; Ding, Qiongjie; Xu, Hongjia; Shi, Chunyue; Singh, Amita; Kumar, Abhinav; Liu, Jianqiang A new Zn(ii)-based 3D metal‒organic framework with uncommon sev topology and its photocatalytic properties for the degradation of organic dyes CrystEngComm, 2019, 21, 4578 |
| 7234999 | CIF | C24 H16 N4 O | A e a 2 | 14.5818; 28.597; 9.1804 90; 90; 90 | 3828.2 | Vala, Ruturajsinh M.; Patel, Divyang M.; Sharma, Mayank G.; Patel, Hitendra M. Impact of an aryl bulky group on a one-pot reaction of aldehyde with malononitrile and N-substituted 2-cyanoacetamide RSC Advances, 2019, 9, 28886 |
| 7235417 | CIF | C36 H24 N2 | A e a 2 | 26.9518; 12.3277; 15.2781 90; 90; 90 | 5076.2 | Gleason, Cody J.; Cox, Jordan M.; Walton, Ian M.; Benedict, Jason B. Polymorphism and the influence of crystal structure on the luminescence of the opto-electronic material 4,4′-bis(9-carbazolyl)biphenyl CrystEngComm, 2014, 16, 7621 |
| 7235715 | CIF | C15 H8 N10 O10 | A e a 2 | 24.962; 16.401; 9.4116 90; 90; 90 | 3853.1 | Wu, Bo; Yang, Hongwei; Wang, Zhixin; Lin, Qiuhan; Ju, Xuehai; Lu, Chunxu; Cheng, Guangbin Synthesis and characterization of new energetic derivatives containing a high nitrogen content moiety and picryl group: a new strategy for incorporating the picryl functionality RSC Adv., 2014, 4, 53282 |
| 7236164 | CIF | C36 H32 Cl2 Cu N8 O8 | A e a 2 | 17.4049; 17.5945; 11.9876 90; 90; 90 | 3671 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236177 | CIF | C64 H42 Cd3 N10 O13 | A e a 2 | 31.98; 7.904; 26.8 90; 90; 90 | 6774 | Wang, Xiao-Xiao; Wang, Xiao-Qing; Niu, Xiao-Yan; Hu, Tuo-Ping Three novel metal‒organic frameworks based on an unsymmetrical rigid carboxylate ligand for luminescence sensing of nitrobenzene derivatives and magnetic properties CrystEngComm, 2016, 18, 7471 |
| 7237091 | CIF | C21 H21 O3 P | A e a 2 | 32.26; 16.224; 7.12 90; 90; 90 | 3727 | Shen, Ruwei; Zhang, Ming; Xiao, Jing; Dong, Chao; Han, Li-Biao Ph3P-mediated highly selective C(α)–P coupling of quinone monoacetals with R2P(O)H: convenient and practical synthesis of ortho-phosphinyl phenols Green Chemistry, 2018, 20, 5111 |
| 7237099 | CIF | C26 H22 Cl0 Co N8 O2 | A e a 2 | 12.408; 19.368; 9.808 90; 90; 90 | 2357 | Huang, Wei; Li, Yujie; Yong, Juan; Liu, Yang; Wu, Dayu Hydrazone-based cobalt complexes toward multielectron redox and spin crossover RSC Advances, 2018, 8, 17159 |
| 7238602 | CIF | C46.5 H51.5 Fe2 N8 O10.5 S8 | A e a 2 | 23.038; 10.461; 22.989 90; 90; 90 | 5540 | Zuo, Weiwei; Rosa, Vitor; Tourbillon, Clarisse; Specklin, David; Khaled, Cheaib; Kurmoo, Mohamedally; Welter, Richard Mononuclear and dinuclear complexes of manganese(iii) and Iron(iii) supported by 2-salicyloylhydrazono-1,3-dithiane ligand: synthesis, characterization and magnetic properties RSC Advances, 2012, 2, 2517 |
| 7239206 | CIF | C21 H19 N3 O2 | A e a 2 | 7.166; 40.204; 6.3427 90; 90; 90 | 1827.3 | Wong, Wing-Yan; Lee, Siu-Fung; Chan, Hoi-Shan; Mak, Thomas C. W.; Wong, Chi-Hin; Huang, Lau-Shan; Stoddart, J. Fraser; Cham-Fai Leung, Ken Recognition between V- and dumbbell-shaped molecules RSC Advances, 2013, 3, 26382 |
| 7240540 | CIF | C50 H36 Cl8 I4 N4 | A e a 2 | 11.0411; 16.8624; 28.2059 90; 90; 90 | 5251.4 | Oburn, Shalisa M.; Santana, Carlos; Elacqua, Elizabeth; Groeneman , Ryan A diamondoid net sustained by halogen bonds: employing a cyclobutane to generate a tetrahedral architecture CrystEngComm, 2020 |
| 7243091 | CIF | B5 H12 N O12 | A e a 2 | 11.3246; 11.0147; 9.1513 90; 90; 90 | 1141.51 | Kusy, Rafał; Grela, Karol Ligand-free (Z)-selective transfer semihydrogenation of alkynes catalyzed by in situ generated oxidizable copper nanoparticles Green Chemistry, 2021, 23, 5494-5502 |
| 7243326 | CIF | C18 H12 F4 I2 N2 | A e a 2 | 13.1529; 18.502; 15.239 90; 90; 90 | 3708.5 | Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106 |
| 7243506 | CIF | C22 H28 N4.5 O4.5 Zn | A e a 2 | 26.205; 25.903; 14.652 90; 90; 90 | 9946 | Basak, Tanmoy; Frontera, Antonio; Chattopadhyay, Shouvik Synthesis and characterization of a mononuclear zinc(ii) Schiff base complex: on the importance of C–H⋯π interactions RSC Advances, 2021, 11, 30148-30155 |
| 7244641 | CIF | C16 H17 N O2 | A e a 2 | 26.6725; 19.708; 10.3729 90; 90; 90 | 5452.64 | Tao, Yang; Liu, Xiaoting; Zhoujin, Yunping; Zhou, Panpan; Parkin, Sean R.; Li, Tonglei; Guo, Ju; Yu, Faquan; Long, Sihui Conformational Flexibility and Substitution Pattern Lead to Polymorphism of 3-Methyl-2-(phenylamino)benzoic acid CrystEngComm, 2022 |
| 7244705 | CIF | C40 H37 Cd2.5 N3 O17.5 | A e a 2 | 16.868; 25.914; 28.838 90; 90; 90 | 12606 | Chahine, Ali; Chaffee, Alan L.; Knowles, Gregory P.; Turner, David Roger; Batten, Stuart R. Highly Connected Framework Materials from Flexible Tetra-Isophthalate Ligands CrystEngComm, 2022 |
| 7245503 | CIF | C18 H40 Cl Fe N10 S6 | A e a 2 | 12.806; 16.361; 17.171 90; 90; 90 | 3597.7 | Wang, Ping; Chen, Ming-Kun; Tong, Yu-Qiao; Yin, Shi-Qing; Huang, Bo Structural phase transition and dielectric relaxation in an organic-inorganic hybrid compound: [(CH3)3NH]4[Fe(SCN)6]Cl CrystEngComm, 2022 |
| 7247024 | CIF | C28 H23 N5 O | A e a 2 | 17.7843; 34.8725; 7.54963 90; 90; 90 | 4682.15 | Sun, Xuancheng; Li, Chaoxiong; Meng, Xianggao; Wang, Dunjia; Zheng, Chunyang A highly thermal and pH-stable fluorescence sensor for rapid detection of Hg2+, Fe3+, and tetracycline in aqueous solutions CrystEngComm, 2023, 25, 4531-4538 |
| 7247099 | CIF | C35 H42 N2 O12 S2 | A e a 2 | 13.1496; 21.1566; 13.3584 90; 90; 90 | 3716.3 | Christoff, Rebecca M.; Al Bayer, Mohammad; Soares da Costa, Tatiana P.; Perugini, Matthew A.; Abbott, Belinda M. Enhancing allosteric inhibition of dihydrodipicolinate synthase through the design and synthesis of novel dimeric compounds RSC Medicinal Chemistry, 2023 |
| 7247808 | CIF | C4 H16 Bi Br5 N2 | A e a 2 | 18.2458; 22.4324; 7.8919 90; 90; 90 | 3230.13 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247809 | CIF | C4 H16 Bi Cl5 N2 | A e a 2 | 17.5689; 21.6639; 7.487 90; 90; 90 | 2849.6 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247810 | CIF | C4 H16 Bi Br2.12 Cl2.88 N2 | A e a 2 | 17.7119; 22.0532; 7.5527 90; 90; 90 | 2950.12 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247811 | CIF | C4 H16 Bi Br1.15 Cl3.85 N2 | A e a 2 | 17.6291; 21.9787; 7.512 90; 90; 90 | 2910.63 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7248548 | CIF | C17 H24 Br2 N2 O7 Zn2 | A e a 2 | 14.662; 16.055; 21.525 90; 90; 90 | 5067 | Middya, Puspendu; Frontera, Antonio; Chattopadhyay, Shouvik The crucial role of hydrogen bonding in shaping the structures of zinc-based coordination polymers using tridentate N, N, O donor reduced Schiff base ligands and bridging acetates RSC Advances, 2024, 14, 13905-13914 |
| 7249264 | CIF | C18 H18 O2 | A e a 2 | 19.6427; 18.5826; 8.2741 90; 90; 90 | 3020.1 | Sethi, Tapaswini; Das, Dinabandhu Switching from positive to negative thermal expansion in a tetrayne-diol compound CrystEngComm, 2024, 26, 5133-5137 |
| 7249265 | CIF | C18 H18 O2 | A e a 2 | 19.6451; 18.8313; 8.3108 90; 90; 90 | 3074.5 | Sethi, Tapaswini; Das, Dinabandhu Switching from positive to negative thermal expansion in a tetrayne-diol compound CrystEngComm, 2024, 26, 5133-5137 |
| 7249266 | CIF | C18 H18 O2 | A e a 2 | 19.6437; 18.7051; 8.2918 90; 90; 90 | 3046.7 | Sethi, Tapaswini; Das, Dinabandhu Switching from positive to negative thermal expansion in a tetrayne-diol compound CrystEngComm, 2024, 26, 5133-5137 |
| 7249267 | CIF | C18 H18 O2 | A e a 2 | 19.6354; 18.9619; 8.3324 90; 90; 90 | 3102.4 | Sethi, Tapaswini; Das, Dinabandhu Switching from positive to negative thermal expansion in a tetrayne-diol compound CrystEngComm, 2024, 26, 5133-5137 |
| 7249268 | CIF | C18 H18 O2 | A e a 2 | 19.6266; 19.0995; 8.357 90; 90; 90 | 3132.7 | Sethi, Tapaswini; Das, Dinabandhu Switching from positive to negative thermal expansion in a tetrayne-diol compound CrystEngComm, 2024, 26, 5133-5137 |
| 7249269 | CIF | C18 H18 O2 | A e a 2 | 19.6202; 19.2474; 8.3912 90; 90; 90 | 3168.8 | Sethi, Tapaswini; Das, Dinabandhu Switching from positive to negative thermal expansion in a tetrayne-diol compound CrystEngComm, 2024, 26, 5133-5137 |
| 7249407 | CIF | C26 H34 N2 O8 Zn | A e a 2 | 21.494; 13.8469; 9.6418 90; 90; 90 | 2869.6 | Gishan, Md; Middya, Puspendu; Drew, Michael G. B.; Frontera, Antonio; Chattopadhyay, Shouvik Synthesis, structural characterization, and theoretical analysis of novel zinc(ii) schiff base complexes with halogen and hydrogen bonding interactions RSC Advances, 2024, 14, 30896-30911 |
| 7249929 | CIF | C22 H15 N O | A e a 2 | 24.2597; 44.3767; 8.5031 90; 90; 90 | 9154.1 | Lukoyanov, Anton N.; Zvereva, Yulia V.; Cherkasov, Anton V.; Zhigulin, Grigory Yu.; Kharitonov, Nikita P.; Ketkov, Sergey Yu. Partial and complete hydrolysis of metal complexes based on monoiminoacenaphthene-1-ones CrystEngComm, 2025, 27, 1749-1762 |
| 7251211 | CIF | C3 H3 As F13 N O Xe | A e a 2 | 8.67561; 31.0125; 8.65174 90; 90; 90 | 2327.77 | Uran, Erik; Lozinšek, Matic Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides CrystEngComm, 2025 |
| 7251300 | CIF | C80 H66 N32 O29 V8 Zn8 | A e a 2 | 20.1731; 20.1804; 27.4319 90; 90; 90 | 11167.6 | Zhu, Maochun; Bai, Xue; Yang, Yanli; Zhang, Ange; Wang, Siyue; Sun, Chengyu; Lu, Ying; Li, Bin; Liu, Shuxia The stepwise construction of polyoxovanadate-based Zn-MOF nanoparticles with Lewis acid sites for the one-pot synthesis of N-heterocycles in air Green Chemistry, 2025 |
| 7251647 | CIF | C63 H85 F18 N8 Nd O12 P2 | A e a 2 | 19.445; 23.4941; 17.6409 90; 90; 90 | 8059.1 | Navarro, Yolanda; Soriano, Stephane Serge Yves Jerome; Silva Junior, Henrique C.; Iglesias, María José; Guedes, Guilherme P.; López-Ortiz, Fernando Coordination compounds based on a phosphonic diamide-TEMPO diradical and CuII , NdIII , EuIII and TbIII ions: synthesis, magnetic properties and application in the aerobic oxidation of allylic and benzylic alcohols CrystEngComm, 2026 |
| 7251648 | CIF | C63 H85 Eu F18 N8 O12 P2 | A e a 2 | 19.5128; 23.4721; 17.509 90; 90; 90 | 8019.2 | Navarro, Yolanda; Soriano, Stephane Serge Yves Jerome; Silva Junior, Henrique C.; Iglesias, María José; Guedes, Guilherme P.; López-Ortiz, Fernando Coordination compounds based on a phosphonic diamide-TEMPO diradical and CuII , NdIII , EuIII and TbIII ions: synthesis, magnetic properties and application in the aerobic oxidation of allylic and benzylic alcohols CrystEngComm, 2026 |
| 7701604 | CIF | C29 H38 I7 N3 Pb2 | A e a 2 | 8.7633; 55.03; 8.7081 90; 90; 90 | 4199.4 | Venkatesan, Naveen R.; Mahdi, Ali; Barraza, Brian; Wu, Guang; Chabinyc, Michael L.; Seshadri, Ram Enhanced yield-mobility products in hybrid halide Ruddlesden-Popper compounds with aromatic ammonium spacers. Dalton transactions (Cambridge, England : 2003), 2019, 48, 14019-14026 |
| 7701798 | CIF | C17 H18 N2 O4 | A e a 2 | 24.479; 10.978; 5.6901 90; 90; 90 | 1529.1 | Hu, Min-Na; Zhang, Wen-Qian; Liu, Hua; He, Peng-Xiu; Liu, Ping; Wang, Yao-Yu; Li, Jian-Li Five complexes based on a new racemic tetraoxaspiro ligand: correlation of potential coordination preferences with the structure, magnetic properties and luminescence properties. Dalton transactions (Cambridge, England : 2003), 2019, 48, 3862-3873 |
| 7702007 | CIF | C56 H49.5 Cl4 N14.5 O16 Zn2 | A e a 2 | 24.6982; 22.0178; 21.7705 90; 90; 90 | 11838.8 | 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 |
| 7702048 | CIF | C38 H44 N2 O2 | A e a 2 | 9.975; 30.06; 10.719 90; 90; 90 | 3214.1 | Kan, Chao; Ge, Jilei; Ma, Haiyan Aluminum methyl, alkoxide and α-alkoxy ester complexes supported by 6,6'-dimethylbiphenyl-bridged salen ligands: synthesis, characterization and catalysis for rac-lactide polymerization. Dalton transactions (Cambridge, England : 2003), 2016, 45, 6682-6695 |
| 7702093 | CIF | C29.5 H34 Cl2 F2 N P Pt | A e a 2 | 18.2105; 17.9198; 17.5935 90; 90; 90 | 5741.26 | Shaw, Paul A.; Phillips, Jessica M.; Clarkson, Guy J.; Rourke, Jonathan P. Trapping five-coordinate platinum(iv) intermediates. Dalton transactions (Cambridge, England : 2003), 2016, 45, 11397-11406 |
| 7702128 | CIF | C18 H10 N10 O8 Zn2 | A e a 2 | 17.8735; 20.9554; 20.7462 90; 90; 90 | 7770.4 | Li, Qin; Yu, Mei-Hui; Xu, Jian; Li, Ai-Lin; Hu, Tong-Liang; Bu, Xian-He Two new metal-organic frameworks based on tetrazole-heterocyclic ligands accompanied by in situ ligand formation. Dalton transactions (Cambridge, England : 2003), 2017, 46, 3223-3228 |
| 7702130 | CIF | C60 H68 Br Fe N8 | A e a 2 | 23.9792; 29.3525; 18.8532 90; 90; 90 | 13269.8 | Simler, Thomas; Danopoulos, Andreas A.; Braunstein, Pierre Non-symmetrical, potentially redox non-innocent imino NHC pyridine 'pincers' via a zinc ion template-assisted synthesis. Dalton transactions (Cambridge, England : 2003), 2017, 46, 5955-5964 |
| 7702163 | CIF | C34 H42 Mo N4 O7 | A e a 2 | 9.7458; 20.3853; 17.2757 90; 90; 90 | 3432.18 | Begines, Emilio; Carrasco, Carlos J.; Montilla, Francisco; Álvarez, Eleuterio; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio; Galindo, Agustín Oxidoperoxidomolybdenum(vi) complexes with acylpyrazolonate ligands: synthesis, structure and catalytic properties. Dalton transactions (Cambridge, England : 2003), 2017, 47, 197-208 |
| 7702164 | CIF | C34 H42 Mo N4 O6 | A e a 2 | 9.5954; 20.5989; 17.1471 90; 90; 90 | 3389.2 | Begines, Emilio; Carrasco, Carlos J.; Montilla, Francisco; Álvarez, Eleuterio; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio; Galindo, Agustín Oxidoperoxidomolybdenum(vi) complexes with acylpyrazolonate ligands: synthesis, structure and catalytic properties. Dalton transactions (Cambridge, England : 2003), 2017, 47, 197-208 |
| 7702175 | CIF | C4 H14 Br4 Cd Cl2 N2 | A e a 2 | 7.9926; 24.108; 7.956 90; 90; 90 | 1533 | Chen, Hai-Peng; Shi, Ping-Ping; Wang, Zhong-Xia; Gao, Ji-Xing; Zhang, Wan-Ying; Chen, Cheng; Tang, Yuan-Yuan; Fu, Da-Wei Tunable dielectric transitions in layered organic-inorganic hybrid perovskite-type compounds: [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>Cl]<sub>2</sub>[CdCl<sub>4-4x</sub>Br<sub>4x</sub>] (x = 0, 1/4, 1). Dalton transactions (Cambridge, England : 2003), 2018, 47, 7005-7012 |
| 7702176 | CIF | C4 H14 Br Cd Cl5 N2 | A e a 2 | 7.6707; 24.6215; 7.5742 90; 90; 90 | 1430.5 | Chen, Hai-Peng; Shi, Ping-Ping; Wang, Zhong-Xia; Gao, Ji-Xing; Zhang, Wan-Ying; Chen, Cheng; Tang, Yuan-Yuan; Fu, Da-Wei Tunable dielectric transitions in layered organic-inorganic hybrid perovskite-type compounds: [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>Cl]<sub>2</sub>[CdCl<sub>4-4x</sub>Br<sub>4x</sub>] (x = 0, 1/4, 1). Dalton transactions (Cambridge, England : 2003), 2018, 47, 7005-7012 |
| 7702177 | CIF | C4 H14 Br Cd Cl5 N2 | A e a 2 | 7.649; 24.42; 7.579 90; 90; 90 | 1416 | Chen, Hai-Peng; Shi, Ping-Ping; Wang, Zhong-Xia; Gao, Ji-Xing; Zhang, Wan-Ying; Chen, Cheng; Tang, Yuan-Yuan; Fu, Da-Wei Tunable dielectric transitions in layered organic-inorganic hybrid perovskite-type compounds: [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>Cl]<sub>2</sub>[CdCl<sub>4-4x</sub>Br<sub>4x</sub>] (x = 0, 1/4, 1). Dalton transactions (Cambridge, England : 2003), 2018, 47, 7005-7012 |
| 7702182 | CIF | C20 H20 Mn N2 | A e a 2 | 7.8832; 17.663; 12.5197 90; 90; 90 | 1743.3 | Cannella, Anthony F.; Dey, Suman Kr; MacMillan, Samantha N.; Lacy, David C. Structural diversity in pyridine and polypyridine adducts of ring slipped manganocene: correlating ligand steric bulk with quantified deviation from ideal hapticity. Dalton transactions (Cambridge, England : 2003), 2018, 47, 5171-5180 |
| 7702208 | CIF | C78 H86 Cl4 N12 O Zn2 | A e a 2 | 16.956; 19.724; 23.052 90; 90; 90 | 7710 | Dammann, Wiebke; Buban, Tabea; Schiller, Carl; Burger, Peter Dinuclear tethered pyridine, diimine complexes. Dalton transactions (Cambridge, England : 2003), 2018, 47, 12105-12117 |
| 7702228 | CIF | C67 H74 Cl2 O4 P4 Ru2 S8 | A e a 2 | 20.1261; 21.5909; 16.4408 90; 90; 90 | 7144.2 | Zain Aldin, Mohammed; Maho, Anthony; Zaragoza, Guillermo; Demonceau, Albert; Delaude, Lionel Synthesis, characterization, and catalytic evaluation of ruthenium-diphosphine complexes bearing xanthate ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 13926-13938 |
| 7702243 | CIF | C27 H17 N S | A e a 2 | 11.9187; 21.3168; 15.1658 90; 90; 90 | 3853.2 | Wang, Yue; Xiao, Yu-Ping; Zhou, Yue-Yue; Hu, Cheng-Gui; Tong, Bi-Hai; Ye, Shang-Hui; Mei, Qun-Bo Novel phosphorescent triptycene-based Ir(iii) complexes for organic light-emitting diodes. Dalton transactions (Cambridge, England : 2003), 2019, 48, 16289-16297 |
| 7702511 | CIF | C12 H17 Ag N5 O2.5 | A e a 2 | 16.139; 14.005; 12.626 90; 90; 90 | 2854 | 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 |
| 7702595 | CIF | C52 H78 N16 O22 Y2 | A e a 2 | 16.677; 20.114; 18.724 90; 90; 90 | 6281 | Bligh, S. W. Annie; Choi, Nick; Evagorou, Evagoras G.; McPartlin, Mary; White, Kenneth N. Dimeric yttrium(iii) and neodymium(iii) macrocyclic complexes: potential catalysts for hydrolysis of double-stranded DNA Journal of the Chemical Society, Dalton Transactions, 2001, 3169 |
| 7702930 | CIF | C26 H22 Cu N8 O4 | A e a 2 | 12.6731; 18.95; 10.049 90; 90; 90 | 2413.3 | Yang, Ping; Zhang, Dan-Dan; Wang, Zi-Zhou; Liu, Hui-Zhong; Shi, Qingshan; Xie, Xiao-Bao Copper(II) complexes with NNO ligands: synthesis, crystal structures, DNA cleavage, and anticancer activities Dalton Transactions, 2019 |
| 7703534 | CIF | C46 H50 B2 N14 O4 W2 | A e a 2 | 16.0592; 26.216; 27.9017 90; 90; 90 | 11746.8 | Frogley, Benjamin J.; Hill, Anthony F. Metal coordination to bipyridyl carbynes. Dalton transactions (Cambridge, England : 2003), 2020, 49, 3272-3283 |
| 7704131 | CIF | Al2 H6 K2 O7 | A e a 2 | 10.1605; 7.5416; 9.999 90; 90; 90 | 766.19 | Dembowski, Mateusz; Prange, Micah P.; Pouvreau, Maxime; Graham, Trent R.; Bowden, Mark E.; N'Diaye, Alpha; Schenter, Gregory K.; Clark, Sue B.; Clark, Aurora E.; Rosso, Kevin M.; Pearce, Carolyn I. Inference of principal species in caustic aluminate solutions through solid-state spectroscopic characterization. Dalton transactions (Cambridge, England : 2003), 2020, 49, 5869-5880 |
| 7704132 | CIF | Al2 H6 O7 Rb2 | A e a 2 | 10.3511; 7.6823; 10.2481 90; 90; 90 | 814.93 | Dembowski, Mateusz; Prange, Micah P.; Pouvreau, Maxime; Graham, Trent R.; Bowden, Mark E.; N'Diaye, Alpha; Schenter, Gregory K.; Clark, Sue B.; Clark, Aurora E.; Rosso, Kevin M.; Pearce, Carolyn I. Inference of principal species in caustic aluminate solutions through solid-state spectroscopic characterization. Dalton transactions (Cambridge, England : 2003), 2020, 49, 5869-5880 |
| 7707082 | CIF | La P3 Si | A e a 2 | 5.965; 25.2125; 5.8168 90; 90; 90 | 874.8 | Akopov, Georgiy; Mark, Justin; Viswanathan, Gayatri; Lee, Shannon J.; McBride, Brennan C.; Won, Juyeon; Perras, Frédéric A; Paterson, Alexander L.; Yuan, Bing; Sen, Sabyasachi; Adeyemi, Adedoyin N.; Zhang, Feng; Wang, Cai-Zhuang; Ho, Kai-Ming; Miller, Gordon J.; Kovnir, Kirill Third time's the charm: intricate non-centrosymmetric polymorphism in <i>Ln</i>SiP<sub>3</sub> (<i>Ln</i> = La and Ce) induced by distortions of phosphorus square layers. Dalton transactions (Cambridge, England : 2003), 2021, 50, 6463-6476 |
| 7707085 | CIF | Ce P3 Si | A e a 2 | 5.8961; 25.0987; 5.7747 90; 90; 90 | 854.57 | Akopov, Georgiy; Mark, Justin; Viswanathan, Gayatri; Lee, Shannon J.; McBride, Brennan C.; Won, Juyeon; Perras, Frédéric A; Paterson, Alexander L.; Yuan, Bing; Sen, Sabyasachi; Adeyemi, Adedoyin N.; Zhang, Feng; Wang, Cai-Zhuang; Ho, Kai-Ming; Miller, Gordon J.; Kovnir, Kirill Third time's the charm: intricate non-centrosymmetric polymorphism in <i>Ln</i>SiP<sub>3</sub> (<i>Ln</i> = La and Ce) induced by distortions of phosphorus square layers. Dalton transactions (Cambridge, England : 2003), 2021, 50, 6463-6476 |
| 7707327 | CIF | C56 H51 Au3 N3 P3 | A e a 2 | 36.692; 21.4267; 13.825 90; 90; 90 | 10869.1 | Ferrer, Montserrat; Gutiérrez, Albert; Martínez, Manuel; Da Silva, Cristiana; Netto, Adelino V. G.; Rodríguez, Laura; Romo-Islas, Guillermo; Pan, Fangfang; Rissanen, Kari Base-assisted synthesis of 4-pyridinate gold(I) metallaligands: a study of their use in self-assembly reactions. Dalton transactions (Cambridge, England : 2003), 2021, 50, 8154-8166 |
| 7707539 | CIF | C40 H36 N2 O4 P2 Zn | A e a 2 | 26.0998; 17.2345; 7.9957 90; 90; 90 | 3596.6 | Yadav, Ravi; Dahlen, Milena; Singh, Akhil K.; Sun, Xiaofei; Gamer, Michael T.; Roesky, Peter W. Nonanuclear zinc-gold [Zn<sub>3</sub>Au<sub>6</sub>] heterobimetallic complexes. Dalton transactions (Cambridge, England : 2003), 2021, 50, 8558-8566 |
| 7708252 | CIF | C8 H20 N2 O2 Sn | A e a 2 | 11.8081; 10.1306; 10.0735 90; 90; 90 | 1205.02 | Johnson, Andrew Lee; Paish, James David; Snook, Michael Evaluation of Sn(II) Aminoalkoxide Precursors for Atomic Layer Deposition of SnO Thin Films. Invitation: Dalton Transactions web collection themed around the topic of tin chemistry Dalton Transactions, 2021 |
| 7709499 | CIF | C21 H26 Br2 N2 Se | A e a 2 | 18.5263; 15.6201; 7.3666 90; 90; 90 | 2131.77 | 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 |
| 7710410 | CIF | C8 H32 Cd2 N2 O12 P6 | A e a 2 | 12.8565; 13.9166; 13.6699 90; 90; 90 | 2445.8 | Mączka, Mirosław; Gągor, Anna; Stefańska, Dagmara; Zaręba, Jan K.; Pikul, Adam Structural, magnetic and photoluminescence properties of new hybrid hypophosphites: discovery of the first noncentrosymmetric and two cobalt-based members Dalton Transactions, 2022 |
| 7710543 | CIF | C24 H27 Cl3 Ga O P | A e a 2 | 19.5931; 19.2681; 13.408 90; 90; 90 | 5061.8 | Dankert, Fabian; Fischer, Malte; Hering-Junghans, Christian Modulating the reactivity of phosphanylidenephosphoranes towards water with Lewis acids Dalton Transactions, 2022 |
| 7710807 | CIF | C28 H60 I2 N10 Sm | A e a 2 | 19.4034; 18.0204; 10.3393 90; 90; 90 | 3615.2 | Bokouende, Sergely Steephen; Jenks, Tyler C.; Ward, Cassandra L.; Allen, Matthew J. Solid-state and solution-phase characterization of Sm<sup>II</sup>-aza[2.2.2]cryptate and its methylated analogue. Dalton transactions (Cambridge, England : 2003), 2022, 51, 10852-10855 |
| 7710942 | CIF | C22 H48 B2 Cl2 F6 N6 O14 P4 Pt2 S2 | A e a 2 | 25.9286; 18.9042; 18.5116 90; 90; 90 | 9073.6 | Culpepper, Johnathan D.; Lee, Kyounghoon; Portis, William; Swenson, Dale C.; Daly, Scott R. Fluorination and hydrolytic stability of water-soluble platinum complexes with a borane-bridged diphosphoramidite ligand Dalton Transactions, 2022 |
| 7712105 | CIF | C21 H21 N O4 | A e a 2 | 17.123; 14.4934; 7.3773 90; 90; 90 | 1830.83 | McEllin, Alice Jane; Goult, Christopher A.; Whitwood, Adrian C.; Lynam, Jason M.; Bruce, Duncan W. On the mercuration, palladation, transmetalation and direct auration of a C^N^C pincer ligand. Dalton transactions (Cambridge, England : 2003), 2023, 52, 872-876 |
| 7713541 | CIF | C24 H34 N2 | A e a 2 | 16.1758; 14.0586; 9.7277 90; 90; 90 | 2212.17 | Roesky, Herbert W.; Huo, Shuai-Cong; Li, Yao; Ji, Peng-Fei; Zhang, De-Xiang; Yang, Ying Interaction of Germanium Analogue of Organic Isonitrile with Cu(I) imide in Side-on Mode Dalton Transactions, 2023 |
| 7714022 | CIF | C62 H82 B2 Fe N6 | A e a 2 | 8.974; 29.2515; 21.3053 90; 90; 90 | 5592.7 | Guthardt, Robin; Jacob, Hannes Lukas; Bruhn, Clemens; Siemeling, Ulrich A complete series of N-heterocyclic tetrylenes (Si – Pb) with a 1,1’-ferrocenediyl backbone enabled by 1,3,2-diazaborolyl N-substituents Dalton Transactions, 2023 |
| 7714210 | CIF | C8 H22 Cl4 Co N4 O3 Zn2 | A e a 2 | 25.8579; 11.1659; 13.2095 90; 90; 90 | 3813.94 | Kariyawasam, Rasika Janadari; Zibaseresht, Ramin; Polson, Matthew Ian James; Houlihan, Joanna C.C.; Wikaira, Jan L.; Hartshorn, Richard M. Synthesis of Nitrogen Mustards on Cobalt(III) Dalton Transactions, 2023 |
| 7714230 | CIF | C21 H16 N2 O3 | A e a 2 | 16.38; 29.87; 6.843 90; 90; 90 | 3348 | Kamboj, Nisha; Dey, Ayan; Lama, Prem; Majumder, Moumita; Sengupta, Srijan; Metre, Ramesh K. Closed-shell Phenalenyl-based Dinuclear Iron(III) Complex as a Robust Cathode for One-Compartment H2O2 Fuel Cell Dalton Transactions, 2023 |
| 7714517 | CIF | C32 H44 Si2 Sn2 | A e a 2 | 16.7596; 21.3357; 8.6837 90; 90; 90 | 3105.1 | Bischoff, Inga-Alexandra; Morgenstern, Bernd; Zimmer, Michael; Koldemir, Aylin; Pöttgen, Rainer; Schäfer, André Bis(tetrelocenes) - fusing tetrelocenes into close proximity. Dalton transactions (Cambridge, England : 2003), 2023 |
| 7715812 | CIF | C28 H26 Fe N6 Se2 | A e a 2 | 13.5008; 24.067; 8.0492 90; 90; 90 | 2615.4 | Dou, Di-Yu; Qi, Da-Fan; Zhao, Tian-Yuan; Zheng, Peng-Xuan; Bao, Xin Design and characterization of Fe(II) complexes with tetradentate ligands exhibiting spin-crossover near room temperature. Dalton transactions (Cambridge, England : 2003), 2024, 53, 8619-8625 |
| 7715813 | CIF | C28 H26 Fe N6 Se2 | A e a 2 | 13.6833; 24.3553; 8.2423 90; 90; 90 | 2746.8 | Dou, Di-Yu; Qi, Da-Fan; Zhao, Tian-Yuan; Zheng, Peng-Xuan; Bao, Xin Design and characterization of Fe(II) complexes with tetradentate ligands exhibiting spin-crossover near room temperature. Dalton transactions (Cambridge, England : 2003), 2024, 53, 8619-8625 |
| 7716203 | CIF | C19 H18 O3 | A e a 2 | 7.4066; 34.011; 6.1761 90; 90; 90 | 1555.8 | Chandra, Anushri; Basu, Pousali; Raha, Shreya; Dhibar, Papu; Bhattacharya, Samaresh Development of ruthenium complexes with S-donor ligands for application in synthesis, catalytic acceptorless alcohol dehydrogenation and crossed-aldol condensation. Dalton transactions (Cambridge, England : 2003), 2024, 53, 10675-10685 |
| 7717350 | CIF | C10 H32 B18 Co N3 | A e a 2 | 20.7855; 19.9491; 11.25789 90; 90; 90 | 4668.11 | Tüzün, Ece Zeynep; Hnyk, Drahomír; Bavol, Dmytro; Litecká, Miroslava; Fanfrlík, Jindřich; Grűner, Bohumír Modification of cobalt bis(dicarbollide) ions with nitrile groups on carbon atoms: a unique low-temperature skeletal rearrangement due to the specific electron-donor character of CN substitution. Dalton transactions (Cambridge, England : 2003), 2024, 53, 18462-18466 |
| 7717772 | CIF | C64 H59 Cu4 N8 O13.5 | A e a 2 | 36.4484; 23.738; 14.043 90; 90; 90 | 12150.2 | Jana, Narayan Ch; Escuer, Albert; Brandão, Paula; Panja, Anangamohan Exploring structural, magnetic, and catalytic diversity in tetranuclear {Cu<sub>4</sub>O<sub>4</sub>} cubane cores and a dinuclear complex derived from closely related ligand systems. Dalton transactions (Cambridge, England : 2003), 2025, 54, 3000-3012 |
| 7718189 | CIF | C37 H51 Cl Fe N2 | A e a 2 | 23.6175; 17.8626; 16.2168 90; 90; 90 | 6841.4 | Zinke, Julian; Bruhn, Clemens; Demeshko, Serhiy; Siemeling, Ulrich The “pogo stick” complex [FeCp*{N(SiMe3)2}]: spin state properties, adduct formation with Lewis bases, and reactivity towards weakly Brønsted acidic protonated NHCs Dalton Transactions, 2025, 54, 5812-5828 |
| 7718942 | CIF | Hg2 P2 S8 Zn | A e a 2 | 16.3443; 8.0439; 9.1596 90; 90; 90 | 1204.23 | Tang, Chunlan; Yao, Aoge; Xing, Wenhao; Tang, Jian; Kang, Lei; Yin, Wenlong; Wu, Jieyun; Kang, Bin Partial congener substitution induced wide band gap witnessed in diamond-like chalcogenide ZnHg<sub>2</sub>P<sub>2</sub>S<sub>8</sub> and its second-order nonlinear optical properties. Dalton transactions (Cambridge, England : 2003), 2025, 54, 10956-10960 |
| 8104589 | CIF | C20 H28 N6 O3 | A e a 2 | 19.9676; 8.4674; 12.4082 90; 90; 90 | 2097.9 | Setshedi, Itumeleng B.; Lemmerer, Andreas; Smith, Mark G. The crystal structure of (E)-N′-(butan-2-ylidene)isonicotinohydrazide 0.5 hydrate C10H13N3O·0.5H2O Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 1295-1296 |
| 8105128 | CIF | C30 H28 N6 O4 Zn | A e a 2 | 12.04; 22.596; 10.344 90; 90; 90 | 2814 | Deng, Xiao-Wei; Wu, Wei-Na Crystal structure of bis(3-methoxy-N-(1-(pyridin-2-yl)ethylidene)benzohydrazonato κ3 O,N,N′)zinc(II), C30H28N6O4Zn Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 421-422 |
| 8105226 | CIF | C28 H26 N8 Ni O2 | A e a 2 | 11.813; 21.433; 10.03 90; 90; 90 | 2539 | Yang, Xue-Mei; Zhu, Tao; Lin, Long Crystal structure of bis(3-methyl-N-(1-(pyrazin-2-yl)ethylidene)benzohydrazonato-κ3 O,N,N′)nickel(II), C28H26N8O2Ni Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 585-586 |
| 8105280 | CIF | C24 H22 Co N8 O4 S2 | A e a 2 | 12.043; 21.723; 9.961 90; 90; 90 | 2605.9 | Wang, Wan-Wan; Deng, Xiao-Wei; Wu, Wei-Na Crystal structure of bis [1-(phenylsulfonyl)-2-(1-(pyrazin-2-yl)ethylidene)hydrazin-1-ido-κ3 N,N′,O]cobalt(II), C24H22N8O4S2Co Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 763-764 |
| 8105987 | CIF | C9 H8 N4 O7 | A e a 2 | 21.0595; 14.8565; 7.6437 90; 90; 90 | 2391.5 | Lizhen, Chen; Yunzhang, Liu; Jianlong, Wang; Jun, Chen; Hongxia, Pan The crystal structure of propan-2-one O-(2,4,6-trinitrophenyl) oxime, C9H8N4O7 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1223-1224 |
| 8106176 | CIF | C21 H15 N O2 | A e a 2 | 22.149; 13.2899; 10.6679 90; 90; 90 | 3140.2 | Huang, Xiang; Shi, Da-Bin Crystal structure of methyl 10-(pyridin-4-yl)-anthracene-9-carboxylate, C21H15NO2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 441-443 |
| 8106185 | CIF | C24 H22 N8 Ni O4 S2 | A e a 2 | 11.845; 21.937; 9.907 90; 90; 90 | 2574 | Wu, Hao; Wu, Wei-Na Crystal structure of bis(1-(phenylsulfonyl)-2-(1-(pyrazin-2-yl)ethylidene)hydrazin-1-ido-κ3 N,N′,O)nickel(II), C24H22N8O4S2Ni Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 465-466 |
| 8106186 | CIF | C24 H22 Cu N8 O4 S2 | A e a 2 | 11.9395; 21.813; 10.1184 90; 90; 90 | 2635.2 | Wang, Wan-Wan; Wu, Wei-Na; Wang, Yuan Crystal Structure of bis(1-(phenylsulfonyl)-2-(1-(pyrazin-2-yl)ethylidene)hydrazin-1-ido-κ3 N,N′,O)copper(II), C24H22N8O4S2Cu Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 467-468 |
| 8106254 | CIF | C24 H20 Cu N10 O2 | A e a 2 | 12.2281; 19.176; 9.8689 90; 90; 90 | 2314.1 | Li, Qingqing; Jiao, Kaichuang; Xu, Zhouqing Crystal structure of bis(N-(1-(pyrazin-2-yl)ethylidene)nicotinohydrazonato-κ3 N,N′,O)copper(II) C24H20N10O2Cu Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 669-670 |
| 8106398 | CIF | C16 H14 O5 | A e a 2 | 7.4156; 31.415; 5.9451 90; 90; 90 | 1384.98 | Maxweel, Lindley; Cárdenas, Alejandro; Brito, Iván Crystal structure of dimethyl 4,4′-oxydibenzoate, C16H14O5 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 1059-1060 |
| 8106596 | CIF | C15 H23 N7 O4 | A e a 2 | 18.4956; 23.9806; 8.1572 90; 90; 90 | 3618 | Amr, Abd El-Galil E.; Khalifa, Nagy M.; Al-Omar, Mohamed A.; Ghabbour, Hazem A. Crystal structure of N 2,N 6-bis(1-hydrazinyl-2-methyl-1-oxopropan-2-yl) pyridine-2,6-dicarboxamide, C15H23N7O4 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 537-539 |
| 9010972 | CIF | O2 S | A e a 2 | 6.07; 5.94; 6.14 90; 90; 90 | 221.383 | Post, B.; Schwartz, R. S.; Fankuchen, I. The crystal structure of sulfur dioxide Sample: T = -130 C Acta Crystallographica, 1952, 5, 372-374 |
| 9011424 | CIF | As8 Hg3 S20 Sb2 Tl4 | A e a 2 | 11.287; 23.389; 13.399 90; 90; 90 | 3537.22 | Ohmasa, M.; Nowacki, W. The crystal structure of vrbaite, Hg3Tl4As8Sb2S20 Locality: Allchar, Macedonia Zeitschrift fur Kristallographie, 1971, 134, 360-380 |
| 1541952 | CIF | Ba4 O10 Pt Ti2 | A e a m | 13.09; 13.33; 5.77 90; 90; 90 | 1006.81 | Blattner, H.; Graenicher, H.; Merz, W.; Kaenzig, W. Die Kristallstruktur des hexagonalen und rhombischen Barium-Platinat-Titanats Helvetica Physica Acta, 1948, 21, 341-354 |
| 4349729 | CIF | C4 H16 Bi Cl5 N2 | A e a m | 17.8318; 21.9673; 7.5656 90; 90; 90 | 2963.57 | Piecha-Bisiorek, Anna; Gągor, Anna; Jakubas, Ryszard; Ciżman, Agnieszka; Janicki, Rafał; Medycki, Wojciech Ferroelectricity in bis(ethylammonium) pentachlorobismuthate(iii): synthesis, structure, polar and spectroscopic properties Inorganic Chemistry Frontiers, 2017, 4, 1281 |
| 8105003 | CIF | C3.5 H3 Br0.5 N2.5 | A e a m | 12.3735; 20.869; 6.8385 90; 90; 90 | 1765.9 | Tang, Hang-Jun; Xu, Yang-Rong; Wang, Xiao-Hui; Zhao, Feng-Lan; Meng, Qing-Guo The crystal structure of 5-bromo-2-(1-methyl-1H-tetrazol-5-yl)pyridine, C7H6BrN5 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 23-25 |
| 9000873 | CIF | Ca1.058 Ce0.818 Fe0.982 Na0.09 Nb0.707 O14 Ta0.02 Th0.034 Ti2.273 Zr2 | A e a m | 10.148; 14.147; 7.278 90; 90; 90 | 1044.86 | Mazzi, F.; Munno, R. Calciobetafite (new mineral of the pyrochlore group) and related minerals from Campi Flegrei, Italy; crystal structures of polymignyte and zirkelite: comparison with pyrochlore and zirconolite Note: polytype zirconolite-3O Locality: Campi Flegrei, Italy American Mineralogist, 1983, 68, 262-276 |
| 9007790 | CIF | Ga Sn2 V2 | A e a m | 6.7191; 18.798; 5.603 90; 90; 90 | 707.691 | Ye, J.; Horiuchi, H.; Shishido, T.; Fukuda, T. Structure of V2Sn2Ga Acta Crystallographica, Section C, 1990, 46, 1195-1197 |
| 9008271 | CIF | Fe Li Na2 O15 Si6 | A e a m | 10.072; 17.337; 14.004 90; 90; 90 | 2445.35 | Johnsen, O.; Nielsen, K.; Sotofte, I. The crystal structure of emeleusite, a novel example of sechser-doppelkette Locality: Igdlutalik Island, Julianchab District, Greenland Zeitschrift fur Kristallographie, 1978, 147, 297-306 |
| 1553241 | CIF | C49 H34 Cl2 | A e m 2 | 13.3249; 26.5982; 10.0862 90; 90; 90 | 3574.7 | Sisto, Thomas J.; Zakharov, Lev N.; White, Brittany M.; Jasti, Ramesh Towards pi-extended cycloparaphenylenes as seeds for CNT growth: investigating strain relieving ring-openings and rearrangements. Chemical science, 2016, 7, 3681-3688 |
| 1564867 | CIF | C9 H21 Mo N3 O2 S | A e m 2 | 12.066; 10.388; 10.613 90; 90; 90 | 1330.3 | Zhang, Cai-Xia; Fang, Duo-Wen; Wang, Jun-Ling; Jia, Ai-Quan; Zhang, Qian-Feng Syntheses, characterizations, and reactivities of new 1,4,7-trimethyl-l,4,7-triazacyclononane (Me3tacn) molybdenum and tungsten complexes Inorganica Chimica Acta, 2020, 507, 119599 |
| 1570737 | CIF | C14 H18 Cl2 Cs Ge2 I7 N2 | A e m 2 | 8.4068; 45.0015; 8.3314 90; 90; 90 | 3151.9 | Morteza Najarian, Amin; Dinic, Filip; Chen, Hao; Sabatini, Randy; Zheng, Chao; Lough, Alan J.; Maris, Thierry; Saidaminov, Makhsud I.; Garcia de Arquer, F. Pelayo; Voznyy, Oleksandr; Hoogland, Sjoerd; Sargent, Edward H. Homomeric Chains of intermolecular bonds scaffold octahedral germanium perovskites Nature, 2023, 620, 328-335 |
| 2021674 | CIF HKL Paper | C23 H14 Br2 O | A e m 2 | 7.098; 42.72; 6.135 90; 90; 90 | 1860.3 | Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments Acta Crystallographica, Section C, 2018, 74, 1674-1683 |
| 2243832 | CIF HKL Paper | C6 H5 N O4 | A e m 2 | 10.2045; 6.1282; 9.7293 90; 90; 90 | 608.42 | Behrman, Edward J.; Parkin, Sean Synthesis and crystal structures of 3,6-dihydroxypicolinic acid and its labile intermediate dipotassium 3-hydroxy-6-(sulfonatooxy)pyridine-2-carboxylate monohydrate Acta Crystallographica Section E, 2021, 77, 623-628 |
| 2311598 | CIF Paper | C18 H10 Br2 S4 | A e m 2 | 7.5981; 37.411; 6.1991 90; 90; 90 | 1762.1 | Rigin, Sergei; Fonari, Marina Crystal structure of 4,4'-bis-(4-bromo-phen-yl)-1,1',3,3'-tetra-thia-fulvalene. Acta crystallographica. Section E, Crystallographic communications, 2019, 75, 1195-1198 |
| 3000529 | On hold until 2024-11-17 | Ca H18 Li2 | A e m 2 | 3.9924453; 4.855366; 8.4194306 90; 90; 90 | 163.209 | Morgan Redington To be published in Chemistry of Materials |
| 4133782 | CIF | C82 H120 K2 N4 O3 Sc2 | A e m 2 | 10.13686; 27.9904; 29.413 90; 90; 90 | 8345.5 | Lv, Ze-Jie; Huang, Zhe; Shen, Jinghang; Zhang, Wen-Xiong; Xi, Zhenfeng Well-Defined Scandacyclopropenes: Synthesis, Structure, and Reactivity. Journal of the American Chemical Society, 2019, 141, 20547-20555 |
| 4321352 | CIF | C4 H12 F N O4 Os | A e m 2 | 7.0174; 11.401; 10.925 90; 90; 90 | 874.1 | Michael Gerken; David A. Dixon; Gary J. Schrobilgen The OsO4F-, OsO4F22-, and OsO3F3- Anions, Their Study by Vibrational and NMR Spectroscopy and Density Functional Theory Calculations, and the X-ray Crystal Structures of [N(CH3)4][OsO4F] and [N(CH3)4][OsO3F3] Inorganic Chemistry, 2000, 39, 4244-4255 |
| 4517089 | CIF | C9 H14 Ag2 N3 O4 P | A e m 2 | 7.1411; 12.8457; 14.2823 90; 90; 90 | 1310.2 | Jaros, Sabina W.; Guedes da Silva, M. Fátima C.; Florek, Magdalena; Oliveira, M. Conceição; Smoleński, Piotr; Pombeiro, Armando J. L.; Kirillov, Alexander M. Aliphatic Dicarboxylate Directed Assembly of Silver(I) 1,3,5-Triaza-7-phosphaadamantane Coordination Networks: Topological Versatility and Antimicrobial Activity Crystal Growth & Design, 2014, 14, 5408 |
| 7134640 | CIF | C30 H43 Al N2 | A e m 2 | 15.6163; 22.5091; 7.737 90; 90; 90 | 2719.6 | Chen, Yiwen; Pang, Ziyuan; Li, Gege; Yang, Xiaobo; Yan, Wenliang; Li, Qifeng; Dong, Xuan; Ma, Xiaoli; Yang, Zhi Alkylaluminium-catalyzed regioselective hydrophosphinylation of α,β-unsaturated ketones into γ-ketophosphine oxides Chemical Communications, 2025, 61, 9666-9669 |
| 7233695 | CIF | Bi I5 O15 Rb2 | A e m 2 | 8.2257; 23.5398; 8.2544 90; 90; 90 | 1598.3 | Yin Huang; Xianggao Meng; Pifu Gong; Lei Yang; Zheshuai Lin; Xingguo Chen; Jingui Qin A2BiI5O15 (A = K+ or Rb+): two new promising nonlinear optical materials containing [I3O9]3- bridging anionic groups Journal of Materials Chemistry C, 2014, 2, 4057-4062 |
| 7233696 | CIF | Bi I5 K2 O15 | A e m 2 | 8.2115; 23.2072; 8.1977 90; 90; 90 | 1562.2 | Yin Huang; Xianggao Meng; Pifu Gong; Lei Yang; Zheshuai Lin; Xingguo Chen; Jingui Qin A2BiI5O15 (A = K+ or Rb+): two new promising nonlinear optical materials containing [I3O9]3- bridging anionic groups Journal of Materials Chemistry C, 2014, 2, 4057-4062 |
| 7244917 | CIF | C20 H22 N12 O4 Zn | A e m 2 | 17.5983; 24.5934; 18.2648 90; 90; 90 | 7905 | Fu, Xiaochen; Sale, Matthew; Ding, Bowen; Lewis, William; Silvester, Debbie S.; Ling, Chris D.; D'Alessandro, Deanna Michelle Hydrogen-Bonding 2D Coordination Polymer for Enzyme-Free Electrochemical Glucose Sensing CrystEngComm, 2022 |
| 7702880 | CIF | C18 H18 Au Cl5 N2 | A e m 2 | 4.5498; 26.313; 18.0718 90; 90; 90 | 2163.5 | Alesso, Giuseppe; Cinellu, Maria Agostina; Stoccoro, Sergio; Zucca, Antonio; Minghetti, Giovanni; Manassero, Carlo; Rizzato, Silvia; Swang, Ole; Ghosh, Manik Kumer Gold(III) six-membered N^C^N pincer complexes: synthesis, structure, reactivity and theoretical calculations. Dalton transactions (Cambridge, England : 2003), 2010, 39, 10293-10304 |
| 7702900 | CIF | C12 H24 Cl6 Fe O4 S2 Sc | A e m 2 | 16.15; 64.37; 11.3327 90; 90; 90 | 11781 | 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 |
| 7706027 | CIF | C27 H21 Cl F6 N5 Ni O2 P | A e m 2 | 8.6326; 22.3707; 16.5568 90; 90; 90 | 3197.4 | Boniolo, Manuel; Chernev, Petko; Cheah, Mun Hon; Heizmann, Philipp A.; Huang, Ping; Shylin, Sergii I.; Salhi, Nessima; Hossain, Md Kamal; Gupta, Arvind K.; Messinger, Johannes; Thapper, Anders; Lundberg, Marcus Electronic and geometric structure effects on one-electron oxidation of first-row transition metals in the same ligand framework. Dalton transactions (Cambridge, England : 2003), 2021, 50, 660-674 |
| 8104544 | CIF | H4 O10 Si2 Zn4 | A e m 2 | 8.354; 21.519; 10.24 90; 90; 90 | 1840.8 | Libowitzky, E.; Schultz, A.J.; Young, D.M. The low-temperature structure and phase transition of hemimorphite, Zn4Si2O7(OH)2.H2O Zeitschrift fur Kristallographie, 1998, 213, 659-668 |
| 9008139 | CIF | Ge1.5 Li2 O5 Si0.5 | A e m 2 | 5.99; 15.05; 4.94 90; 90; 90 | 445.339 | Vollenkle, H.; Wittmann, A.; Nowatny, H. Die kristallstruktur von Li2(Si0.25Ge0.75)2O5 Zeitschrift fur Kristallographie, 1968, 126, 37-45 |
| 9013141 | CIF | Bi2 O5 Te | A e m 2 | 11.602; 16.461; 5.523 90; 90; 90 | 1054.79 | Mercurio, D.; El Farissi, M.; Frit, B.; Goursat, P. Etude structurale et densification d'un nouveau materiau piezoelectrique: Bi2TeO5 Locality: synthetic Materials Chemistry and Physics, 1983, 9, 467-476 |
| 1541052 | CIF | Cu La1.83 Na0.16 O4 | A e m a | 5.3626; 5.3239; 13.1501 90; 90; 90 | 375.435 | Torardi, C.C.; Subramanian, M.A.; Gopalakrishnan, J.; Sleight, A.W. Alkali-metal substituted La2 Cu O4: Structures of La2-x Mx Cu O4 (M= Na, K: x ca. 0.2) Physica C (Amsterdam), 1989, 158, 465-470 |
| 1541054 | CIF | Cu K0.2 La1.8 O4 | A e m a | 5.3596; 5.3431; 13.1933 90; 90; 90 | 377.815 | Torardi, C.C.; Subramanian, M.A.; Gopalakrishnan, J.; Sleight, A.W. Alkali-metal substituted La2 Cu O4: Structures of La2-x Mx Cu O4 (M= Na, K: x ca. 0.2) Physica C (Amsterdam), 1989, 158, 465-470 |
| 2000747 | CIF Paper | C8 H24 Cd Cl4 N2 | A e m a | 7.538; 7.416; 30.803 90; 90; 90 | 1722 | Doudin, B.; Chapuis, G. Structure of bis(<i>n</i>-butylammonium) tetrachlorocadmate(II) Acta Crystallographica Section C, 1992, 48, 1218-1220 |
| 2000748 | CIF Paper | C8 H24 Cd Cl4 N2 | A e m a | 7.538; 7.416; 30.803 90; 90; 90 | 1722 | Doudin, B.; Chapuis, G. Structure of bis(<i>n</i>-butylammonium) tetrachlorocadmate(II) Acta Crystallographica Section C, 1992, 48, 1218-1220 |
| 2101146 | CIF Paper | C6 H20 Cl4 Mn N2 | A e m a | 7.414; 7.289; 26.803 90; 90; 90 | 1448.5 | Meyer, M.; Paciorek, W. A.; Schenk, K. J.; Chapuis, G.; Depmeier, W. Incommensurately modulated structure of γ-PAMC: new experimental evidence for amplitude and phase fluctuations Acta Crystallographica Section B, 1994, 50, 333-343 |
| 9000570 | CIF | As2 H8 Mg0.55 Mn5.45 O20 Si Zn3 | A e m a | 11.99; 31.46; 8.697 90; 90; 90 | 3280.55 | Moore, P. B.; Araki, T. Holdenite, a novel cubic close-packed structure Note: sample is from the zinc mines at Franklin, Sussex County, New Jersey, USA American Mineralogist, 1977, 62, 513-521 |
| 1531668 | CIF | Bi1.97 O8.9 Sr0.96 Ta2 | A m 2 m | 5.527; 5.5244; 24.9935 90; 90; 90 | 763.136 | Kim, J.S.; Cheon, C.-I.; Lee, C.H.; Choo, W.-G. Crystal structure of high temperature phase in (Bi2 O2)-layered perovskites A Bi2 M2 O9 (A = Pb, Sr; M = Nb, Ta) Journal of the Korean Ceramic Society, 2001, 38, 962-966 |
| 1000450 | CIF | C3 Eu Na3 O9 | A m a 2 | 9.942; 11.024; 7.147 90; 90; 90 | 783.3 | Mercier, N; Leblanc, M; Antic-Fidancev, E; Lemaitre-Blaise, M Structural and optical investigations of sodium europium carbonate Na3 Eu (C O3)3 Journal of Solid State Chemistry, 1997, 132, 33-40 |
| 1101148 | CIF | B3 Ca4 Na O9 | A m a 2 | 10.68004; 11.28574; 6.48521 90; 90; 90 | 781.68 | Li Wu; Xia Long Chen; Yan Ping Xu; Yan Ping Sun Structure Determination and Relative Properties of Novel Non-centrosymmetric Borates MM'~4~(BO~3~)~3~ (M=Na, M'=Ca and M=K, M'=Ca, Sr) Inorganic Chemistry, 2006, 45, 3042-3047 |
| 1101149 | CIF | B3 Ca4 K O9 | A m a 2 | 10.63455; 11.51705; 6.51942 90; 90; 90 | 798.49 | Li Wu; Xia Long Chen; Yan Ping Xu; Yan Ping Sun Structure Determination and Relative Properties of Novel Noncentrosymmetric Borates MM'~4~(BO~3~)~3~ (M = Na, M' = Ca and M = K, M' = Ca, Sr) Inorganic Chemistry, 2006, 45, 3042-3047 |
| 1101150 | CIF | B3 K O9 Sr4 | A m a 2 | 11.03843; 11.98974; 6.88446 90; 90; 90 | 911.14 | Li Wu; Xia Long Chen; Yan Ping Xu; Yan Ping Sun Structure Determination and Relative Properties of Novel Noncentrosymmetric Borates MM'~4~(BO~3~)~3~ (M = Na, N = Ca and M = K, M' = Ca, Sr) Inorganic Chemistry, 2006, 45, 3042-3047 |
| 1509657 | CIF | Ag2 K Nb Se4 | A m a 2 | 7.7413; 19.024; 5.6935 90; 90; 90 | 838.485 | Guo Guocong; Huang Jinshun; Zhou Guowei; Deng Lei; Dong Zhenchao; Ma Hongwei; Chen Wentong Syntheses and crystal structures of new quaternary Ag-containing group 5 chalcogenides: K Ag2 M(V) Se4 and K3 Ag3 M(V)2 S8 (M(V) = Nb, Ta) Bulletin of the Chemical Society of Japan, 2004, 77, 505-509 |
| 1509660 | CIF | Ag2 K Se4 Ta | A m a 2 | 7.8103; 19.004; 5.7303 90; 90; 90 | 850.531 | Ma Hongwei; Chen Wentong; Dong Zhenchao; Huang Jinshun; Deng Lei; Guo Guocong; Zhou Guowei Syntheses and crystal structures of new quaternary Ag-containing group 5 chalcogenides: K Ag2 M(V) Se4 and K3 Ag3 M(V)2 S8 (M(V) = Nb, Ta) Bulletin of the Chemical Society of Japan, 2004, 77, 505-509 |
| 1528472 | CIF | B H4 Li | A m a 2 | 6.4494; 5.307; 5.2919 90; 90; 90 | 181.126 | Filinchuk, Ya.; Chernyshov, D.; Nevidomskyy, A.; Dmitriev, V. High-pressure polymorphism as a step towards destabilization of Li B H4 Angew. Chem. Int. ed., 2008, 47, 529-532 |
| 1530483 | CIF | Ca4 Ge3 H2 O11 | A m a 2 | 21.1895; 10.577; 9.2494 90; 90; 90 | 2072.99 | Nevskii, N.N.; Ilyukhin, V.V.; Belov, N.V.; Ivanova, L.I. Structure of a new calcium triorthogermanate Ca4 (Ge3 O10) H2 O Doklady Akademii Nauk SSSR, 1978, 242, 1074-1077 |
| 1531545 | CIF | Al4 Cs4 O48 Si20 | A m a 2 | 16.72422; 13.78443; 5.02516 90; 90; 90 | 1158.47 | Hughes, R.W.; Weller, M.T. The structure of the CAS-type zeolite, Cs4 (Al4 Si20 O48) by high-resolution powder neutron diffraction and (29)Si MAS NMR Microporous and Mesoporous Materials, 2002, 51, 189-196 |
| 1532758 | CIF | H Li S | A m a 2 | 6.15687; 5.61841; 5.51478 90; 90; 90 | 190.766 | Winkler, B.; Hytha, M.; Milman, V. The low-temperature structure of Li S H Phase Transition, 2003, 76, 187-195 |
| 1533057 | CIF | Al F5 Mn | A m a 2 | 9.54; 9.85; 3.58 90; 90; 90 | 336.409 | Rimsky, A.; Freundlich, W.; Thoret, J. Structure cristalline du fluorure ternaire Al Mn F5 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-), 1970, 270, 407-409 |
| 1536638 | CIF | Ge Se4 Sr2 | A m a 2 | 10.284; 10.543; 7.411 90; 90; 90 | 803.532 | Pocha, R.; Tampier, M.; Poettgen, R.; Mosel, B.D.; Hoffmann, R.D.; Johrendt, D. Crystal structures and properties of the thiostannates Eu2 Sn S4 and Sr2 Sn S4 and the selenogermanate gamma-(Sr2 Ge Se4) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 1379-1384 |
| 1536641 | CIF | S4 Sn Sr2 | A m a 2 | 9.977; 10.311; 7.2432 90; 90; 90 | 745.129 | Pocha, R.; Hoffmann, R.D.; Tampier, M.; Mosel, B.D.; Poettgen, R.; Johrendt, D. Crystal structures and properties of the thiostannates Eu2 Sn S4 and Sr2 Sn S4 and the selenogermanate gamma-(Sr2 Ge Se4) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 1379-1384 |
| 1536681 | CIF | Cs Cu O | A m a 2 | 5.086; 10.238; 5.899 90; 90; 90 | 307.164 | Klassen, H.; Hoppe, R. Neue Oxocuprate(I): Zur Kenntnis von Cs Cu O Zeitschrift fuer Anorganische und Allgemeine Chemie, 1983, 497, 70-78 |
| 1539748 | CIF | B3 Cs H8 | A m a 2 | 8.8723; 8.6692; 7.4299 90; 90; 90 | 571.476 | Deiseroth, H.J.; Binder, H.; Sommer, O.; Wolfer, K.; Frei, B. Cs B3 H8: Kristallstruktur und Optimierung der Synthese Zeitschrift fuer Anorganische und Allgemeine Chemie, 1989, 571, 21-28 |
| 1539922 | CIF | Cr O3 | A m a 2 | 5.743; 8.557; 4.789 90; 90; 90 | 235.345 | Bystroem, A.; Wilhelmi, K.A. The crystal structure of chromium trioxide Acta Chemica Scandinavica (1-27,1973-42,1988), 1950, 4, 1131-1141 |
| 1540006 | CIF | Ba2 Ce2 F0.7 H1.7 Mn Na O27 Si8 Ti2 | A m a 2 | 22.301; 10.514; 9.669 90; 90; 90 | 2267.12 | Zubkova, N.V.; Pekov, I.V.; Pushcharovskii, D.Yu.; Giester, G.; Tillmanns, E.; Krotova, O.D. Crystal structure of byelorussite-(Ce) Na Mn Ba2 Ce2 (Ti O)2 (Si4 O12)2 (F, O H) H2 O Kristallografiya, 2004, 49, 1061-1065 |
| 1540317 | CIF | Cu2 K Se4 Ta | A m a 2 | 7.662; 18.829; 5.66 90; 90; 90 | 816.556 | Lu Yingjie; Ibers, J.A. Synthesis and characterization of Cu3 Nb Se4 and K Cu2 Ta Se4. Errata Journal of Solid State Chemistry, 1994, 111, 447-448 |
| 1540320 | CIF | Cu2 K Nb Se4 | A m a 2 | 7.645; 18.791; 5.663 90; 90; 90 | 813.531 | Lu, Y.-J.; Ibers, J.A. Synthesis and characterization of the new quaternary two-dimensional materials K Cu2 Nb Q4 (Q= Se, S) Journal of Solid State Chemistry, 1991, 94, 381-385 |
| 1541849 | CIF | C4 H2 Mn N6 O | A m a 2 | 7.5743; 17.45329; 5.6353 90; 90; 90 | 744.967 | Jensen, P.; Price, D.J.; Batten, S.R.; Murray, K.S.; Moubaraki, B. Self-penetration - a structural compromise between single networks and interpenetration: magnetic properties and crystal structures of (Mn (dca)2 (H2 O)) and (M (dca) (tcm)), M = Co, Ni, Cu, dca = dicyanamide, tcm = tricyanomethanide Chemistry - A European Journal, 2000, 6, 3186-3195 |
| 1549636 | CIF | C18 H22 B10 N | A m a 2 | 7.224; 24.584; 11.2382 90; 90; 90 | 1995.85 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles. Chemical science, 2018, 9, 6390-6394 |
| 1558643 | CIF | C35 H45 Al F2 N2 | A m a 2 | 22.3034; 19.6726; 7.40067 90; 90; 90 | 3247.16 | Rekhroukh, Feriel; Chen, Wenyi; Brown, Ryan; White, Andrew J. P.; Crimmin, Mark Richard Palladium-Catalysed C‒F Alumination of Fluorobenzenes: Mechanistic Diversity and Origin of Selectivity Chemical Science, 2020 |
| 1560458 | CIF | C31 H45 Ag3 Cl3 N11 O12 | A m a 2 | 6.4359; 41.977; 18.1773 90; 90; 90 | 4910.8 | Xiao, Ying-Hui; Huang, Jing; Deng, Zhao-Peng; Huo, Li-Hua; Gao, Shan Syntheses and characterizations of multinuclear, chain and layer silver(I) complexes assembled from bispyridine analogues of pyridinyl-hexahydropyrimidine Journal of Solid State Chemistry, 2017, 251, 255-265 |
| 1562914 | CIF | B3 K O9 Sr4 | A m a 2 | 11.025; 11.977; 6.872 90; 90; 90 | 907.4 | Zhao, Wenwu; Pan, Shilie; Wang, Yongjiang; Yang, Zhihua; Wang, Xian; Han, Jian Structure, growth and properties of a novel polar material, KSr4B3O9 Journal of Solid State Chemistry, 2012, 195, 73-78 |
| 1563222 | CIF | C18 H12 Cl Cu2 N4 O2 | A m a 2 | 13.317; 10.5909; 11.8134 90; 90; 90 | 1666.2 | Shi, Ling; Yang, Ping; Huang, Guang; Li, Qian; Wang, Ning; Wu, Jian-Zhong; Yu, Ying C‒H⋯Cl relevant discrepancy on structure, magnetic and electronic conductivity of two mixed-valence CuICuII coordination polymers Journal of Solid State Chemistry, 2011, 184, 1699-1706 |
| 1563552 | CIF | Cr7 K2 O38 Th3 | A m a 2 | 19.3021; 15.5803; 11.3178 90; 90; 90 | 3403.6 | Sigmon, Ginger E.; Burns, Peter C. Crystal chemistry of thorium nitrates and chromates Journal of Solid State Chemistry, 2010, 183, 1604-1608 |
| 1567667 | CIF | Cd S4 Si Sr | A m a 2 | 10.2821; 10.1551; 6.3699 90; 90; 90 | 665.12 | Yang, He-Di; Ran, Mao-Yin; Zhou, Sheng-Hua; Wu, Xin-Tao; Lin, Hua; Zhu, Qi-Long Rational design via dual-site aliovalent substitution leads to an outstanding IR nonlinear optical material with well-balanced comprehensive properties Chemical Science, 2022, 13, 10725-10733 |
| 1568703 | CIF | C7 H6 N4 | A m a 2 | 9.8121; 15.2562; 4.5459 90; 90; 90 | 680.5 | Horiuchi, Sachio; Minemawari, Hiromi; Ishibashi, Shoji Competition of polar and antipolar states hidden behind a variety of polarization switching modes in hydrogen-bonded molecular chains. Materials horizons, 2023, 10, 2149-2159 |
| 1573036 | CIF | C58 H91.5 F12 N26 O17.75 P2 | A m a 2 | 17.47878; 27.72924; 15.22975 90; 90; 90 | 7381.45 | Závodná, Aneta; Janovský, Petr; Kolařík, Václav; Ward, Jas S.; Prucková, Zdeňka; Rouchal, Michal; Rissanen, Kari; Vícha, Robert Allosteric release of cucurbit[6]uril from a rotaxane using a molecular signal. Chemical science, 2024, 16, 83-89 |
| 2002766 | CIF | Ba Cu O7 Te2 | A m a 2 | 5.4869; 15.412; 7.2066 90; 90; 90 | 609.4 | Sedello, O; Mueller-Buschbaum, Hk Synthese und Kristallstruktur des Barium-Kupfer-TelluritTellurats Ba Cu (Te O3) (Te O4) Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1996, 51, 465-468 |
| 2006785 | CIF Paper | C4 H6 N6 | A m a 2 | 9.3307; 19.372; 3.6982 90; 90; 90 | 668.47 | Richard Goddard; Oliver Heinemann; Carl Krüger Pyrrole and a Co-crystal of 1<i>H</i>- and 2<i>H</i>-1,2,3-Triazole Acta Crystallographica Section C, 1997, 53, 1846-1850 |
| 2009345 | CIF Paper | Cu2 K Se4 V | A m a 2 | 7.5803; 18.4838; 5.5653 90; 90; 90 | 779.77 | Tillinski, Ralf; Näther, Christian; Bensch, Wolfgang KCu~2~VSe~4~ Acta Crystallographica Section C, 1999, 55, 1959-1961 |
| 2011900 | CIF HKL Paper | Cu2 Rb S4 V | A m a 2 | 7.382; 18.187; 5.413 90; 90; 90 | 726.7 | Tillinski, Ralf; Näther, Christian; Bensch, Wolfgang RbCu~2~VS~4~ Acta Crystallographica Section C, 2001, 57, 333-334 |
| 2015445 | CIF Paper | Mo2 O7 Rb2 | A m a 2 | 11.8887; 12.8303; 10.2464 90; 90; 90 | 1562.94 | Solodovnikova, Zoya A.; Solodovnikov, Sergey F. Rubidium dimolybdate, Rb~2~Mo~2~O~7~, and caesium dimolybdate, Cs~2~Mo~2~O~7~ Acta Crystallographica Section C, 2006, 62, i53-i56 |
| 2017757 | CIF HKL Paper | C14 H16 Cu5 I6 P | A m a 2 | 18.211; 23.6861; 5.8206 90; 90; 90 | 2510.7 | Jalilian, Ehsan; Lidin, Sven Poly[dimethyldiphenylphosphonium [di-μ~4~-iodido-tetra-μ~3~-iodido-pentacopper(I)]] Acta Crystallographica Section C, 2010, 66, m227-m230 |
| 2019161 | CIF HKL Paper | C24 H40 B In N6 | A m a 2 | 16.6414; 15.8504; 10.3779 90; 90; 90 | 2737.4 | Yurkerwich, Kevin; Rong, Yi; Parkin, Gerard Gallium hydride and monovalent indium compounds that feature tris(pyrazolyl)hydroborate ligands Acta Crystallographica Section C, 2013, 69, 963-967 |
| 2101306 | CIF Paper | Al2 O4 Pb | A m a 2 | 8.458; 9.234; 5.07 90; 90; 90 | 395.973 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101307 | CIF Paper | Ga2 O4 Pb | A m a 2 | 8.575; 9.424; 5.22 90; 90; 90 | 421.832 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101311 | CIF Paper | C6 H16 Co N5 O7 | A m a 2 | 12.717; 12.206; 7.717 90; 90; 90 | 1197.86 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2102431 | CIF Paper | C7 H6 N4 | A m a 2 | 9.807; 15.232; 4.54 90; 90; 90 | 678.186 | Marsh, Richard E. Space group <i>Cc</i>: an update Acta Crystallographica Section B, 2004, 60, 252-253 |
| 2104488 | CIF Paper | C26 H26 Ga N O2 P2 | A m a 2 | 17.743; 14.8424; 9.6445 90; 90; 90 | 2539.9 | Marsh, Richard E. Space groups <i>P</i>1 and <i>Cc</i>: how are they doing? Acta Crystallographica Section B, 2009, 65, 782-783 |
| 2108891 | CIF | C6 H12 N3 O3 | A m a 2 | 12.1054; 13.5537; 5.20741 90; 90; 90 | 854.4 | Gallo, Gianpiero; Terban, Maxwell W.; Moudrakovski, Igor; Huber, Tatjana; Etter, Martin; Ernst, Martin; Hinrichsen, Bernd; Dinnebier, Robert E. A previously unknown cyclic alkanolamine and molecular ranking using the pair distribution function Acta Crystallographica Section B, 2021, 77, 986-995 |
| 2201293 | CIF HKL Paper | C9 H14 Cl3 Hg N | A m a 2 | 7.4699; 14.379; 12.5687 90; 90; 90 | 1350 | Nockemann, Peter; Meyer, Gerd Trimethylphenylammonium trichloromercurate(II), (Me~3~PhN)[HgCl~3~] Acta Crystallographica Section E, 2002, 58, m527-m528 |
| 2208896 | CIF HKL Paper | C26 H23 Br3 Fe N P | A m a 2 | 22.3226; 16.5842; 7.2972 90; 90; 90 | 2701.4 | Garagorri-Benito, David; Kirchner, Karl; Mereiter, Kurt Tetraphenylphosphonium acetonitriletribromoferrate(II) Acta Crystallographica Section E, 2006, 62, m1136-m1138 |
| 2211896 | CIF HKL Paper | C24 H40 B Cl Co N6 | A m a 2 | 16.429; 16.035; 10.6255 90; 90; 90 | 2799.2 | Gregory M. Ferrence; Adam D. Beitelman Chloro[hydridotris(3-<i>tert</i>-butyl-5-methylpyrazolyl)borato]cobalt(II) Acta Crystallographica Section E, 2007, 63, m153-m155 |
| 2226794 | CIF HKL Paper | C21 H17 N13 O Se4 Zn3 | A m a 2 | 15.6156; 22.6489; 8.6626 90; 90; 90 | 3063.8 | Reinert, Thorben; Boeckmann, Jan; Jess, Inke; Näther, Christian <i>catena</i>-Poly[[μ~3~-hydroxido-tetra-μ~2~-pyridazine-1:2κ^4^<i>N</i>:<i>N</i>';1:3κ^2^<i>N</i>:<i>N</i>';2:3κ^2^<i>N</i>:<i>N</i>'-tetrakis(selenocyanato)-1κ<i>N</i>,2κ<i>N</i>,3κ^2^<i>N</i>-trizinc(II)]-μ-cyanido-1:2'κ^2^<i>C</i>:<i>N</i>] Acta Crystallographica Section E, 2010, 66, m1018-m1019 |
| 2233005 | CIF HKL Paper | C9 H8 N2 | A m a 2 | 10.074; 18.151; 4.1562 90; 90; 90 | 760 | Mehdizadeh Barforoush, Maryam; Naderi, Soheila; Ghanbarpour, Ali Reza; Azhdari Tehrani, Alireza; Khavasi, Hamid Reza 2-Phenyl-1<i>H</i>-imidazole Acta Crystallographica Section E, 2011, 67, o3248 |
| 2300524 | CIF | Cl O4 P Sn2 | A m a 2 | 13.52; 8.673; 4.74 90; 90; 90 | 555.807 | Berndt, A.F.; Sylvester, J.M. Crystal data on tin(II) phosphate chloride, Sn2 P O4 Cl Journal of Applied Crystallography, 1972, 5, 248-249 |
| 2310212 | CIF | Pt2 U | A m a 2 | 5.6; 9.68; 4.12 90; 90; 90 | 223.337 | Hatt, B.A.; Williams, G.I. The crystal structure of U Pt2 Acta Crystallographica (1,1948-23,1967), 1959, 12, 655-657 |
| 3000000 | CIF | C Ca O3 | A m a 2 | 8.4721; 7.1575; 4.1265 90; 90; 90 | 250.23 | Armel Le Bail; Salim Ouhenia; Daniel Chateigner Microtwinning hypothesis for a more ordered vaterite model Powder Diffraction, 2011, 26, 16-21 |
| 3000016 | On hold until 2012-10-18 | B3 O9 Rb Sr4 | A m a 2 | 11.128; 12.155; 6.952 90; 90; 90 | 940.3 | xiamingjun; Li; R.K. Crystal structure and Optical Properties of a Noncentrosymmetric Borate RbSr4(BO3)3 To be published in J.Solid State Chem |
| 4000415 | CIF | C9 H15 N3 O3 S | A m a 2 | 7.4368; 21.845; 7.2227 90; 90; 90 | 1173.4 | Chemistry of Materials, 2004 |
| 4000567 | CIF | Ba Cu2 Se4 Sn | A m a 2 | 11.1215; 11.2373; 6.7531 90; 90; 90 | 843.97 | Chemistry of Materials, 2005 |
| 4002951 | CIF | Ge Hg Se4 Sr | A m a 2 | 10.8375; 10.7456; 6.6377 90; 90; 90 | 773 | Guo, Yangwu; Liang, Fei; Yin, Wenlong; Li, Zhuang; Luo, Xiaoyu; Lin, Zhe-Shuai; Yao, Jiyong; Mar, Arthur; Wu, Yicheng BaHgGeSe4 and SrHgGeSe4: Two New Hg-Based Infrared Nonlinear Optical Materials Chemistry of Materials, 2019, 31, 3034 |
| 4002952 | CIF | Ba Ge Hg Se4 | A m a 2 | 11.255; 11.033; 6.6847 90; 90; 90 | 830.1 | Guo, Yangwu; Liang, Fei; Yin, Wenlong; Li, Zhuang; Luo, Xiaoyu; Lin, Zhe-Shuai; Yao, Jiyong; Mar, Arthur; Wu, Yicheng BaHgGeSe4 and SrHgGeSe4: Two New Hg-Based Infrared Nonlinear Optical Materials Chemistry of Materials, 2019, 31, 3034 |
| 4030897 | CIF | Cu2 Na Nb S4 | A m a 2 | 7.451; 18.416; 5.542 90; 90; 90 | 760.5 | Rumpf, C.; Nather, C.; Jeb, I.; Bensch, W. Synthesis, crystal structure and optical absorptions of the two-dimensional sulfide NaCu2NbS4 European Journal of Solid State and Inorganic Chemistry, 1997, 34, 1165-1177 |
| 4030898 | CIF | Cu2 Na Nb S4 | A m a 2 | 7.406; 18.313; 5.522 90; 90; 90 | 748.9 | Rumpf, C.; Nather, C.; Jeb, I.; Bensch, W. Synthesis, crystal structure and optical absorptions of the two-dimensional sulfide NaCu2NbS4 European Journal of Solid State and Inorganic Chemistry, 1997, 34, 1165-1177 |
| 4038230 | CIF | C26 H28 N4 O4 S2 | A m a 2 | 27.2818; 14.841; 6.2806 90; 90; 90 | 2542.9 | Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry, 2020, 85, 5351-5361 |
| 4065515 | CIF | C28 H41 Br4 Fe2 N11 | A m a 2 | 20.707; 13.316; 13.837 90; 90; 90 | 3815.34 | Meyer, Steffen; Orben, Claudia Manuela; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc Synthesis and Characterization of Di- and Tetracarbene Iron(II) Complexes with Chelating N-Heterocyclic Carbene Ligands and Their Application in Aryl Grignard‒Alkyl Halide Cross-Coupling Organometallics, 2011, 30, 6692 |
| 4066832 | CIF | C8 H27 B10 Br Ni P2 | A m a 2 | 15.253; 11.484; 11.8579 90; 90; 90 | 2077.1 | Qiu, Zaozao; Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis and Structural Characterization of Group 10 Metal−Carboryne Complexes Organometallics, 2010, 29, 4541 |
| 4071221 | CIF | C32 H64 Si8 Zr | A m a 2 | 28.738; 16.791; 9.5167 90; 90; 90 | 4592 | Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith Group 4 Metallocene Complexes of Tris(trimethylsilyl)silylacetylene and Related Alkynes Organometallics, 2008, 27, 2570 |
| 4078101 | CIF | C22 H46 Al N Si | A m a 2 | 14.8891; 18.0127; 9.6036 90; 90; 90 | 2575.62 | Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide Organometallics, 2012, 31, 3272 |
| 4089612 | CIF | C12 H8 O7 W | A m a 2 | 7.6044; 12.0731; 14.8012 90; 90; 90 | 1358.88 | Landman, Marilé; Pretorius, René; Buitendach, Blenerhassitt E.; van Rooyen, Petrus H.; Conradie, Jeanet Synthesis, Structure, and Electrochemistry of Fischer Alkoxy- and Aminocarbene Complexes of Tungsten: The Use of DFT To Predict and Understand Oxidation and Reduction Potentials Organometallics, 2013, 32, 5491 |
| 4100299 | CIF | C8 H9 N O S | A m a 2 | 9.2374; 18.966; 4.6027 90; 90; 90 | 806.37 | Journal of the American Chemical Society, 2005 |
| 4121641 | CIF | Br2 Cd I2 Rb2 | A m a 2 | 11.764; 12.025; 8.446 90; 90; 90 | 1194.8 | Wu, Qi; Meng, Xianggao; Zhong, Cheng; Chen, Xingguo; Qin, Jingui Rb2CdBr2I2: A New IR Nonlinear Optical Material with a Large Laser Damage Threshold. Journal of the American Chemical Society, 2014, 136, 5683 |
| 4122386 | CIF | C14 H14 N2 O2 | A m a 2 | 6.8074; 21.719; 7.9131 90; 90; 90 | 1169.95 | Hsu, Yen-Hao; Chen, Yi-An; Tseng, Huan-Wei; Zhang, Zhiyun; Shen, Jiun-Yi; Chuang, Wei-Ti; Lin, Tzu-Chieh; Lee, Chun-Shu; Hung, Wen-Yi; Hong, Bor-Cherng; Liu, Shih-Hung; Chou, Pi-Tai Locked ortho- and para-Core Chromophores of Green Fluorescent Protein; Dramatic Emission Enhancement via Structural Constraint. Journal of the American Chemical Society, 2014, 136, 11805-11812 |
| 4301658 | CIF | C25 H28 Cl F3 N3 P | A m a 2 | 13.7194; 18.513; 9.5476 90; 90; 90 | 2425 | Allen T. Ekubo; Mark R. J. Elsegood; Andrew J. Lake; Martin B. Smith Intramolecular Hydrogen-Bonded Tertiary Phosphines as 1,3,5-Triaza-7-phosphaadamantane (PTA) Analogues Inorganic Chemistry, 2009, 48, 2633-2638 |
| 4316187 | CIF | Ag Ge2 O12 U2 | A m a 2 | 7.1241; 10.771; 14.024 90; 90; 90 | 1076.1 | Jie Ling; Jessica M. Morrison; Matthew Ward; Kelsey Poinsatte-Jones; Peter C. Burns Syntheses, Structures, and Characterization of Open-Framework Uranyl Germanates Inorganic Chemistry, 2010, 49, 7123-7128 |
| 4320828 | CIF | Eu Li P Se4 | A m a 2 | 10.5592; 10.415; 6.4924 90; 90; 90 | 714 | Jennifer A. Aitken; Konstantinos Chondroudis; Victor G. Young,; Mercouri G. Kanatzidis LiEuPSe4 and KEuPSe4: Novel Selenophosphates with the Tetrahedral [PSe4]3- Building Block Inorganic Chemistry, 2000, 39, 1525-1533 |
| 4322126 | CIF | H6 Hg I3 N O | A m a 2 | 8.7246; 9.786; 11.1103 90; 90; 90 | 948.59 | Per H. Svensson; Lars Kloo Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions Inorganic Chemistry, 1999, 38, 3390-3393 |
| 4328447 | CIF | Ba Mg O7 Te2 | A m a 2 | 5.558; 15.215; 7.307 90; 90; 90 | 617.9 | Jeongho Yeon; Sang-Hwan Kim; Sau Doan Nguyen; Hana Lee; P. Shiv Halasyamani Two New Noncentrosymmetric (NCS) Polar Oxides: Syntheses, Characterization, and Structure-Property Relationships in BaMTe2O7 (M = Mg2+ or Zn2+) Inorganic Chemistry, 2012, 51, 2662-2668 |
| 4328448 | CIF | Ba O7 Te2 Zn | A m a 2 | 5.5498; 15.3161; 7.3098 90; 90; 90 | 621.34 | Jeongho Yeon; Sang-Hwan Kim; Sau Doan Nguyen; Hana Lee; P. Shiv Halasyamani Two New Noncentrosymmetric (NCS) Polar Oxides: Syntheses, Characterization, and Structure-Property Relationships in BaMTe2O7 (M = Mg2+ or Zn2+) Inorganic Chemistry, 2012, 51, 2662-2668 |
| 4328830 | CIF | As Eu Na S4 | A m a 2 | 9.9985; 9.962; 6.7637 90; 90; 90 | 673.7 | Tarun K. Bera; Mercouri G. Kanatzidis Na2EuAs2S5, NaEuAsS4, and Na4Eu(AsS4)2: Controlling the Valency of Arsenic in Polysulfide Fluxes Inorganic Chemistry, 2012, 51, 4293-4299 |
| 4330245 | CIF | C64 H64 Mn3 N8 O12 | A m a 2 | 33.611; 13.8679; 13.7856 90; 90; 90 | 6425.7 | Lu-Fang Ma; Min-Le Han; Jian-Hua Qin; Li-Ya Wang; Miao Du MnIICoordination Polymers Based on Bi-, Tri-, and Tetranuclear and Polymeric Chain Building Units: Crystal Structures and Magnetic Properties Inorganic Chemistry, 2012, 51, 9431-9442 |
| 4335929 | CIF | C15 H40 Ge11 N3 O25.5 | A m a 2 | 37.82959; 15.24373; 12.83659 90; 90; 90 | 7402.4 | Yan Xu; Leifeng Liu; Daniel M. Chevrier; Junliang Sun; Peng Zhang; Jihong Yu Germanate with Three-Dimensional 12 x 12 x 11-Ring Channels Solved by X-ray Powder Diffraction with Charge-Flipping Algorithm Inorganic Chemistry, 2013, 52, 10238-10244 |
| 4341857 | CIF | Ba3 Eu3 Na O20 Si6 | A m a 2 | 14.777; 23.926; 5.5533 90; 90; 90 | 1963.4 | Heyward, Carla C.; McMillen, Colin D.; Kolis, Joseph W. Hydrothermal growth of lanthanide borosilicates: a useful approach to new acentric crystals including a derivative of cappelenite. Inorganic chemistry, 2015, 54, 905-913 |
| 4344008 | CIF | B7 Cs2 Li5 O14 | A m a 2 | 21.2775; 13.6296; 4.4283 90; 90; 90 | 1284.22 | Li, Lin; Han, Shujuan; Lei, Binghua; Dong, Xiaoyu; Wu, Hongping; Zhou, Zhongxiang; Yang, Zhihua; Pan, Shilie Two New Crystals in LimCsnBm+nO2(m+n) (m + n = 5, 7; m > n) Series: Noncentrosymmetric Li5Cs2B7O14 and Centrosymmetric Li4CsB5O10. Inorganic chemistry, 2015, 54, 7381-7387 |
| 4349009 | CIF | C2 H7 N O0 S8 Sb4 | A m a 2 | 10.0371; 26.6752; 5.9349 90; 90; 90 | 1589.02 | Nie, Lina; Zhang, Yu; Xiong, Wei-Wei; Lim, Teik-Thye; Xu, Rong; Yan, Qingyu; Zhang, Qichun A surfactant-thermal method to prepare crystalline thioantimonate for high-performance lithium-ion batteries Inorganic Chemistry Frontiers, 2016, 3, 111 |
| 4504445 | CIF | C6 H4 Cu2 N2 S2 | A m a 2 | 7.3433; 8.5921; 12.889 90; 90; 90 | 813.2 | Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions Crystal Growth & Design, 2007, 7, 2352 |
| 4507351 | CIF | C11 H6 Br N2 O5 Zn | A m a 2 | 12.8977; 8.1974; 11.2059 90; 90; 90 | 1184.77 | Zhang, Yu; Guo, Beibei; Li, Li; Liu, Shaofeng; Li, Gang Construction and Properties of Six Metal‒Organic Frameworks Based on the Newly Designed 2-(p-Bromophenyl)-Imidazole Dicarboxylate Ligand Crystal Growth & Design, 2013, 13, 367 |
| 4512830 | CIF | C3 H Cl3 N2 | A m a 2 | 9.9264; 16.0761; 3.8161 90; 90; 90 | 608.96 | Andrzejewski, Michał; Marciniak, Jędrzej; Rajewski, Kacper W.; Katrusiak, Andrzej Halogen and Hydrogen Bond Architectures in Switchable Chains of Di- and Trihaloimidazoles Crystal Growth & Design, 2015, 15, 1658 |
| 4512831 | CIF | C3 H Br3 N2 | A m a 2 | 10.1305; 16.7094; 4.0483 90; 90; 90 | 685.27 | Andrzejewski, Michał; Marciniak, Jędrzej; Rajewski, Kacper W.; Katrusiak, Andrzej Halogen and Hydrogen Bond Architectures in Switchable Chains of Di- and Trihaloimidazoles Crystal Growth & Design, 2015, 15, 1658 |
| 4513025 | CIF | C26 H33 N O6 | A m a 2 | 13.8342; 22.8608; 7.8578 90; 90; 90 | 2485.11 | Drużbicki, Kacper; Mielcarek, Jadwiga; Kiwilsza, Anna; Toupet, Loic; Collet, Eric; Pajzderska, Aleksandra; Wąsicki, Jan Computationally Assisted (Solid-State Density Functional Theory) Structural (X-ray) and Vibrational Spectroscopy (FT-IR, FT-RS, TDs-THz) Characterization of the Cardiovascular Drug Lacidipine Crystal Growth & Design, 2015, 15, 2817 |
| 7001144 | CIF | C12 H16 Ag Cl2 N5 O3 S | A m a 2 | 6.579; 27.779; 8.637 90; 90; 90 | 1578.5 | Wu, Hua; Dong, Xian-Wu; Ma, Jian-Fang; Liu, Hai-Yan; Yang, Jin; Bai, Hong-Ye Influence of anionic sulfonate-containing and nitrogen-containing mixed-ligands on the structures of silver coordination polymers Dalton Transactions, 2009, 3162-3174 |
| 7004030 | CIF | C3 H6 Cl2.5 N1.5 Re0.5 | A m a 2 | 7.266; 26.3894; 7.3267 90; 90; 90 | 1404.86 | Martínez-Lillo, José; Armentano, Donatella; Marino, Nadia; Arizaga, Livia; Chiozzone, Raúl; González, Ricardo; Kremer, Carlos; Cano, Joan; Faus, Juan Pentachloro(pyrazine)rhenate(iv) complex as precursor of heterobimetallic pyrazine-containing ReIV2MII (M = Ni, Cu) species: synthesis, crystal structures and magnetic properties Dalton Transactions, 2008, 4585 |
| 7005391 | CIF | C8 H23 B9 I8 N2 | A m a 2 | 11.1115; 14.8951; 17.5202 90; 90; 90 | 2899.7 | Teixidor, Francesc; Barberà, Gemma; Kivekäs, Raikko; Sillanpää, Reijo; Viñas, Clara "Water-stable boron-iodinated dicarbollide dianions [7,8-nido-C2H2B9I9]2- and [7,8-nido-C2H2B9I8H]2-". Dalton transactions (Cambridge, England : 2003), 2007, 1668-1670 |
| 7006802 | CIF | C H29 K6 N3 Na O50.5 Si W11 | A m a 2 | 19.457; 22.581; 11.069 90; 90; 90 | 4863.3 | Chiba, Hirokazu; Wada, Akihide; Ozeki, Tomoji Cation-controlled assembly of Na±linked lacunary alpha-Keggin tungstosilicates. Dalton transactions (Cambridge, England : 2003), 2006, 1213-1217 |
| 7009662 | CIF | C3 H9 I5 S | A m a 2 | 15.841; 9.3342; 9.363 90; 90; 90 | 1384.4 | Svensson, Per H.; Kloo, Lars A vibrational spectroscopic, structural and quantum chemical study of the triiodide ion Dalton (2000), 2000, 2449-2455 |
| 7027115 | CIF | C11 H23 B F4 Mo O P2 | A m a 2 | 17.289; 15.201; 6.6459 90; 90; 90 | 1746.6 | Fettinger, James C.; Kraatz, Heinz-Bernhard; Poli, Rinaldo; Quadrelli, E. Alessandra Formation of organometallic hydroxo and oxo complexes by oxidation of transition metal hydrides in the presence of water. X-Ray structures of [CpMo(OH)(PMe3)3][BF4] and [CpMo(O)(PMe3)2][BF4] Journal of the Chemical Society, Dalton Transactions, 1999, 497 |
| 7029055 | CIF | C8 H15 N9 O Zn | A m a 2 | 15.1635; 17.9739; 10.0176 90; 90; 90 | 2730.27 | Wang, Fei; Hou, Duan-Chuan; Yang, Hui; Kang, Yao; Zhang, Jian Tetrahedral tetrazolate frameworks for high CO2 and H2 uptake. Dalton transactions (Cambridge, England : 2003), 2014, 43, 3210-3214 |
| 7029056 | CIF | C5 H10 N8 O Zn | A m a 2 | 15.6799; 18.1616; 9.6615 90; 90; 90 | 2751.3 | Wang, Fei; Hou, Duan-Chuan; Yang, Hui; Kang, Yao; Zhang, Jian Tetrahedral tetrazolate frameworks for high CO2 and H2 uptake. Dalton transactions (Cambridge, England : 2003), 2014, 43, 3210-3214 |
| 7034649 | CIF | C37 H58 Cl4 Co2 N8 O13 | A m a 2 | 24.1438; 17.6734; 10.6296 90; 90; 90 | 4535.68 | Caballero-Jiménez, Judith; Habib, Fatemah; Ramírez-Rosales, Daniel; Grande-Aztatzi, Rafael; Merino, Gabriel; Korobkov, Ilia; Singh, Mukesh Kumar; Rajaraman, Gopalan; Reyes-Ortega, Yasmi; Murugesu, Muralee Inducing magnetic communication in caged dinuclear Co(ii) systems. Dalton transactions (Cambridge, England : 2003), 2015, 44, 8649-8659 |
| 7034650 | CIF | C37 H58 Br Cl3 Co2 N8 O13 | A m a 2 | 24.3318; 17.6327; 10.6002 90; 90; 90 | 4547.9 | Caballero-Jiménez, Judith; Habib, Fatemah; Ramírez-Rosales, Daniel; Grande-Aztatzi, Rafael; Merino, Gabriel; Korobkov, Ilia; Singh, Mukesh Kumar; Rajaraman, Gopalan; Reyes-Ortega, Yasmi; Murugesu, Muralee Inducing magnetic communication in caged dinuclear Co(ii) systems. Dalton transactions (Cambridge, England : 2003), 2015, 44, 8649-8659 |
| 7039820 | CIF | Ga6 Pb5 S15 Zn | A m a 2 | 22.232; 17.933; 6.225 90; 90; 90 | 2481.8 | Duan, Rui-Huan; Yu, Ju-Song; Lin, Hua; Zheng, Yu-Jun; Zhao, Hua-Jun; Huang-Fu, Shang-Xiong; Khan, Muhammad Ali; Chen, Ling; Wu, Li-Ming Pb5Ga6ZnS15: a noncentrosymmetric framework with chains of T2-supertetrahedra. Dalton transactions (Cambridge, England : 2003), 2016, 45, 12288-12291 |
| 7040604 | CIF | B6 K O13 U | A m a 2 | 32.347; 6.4311; 11.143 90; 90; 90 | 2318 | Xu, Xiaomei; Liu, Zhiyong; Yang, Shitong; Chen, Lanhua; Diwu, Juan; Alekseev, Evgeny V.; Chai, Zhifang; Albrecht-Schmitt, Thomas E; Wang, Shuao Potassium uranyl borate 3D framework compound resulted from temperature directed hydroborate condensation: structure, spectroscopy, and dissolution studies. Dalton transactions (Cambridge, England : 2003), 2016, 45, 15464-15472 |
| 7048380 | CIF | C22.31 H35.62 B2 Cl2.31 F8 N6 O0.35 Pd | A m a 2 | 25.6757; 21.3064; 11.7797 90; 90; 90 | 6444.2 | Ashida, Yoshiko; Manabe, Yumehiro; Yoshioka, Shota; Yoneda, Tomoki; Inokuma, Yasuhide Control over coordination self-assembly of flexible, multidentate ligands by stepwise metal coordination of isopyrazole subunits. Dalton transactions (Cambridge, England : 2003), 2019, 48, 818-822 |
| 7058371 | CIF | B3 Ca4 K O9 | A m a 2 | 10.621; 11.489; 6.534 90; 90; 90 | 797 | Ren, Peng; Yang, Yun; Li, Hao; Yang, Zhihua; Pan, Shilie Two alkali calcium borates exhibiting second harmonic generation and deep-UV cutoff edges New Journal of Chemistry, 2019, 43, 9354 |
| 7058372 | CIF | B3 Ca4 K0.59 O9 Rb0.41 | A m a 2 | 10.62; 11.543; 6.523 90; 90; 90 | 799.6 | Ren, Peng; Yang, Yun; Li, Hao; Yang, Zhihua; Pan, Shilie Two alkali calcium borates exhibiting second harmonic generation and deep-UV cutoff edges New Journal of Chemistry, 2019, 43, 9354 |
| 7059710 | CIF | C9 H2 N15 O4 S Zn2 | A m a 2 | 17.2632; 25.2792; 10.2353 90; 90; 90 | 4466.7 | Talha, Khalid; Alamgir,; He, Tao; Xie, Lin-Hua; Wang, Bin; Zhao, Min-Jian; Zhang, Yong-Zheng; Chen, Qiang; Li, Jian-Rong A three-dimensional metal‒organic framework with high performance of dual cation sensing synthesized via single-crystal transformation New Journal of Chemistry, 2020, 44, 11829-11834 |
| 7063421 | CIF | B3 F4 H K2 O4 | A m a 2 | 25.9308; 22.5853; 7.4632 90; 90; 90 | 4370.86 | Ouyang, Tao; Chen, Xu; Chen, Shanshan; Li, Yanqiang; Shang, Xiaoying; Bai, Zhiyong; Jiang, Ningtao; Yan, Zhishuo; Luo, Junhua; Zhao, Sangen A nonlinear optical crystal with deep-ultraviolet transparency and appropriate birefringence achieved using π-conjugated confined [B3O3F4(OH)]2− New Journal of Chemistry, 2024, 48, 15281-15286 |
| 7111610 | CIF | C6 H11 Cu N2 O | A m a 2 | 9.7119; 12.2714; 6.2836 90; 90; 90 | 748.87 | Ley, Amanda N.; Dunaway, Lars E.; Brewster, Timothy P.; Dembo, Matthew D.; Harris, T. David; Baril-Robert, François; Li, Xiaobo; Patterson, Howard H.; Pike, Robert D. Reversible luminescent reaction of amines with copper(i) cyanide Chemical Communications, 2010, 46, 4565-4567 |
| 7114072 | CIF | C14 H9 Cu N6 S | A m a 2 | 20.649; 8.9701; 7.4121 90; 90; 90 | 1372.9 | Barnett, Sarah A.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire Structural isomerism in CuSCN coordination polymers Chemical Communications, 2002, 1640 |
| 7114914 | CIF | C10 H10 Cl5 Fe N2 | A m a 2 | 16.651; 11.6816; 7.2764 90; 90; 90 | 1415.3 | Dolling, Ben; Gillon, Amy L.; Orpen, A. Guy; Starbuck, Jonathan; Wang, Xi-Meng Homologous families of chloride-rich 4,4′-bipyridinium salt structures Chemical Communications, 2001, 567 |
| 7125399 | CIF | C24 H28 N4 O S3 | A m a 2 | 32.1098; 13.472; 5.7153 90; 90; 90 | 2472.34 | Zhan, Shun-Ze; Li, Jing-Hong; Zhang, Guo-Hui; Liu, Xiao-Wei; Li, Mian; Zheng, Ji; Ng, Seik Weng; Li, Dan A luminescent edge-interlocked prismatic heteroleptic metallocage assembled through a ligand replacement reaction. Chemical communications (Cambridge, England), 2019, 55, 11992-11995 |
| 7130537 | CIF | C33 H76 B18 K2 N2 O7 | A m a 2 | 60.951; 17.6644; 9.8809 90; 90; 90 | 10638.4 | Tej, Varun; McArthur, Sarah; Banda, Isaac; Gregory, Aaron; Fisher, Steven P.; McArthur, Scott; Lavallo, Vince Fusing 10-vertex closo-Carborane Anions with N-Heterocyclic Carbenes Chemical Communications, 2022 |
| 7150483 | CIF | C30 H24 N4 O5 | A m a 2 | 35.743; 9.285; 7.338 90; 90; 90 | 2435.3 | Bensemann, Igor; Gdaniec, Maria; Łakomecka, Karina; Milewska, Maria J.; Połoński, Tadeusz Creation of hydrogen bonded 1D networks by co-crystallization of N,N'-bis(2-pyridyl)aryldiamines with dicarboxylic acidsSupramolecular structures formed by 2-aminopyridine derivatives. Part II.5 Organic & Biomolecular Chemistry, 2003, 1, 1425 |
| 7208199 | CIF | C42 H37 B Cd3 F5 N7 O8 | A m a 2 | 20.6365; 18.1133; 12.6984 90; 90; 90 | 4746.6 | Xie, Zai-Lai; Feng, Mei-Ling; Tan, Bin; Huang, Xiao-Ying The multifunctional roles of the ionic liquid [Bmim][BF4] in the creation of cadmium metal‒organic frameworks CrystEngComm, 2012, 14, 4894 |
| 7208643 | CIF | B7 Li5 O14 Rb2 | A m a 2 | 20.376; 13.5114; 4.39 90; 90; 90 | 1208.6 | Yang, Yun; Pan, Shilie; Hou, Xueling; Dong, Xiaoyu; Su, Xin; Yang, Zhihua; Zhang, Min; Zhao, Wenwu; Chen, Zhaohui Li5Rb2B7O14: a new congruently melting compound with two kinds of B‒O one-dimensional chains and short UV absorption edge CrystEngComm, 2012, 14, 6720 |
| 7216450 | CIF | C3 Gd Na3 O9 | A m a 2 | 9.926; 10.992; 7.12 90; 90; 90 | 776.8 | Luo, Min; Lin, Chensheng; Zou, Guohong; Ye, Ning; Cheng, Wendan Sodium–rare earth carbonates with shorite structure and large second harmonic generation response CrystEngComm, 2014, 16, 4414 |
| 7216451 | CIF | C3 Na3 O9 Y | A m a 2 | 9.82; 10.883; 7.038 90; 90; 90 | 752.2 | Luo, Min; Lin, Chensheng; Zou, Guohong; Ye, Ning; Cheng, Wendan Sodium–rare earth carbonates with shorite structure and large second harmonic generation response CrystEngComm, 2014, 16, 4414 |
| 7220165 | CIF | C16 H32 Cl Cu3 I4 N4 O4 | A m a 2 | 28.8; 10.33; 9.2214 90; 90; 90 | 2743.4 | Zeng, Guang; Xing, Shanghua; Han, Xu; Xin, Bingjing; Yang, Yulin; Wang, Xiuru; Li, Guanghua; Shi, Zhan; Feng, Shouhua Reversible photoluminescence switching behavior and luminescence thermochromism of copper (І) halide cluster coordination polymers RSC Adv., 2015 |
| 7220166 | CIF | C16 H32 Cl Cu3 I4 N4 O4 | A m a 2 | 28.536; 10.276; 9.2102 90; 90; 90 | 2700.8 | Zeng, Guang; Xing, Shanghua; Han, Xu; Xin, Bingjing; Yang, Yulin; Wang, Xiuru; Li, Guanghua; Shi, Zhan; Feng, Shouhua Reversible photoluminescence switching behavior and luminescence thermochromism of copper (І) halide cluster coordination polymers RSC Adv., 2015 |
| 7221225 | CIF | Cd K2 Pb | A m a 2 | 6.458; 8.602; 10.955 90; 90; 90 | 608.569 | Matthes, R.; Schuster, H.U. Synthese und Struktur der Phasen K2 Cd Sn und K2 Cd Pb Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986), 1979, 34, 541-543 |
| 7228408 | CIF | Ba Cu2 Se4 Sn | A m a 2 | 11.101; 11.189; 6.728 90; 90; 90 | 835.7 | Nian, Leyan; Huang, Junben; Wu, Kui; Su, Zhi; Yang, Zhihua; Pan, Shilie BaCu2MIVQ4 (MIV = Si, Ge, and Sn; Q = S, Se): synthesis, crystal structures, optical performances and theoretical calculations RSC Adv., 2017, 7, 29378 |
| 7229379 | CIF | C7 H Ag2 N7 O7 | A m a 2 | 6.6521; 16.2005; 11.0651 90; 90; 90 | 1192.5 | Du, Ceng-Ceng; Wang, Xin-Fang; Zhou, Sheng-Bin; Wang, Duo-Zhi; Jia, Dianzeng New complexes constructed from in situ nitration of (1H-tetrazol-5-yl)phenol: synthesis, structures and properties CrystEngComm, 2017 |
| 7237661 | CIF | C10 H21 B2 Cu F8 O S4 | A m a 2 | 12.8692; 14.15; 10.846 90; 90; 90 | 1975 | Zhao, Yawei; Shen, Junyu; Yu, Ze; Hu, Maowei; Liu, Chong; Fan, Jiandong; Han, Hongxian; Hagfeldt, Anders; Wang, Mei; Sun, Licheng Fine-tuning the coordination atoms of copper redox mediators: an effective strategy for boosting the photovoltage of dye-sensitized solar cells Journal of Materials Chemistry A, 2019, 7, 12808 |
| 7238704 | CIF | C12 H18 F6 Li N6 P | A m a 2 | 14.83; 9.225; 14.606 90; 90; 90 | 1998.2 | Seo, Daniel M.; Boyle, Paul D.; Borodin, Oleg; Henderson, Wesley A. Li+ cation coordination by acetonitrile—insights from crystallography RSC Advances, 2012, 2, 8014 |
| 7239729 | CIF | C17 H14 Co N4 O4 | A m a 2 | 33.563; 12.204; 10.119 90; 90; 90 | 4145 | Wang, Jun; Chen, Ning-Ning; Zhang, Chen; Jia, Li-Yong; Fan, Liming Functional group induced structural diversities and photocatalytic, magnetic and luminescence sensing properties of four cobalt(ii) coordination polymers based on 1,3,5-tris(2-methylimidazol-1-yl)benzene CrystEngComm, 2020, 22, 811-820 |
| 7700574 | CIF | C38 H58 N5 O Si2 Y | A m a 2 | 18.4951; 21.577; 10.5804 90; 90; 90 | 4222.3 | Wang, Fenhua; Zhao, Xu; Meng, Xianfu; Wang, Shaowu Rare-earth complexes supported by an ansa-bis(amidinate) ligand with a rigid o-phenylene linker: synthesis, structure, and catalytic activity for polymerization of cyclic esters. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12193-12198 |
| 7700576 | CIF | C38 H58 Er N5 O Si2 | A m a 2 | 18.498; 21.5082; 10.6134 90; 90; 90 | 4222.6 | Wang, Fenhua; Zhao, Xu; Meng, Xianfu; Wang, Shaowu Rare-earth complexes supported by an ansa-bis(amidinate) ligand with a rigid o-phenylene linker: synthesis, structure, and catalytic activity for polymerization of cyclic esters. Dalton transactions (Cambridge, England : 2003), 2019, 48, 12193-12198 |
| 7701944 | CIF | Cd Eu Ge S4 | A m a 2 | 10.2731; 10.1827; 6.4354 90; 90; 90 | 673.19 | Xing, Wen-Hao; Wang, Naizheng; Guo, Yangwu; Li, Zhuang; Tang, Jian; Kang, Kaijin; Yin, Wenlong; Lin, Zheshuai; Yao, Jiyong; Bin, Kang Two rare-earth-based quaternary chalcogenides EuCdGeQ4 (Q = S, Se) with strong second-harmonic generation Dalton Transactions, 2019 |
| 7701945 | CIF | Cd Eu Ge Se4 | A m a 2 | 10.7525; 10.6275; 6.674 90; 90; 90 | 762.65 | Xing, Wen-Hao; Wang, Naizheng; Guo, Yangwu; Li, Zhuang; Tang, Jian; Kang, Kaijin; Yin, Wenlong; Lin, Zheshuai; Yao, Jiyong; Bin, Kang Two rare-earth-based quaternary chalcogenides EuCdGeQ4 (Q = S, Se) with strong second-harmonic generation Dalton Transactions, 2019 |
| 7703480 | CIF | C18 H20 Ba2 N2 O21 P4 S2 | A m a 2 | 15.596; 24.683; 8.749 90; 90; 90 | 3368 | Wöhlbrandt, Stephan; Igeska, Angela; Svensson Grape, Erik; Øien-Ødegaard, Sigurd; Ken Inge, A.; Stock, Norbert Permanent porosity and role of sulfonate groups in coordination networks constructed from a new polyfunctional phosphonato-sulfonate linker molecule. Dalton transactions (Cambridge, England : 2003), 2020, 49, 2724-2733 |
| 7704111 | CIF | Li2 Na2 O7 P2 | A m a 2 | 13.272; 9.007; 5.04 90; 90; 90 | 602.5 | Wen, Ming; Hu, Cong; Wu, Hongping; Yang, Zhihua; Wu, Xiaohong; Pan, Shilie Three diphosphates, α-Li<sub>2</sub>Na<sub>2</sub>P<sub>2</sub>O<sub>7</sub>, Li<sub>8</sub>Pb<sub>3</sub>Ba(P<sub>2</sub>O<sub>7</sub>)<sub>4</sub> and Li<sub>7</sub>Rb(P<sub>2</sub>O<sub>7</sub>)<sub>2</sub>: influences of co-substitution on the crystal structure. Dalton transactions (Cambridge, England : 2003), 2020, 49, 6744-6750 |
| 7707486 | CIF | C51 H75 Cl Ga N2 Na O4 Si | A m a 2 | 19.4444; 17.6536; 14.8679 90; 90; 90 | 5103.6 | Dodonov, Vladimir A.; Kushnerova, Olga A.; Baranov, Evgeny V.; Novikov, Alexander S.; Fedushkin, Igor L. Activation and modification of carbon dioxide by redox-active low-valent gallium species. Dalton transactions (Cambridge, England : 2003), 2021, 50, 8899-8906 |
| 7710064 | CIF | C10 H20 Br4 Hg2 S4 | A m a 2 | 14.1565; 15.7413; 4.526 90; 90; 90 | 1008.58 | Viau, Lydie; Knorr, Michael; Knauer, Lena; Brieger, Lukas; Strohman, Carsten 2,2’-Ethylenebis(1,3-dithiane) as polydentate m2-, m4- and m5-assembling ligand for the construction of sulphur-rich Cu(I), Hg(II) and heterometallic Cu(I)/Hg(II) coordination polymers featuring uncommon network architectures Dalton Transactions, 2022 |
| 7710286 | CIF | Ba5 Fe2 In4 S15 Zn | A m a 2 | 23.458; 18.551; 6.464 90; 90; 90 | 2813 | Almoussawi, Batoul; Duffort, Victor; Arevalo-Lopez, Angel M; Braun, Maxime; Djelal, Nora; Kabbour, Houria Preparation, characterization and DFT+U study of the polar Fe<sup>3+</sup>-based phase Ba<sub>5</sub>Fe<sub>2</sub>ZnIn<sub>4</sub>S<sub>15</sub> containing <i>S</i> = 5/2 zigzag chains. Dalton transactions (Cambridge, England : 2003), 2022, 51, 9522-9530 |
| 7712066 | CIF | C14 H34 I6 N6 O | A m a 2 | 30.562; 10.349; 9.908 90; 90; 90 | 3133.8 | Zhang, Haina; You, Xiuli; Zhang, Mengxia; Guo, Wenjing; Wei, Zhenhong; Cai, Hu Two metal-free perovskite molecules with different 3D frameworks show reversible phase transition, dielectric anomaly and SHG effect. Dalton transactions (Cambridge, England : 2003), 2023, 52, 1753-1760 |
| 7712866 | CIF | Ag P S4 Sr | A m a 2 | 10.0941; 10.0305; 6.4002 90; 90; 90 | 648.01 | Xing, Wenhao; Tang, Jian; Liang, Fei; Tang, Chunlan; Wu, Jieyun; Yin, Wenlong; Bin, Kang; Deng, Jianguo Quaternary alkaline-earth metal thiophosphate SrAgPS4: syntheses, structure, and optical properties Dalton Transactions, 2023 |
| 8100161 | CIF | C17 H22 Cr F6 P | A m a 2 | 15.9186; 15.6388; 7.2709 90; 90; 90 | 1810.07 | Hradsky, Andreas; Kopacka, Holger; Bildstein, Benno; Wurst, Klaus Crystal structure of (η^7^-2,4,6-cycloheptatrien-1-ylium)(η^5^-1,2,3,4,5- pentamethyl-2,4-cyclopentadien-1-yl)chromium(I) hexafluorophosphate, [Cr(C~7~H~7~)(C~10~H~15~)][PF~6~] Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 371-372 |
| 8101228 | CIF | N2 O Rb2 W | A m a 2 | 6.154; 20.963; 12.169 90; 90; 90 | 1569.7 | Niewa, Rainer; Jacobs, Herbert Crystal structure of dirubidium oxodinitridotungstate(VI), Rb~2~[WN~2~O] Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 17-18 |
| 8103527 | CIF | Al Cs0.814 O12 Si5 | A m a 2 | 16.776; 13.828; 5.021 90; 90; 90 | 1164.76 | Araki, T. Crystal structure of a cesium alumosilicate, Cs (Al Si5 O12) Zeitschrift fuer Kristallographie (149,1979-), 1980, 152, 207-213 |
| 9009465 | CIF | Ca H2 O8 Si2 Zn2 | A m a 2 | 12.51; 6.318; 8.561 90; 90; 90 | 676.646 | Hamilton, R. D.; Finney, J. J. The structure of junitoite, CaZn2Si2O7*H2O Mineralogical Magazine, 1985, 49, 91-95 |
| 9012661 | CIF | Ba1.9 Ce2 F0.7 Fe0.16 H2.3 K0.05 Mg0.05 Mn0.52 Na0.95 O27.3 Si8 Sr0.1 Ti2 Zn0.27 | A m a 2 | 22.301; 10.514; 9.669 90; 90; 90 | 2267.12 | Zubkova, N. V.; Pushcharovsky, D. Y.; Giester, G.; Tillmanns, E.; Pekov, I. V.; Krotova, O. D. Crystal structure of byelorussite-(Ce) NaMnBa2Ce2(TiO)2[Si4O12]2(F,OH)*H2O Crystallography Reports, 2004, 49, 964-968 |
| 9014240 | CIF | Ca4 H2 O11 Si3 | A m a 2 | 20.5805; 10.324; 9.1053 90; 90; 90 | 1934.6 | Armbruster, T.; Lazic, B.; Galuskina, I. O.; Galuskin, E. V.; Gnos, E.; Marzec, K. M.; Gazeev, V. M. Trabzonite, Ca4[Si3O9(OH)]OH: crystal structure, revised formula, new occurrence and relation to killalaite Mineralogical Magazine, 2012, 76, 455-472 |
| 9017410 | CIF | C Ca O3 | A m a 2 | 8.4905; 6.3905; 4.5026 90; 90; 90 | 244.305 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
| 1000285 | CIF | Bi2 Ca Cu2 O8 Sr2 | A m a a | 5.4054; 5.4016; 30.7152 90; 90; 90 | 896.8 | Hervieu, M; Michel, C; Domenges, B; Laligant, Y; Lebail, A; Ferey, G; Raveau, B Electron microscopy study of the superconductor "Bi~2~ Sr~2~ Ca Cu~2~ O~8~" Modern Physics Letters B, 1988, 2, 491-500 |
| 1008677 | CIF | Bi Mn O6 Pb Sr2 | A m a a | 5.3204; 5.3796; 23.71399 90; 90; 90 | 678.7 | Levy, D; Fu, W T; Ijdo, D J W; Catti, M Crystal structure of Bi Pb Sr2 Mn O6 by powder neutron diffraction Solid State Communications, 1994, 92, 659-663 |
| 1520924 | CIF | Bi0.9888 Ca1.57 Mn2 O9 Pb0.6592 Sr1.43 | A m a a | 5.3314; 5.3697; 31.067 90; 90; 90 | 889.387 | Catti, M.; Levy, D.; Artioli, G. Synchrotron X-ray powder diffraction study of (Bi, Pb)1.64 Sr1.43 Ca1.57 Mn2 O9, Mn-analogue of BSCCO-2212 superconductor Journal of Solid State Chemistry, 1999, 147, 501-508 |
| 1521502 | CIF | Bi1.64 Ca1.83 Cu2.72 Hg0.01 O8.58 Pb0.4 Sr1.47 | A m a a | 5.4056; 5.4156; 37.079 90; 90; 90 | 1085.47 | Li, D.Y.; O'Connor, B.H.; Hunter, B.A.; McKinnon, C.W.; Cookson, D.J.; Garrett, R.F.; van Riessen, A. Characterisation of mercury-substituted (Bi, Pb)2 Sr2 Ca2 Cu3 Ox (2223) high-Tc phase using synchrotron radiation and neutron diffraction data Advances in X-Ray Analysis, 1998, 40, 413-421 |
| 1526841 | CIF | Bi2 Cu2 O8.5 Pr Sr2 | A m a a | 5.487; 5.507; 30.33 90; 90; 90 | 916.479 | Lee, T.-J.; Huang, C.F.; Yeh, K.W.; Teo, C.C.; Khor, T.S.; Ku, H.C.; Sakabe, K.; Huang, Y.; Hung, H.H.; Sakabe, N. X-ray structure analysis of Bi2212 using synchrotron source and high dynamic range imaging plate detector Chinese Journal of Physics (Taipei), 2000, 38, 243-261 |
| 1540940 | CIF | Bi2 Ca Cu2 O9.07 Sr2 | A m a a | 5.423; 5.376; 30.72 90; 90; 90 | 895.612 | Sequeira, A.; Rajagopal, H.; Yakhmi, J.V. On the coordination of bismuth in Bi2 Ca Sr2 Cu2 O8 - A2aa/Amaa structures revisited Physica C (Amsterdam), 1989, 157, 515-519 |
| 1541124 | CIF | Bi2.15 Ca0.75 Cu2 O8 Sr1.92 | A m a a | 5.408; 5.413; 30.871 90; 90; 90 | 903.702 | Petricek, V.; Gao, Y.; Lee, P.; Coppens, P. X-ray analysis of the incommensurate modulation in the 2:2:1:2 Bi-Sr-Ca-Cu-O superconductor including the oxygen atoms Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1990, 42, 387-392 |
| 1548782 | CIF | F N O4 Pb2 | A m a a | 5.78377; 14.63528; 5.81352 90; 90; 90 | 492.098 | Dmitri O. Charkin; Igor V. Plokhikh; Alexandr N. Zaloga; Maxim V. Lobanov; Sergey M. Kazakov One disorder out of two orders: Synthesis and crystal structures of cation-ordered PbNaF2NO3, anion-ordered Pb2OFNO3, and continuous disordered (Pb, Na)2(O,F)2-deltaNO3 solid solution with Sillen-derived structures Solid State Sciences, 2017, 71, 111-116 |
| 2310291 | CIF | Bi1.11 Ca0.8 Cu2 O8.144 Sr1.82 | A m a a | 5.408; 5.413; 30.871 90; 90; 90 | 903.702 | Gao, Y.; Coppens, P.; Cox, D. E.; Moodenbaugh, A. R. Combined x-ray single-crystal and neutron powder refinement of modulated structures and application to the incommensurately modulated structure of Bi~2~Sr~2~CaCu~2~O~8+y~ Acta Crystallographica Section A, 1993, 49, 141-148 |
| 2310292 | CIF | Bi1.05 Ca0.96 Cu2 O8.144 Sr1.75 | A m a a | 5.415; 5.4149; 30.861 90; 90; 90 | 904.896 | Gao, Y.; Coppens, P.; Cox, D. E.; Moodenbaugh, A. R. Combined x-ray single-crystal and neutron powder refinement of modulated structures and application to the incommensurately modulated structure of Bi~2~Sr~2~CaCu~2~O~8+y~ Acta Crystallographica Section A, 1993, 49, 141-148 |
| 1001208 | CIF | K Nb3 O8 | A m a m | 8.903; 21.16; 3.799 90; 90; 90 | 715.7 | Gasperin, M Structure du Triniobate(V) de Potassium K Nb~3~ O~8~, un Niobate Lamellaire Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2024-2026 |
| 1001255 | CIF | Cs3 Nb5.96 O16.4 | A m a m | 18.315; 24.506; 7.296 90; 90; 90 | 3274.6 | Saine, M C; Gasperin, M Synthese et Structure d'un Niobate de Cesium non Stoechiometrique, Cs~3~ Nb~5.96~ O~16.4~ Acta Crystallographica C (39,1983-), 1983, 39, 1153-1156 |
| 1001337 | CIF | Cs0.75 K0.25 Nb O11 Ti U2 | A m a m | 7.63; 10.923; 13.609 90; 90; 90 | 1134.2 | Gasperin, M (Cs~.75~ K~.25~) (Nb, Ti) U~2~ O~11~: un Niobotitanouranate Alcalin de Type Sructural Nouveau Acta Crystallographica C (39,1983-), 1986, 42, 136-138 |
| 1011026 | CIF | Fe H O2 | A m a m | 3.87; 12.51; 3.06 90; 90; 90 | 148.1 | Ewing, F J The Crystal Structure of Lepidocrocite Journal of Chemical Physics, 1935, 3, 420-424 |
| 1011088 | CIF | Fe H O2 | A m a m | 3.87; 12.4; 3.06 90; 90; 90 | 146.8 | Goldsztaub, M S Etude de quelques derives de l'oxyde ferrique (Fe O.OH, FeO2Na, FeOCl) determination de leurs structures. Bulletin de la Societe Francaise de Mineralogie (-71,1948), 1935, 58, 6-6 |
| 1521521 | CIF | La3 Ni2 O7 | A m a m | 5.39283; 5.44856; 20.51849 90; 90; 90 | 602.898 | Ling, C.D.; Argyriou, D.N.; Wu, G.-Q.; Neumeier, J.J. Neutron diffraction study of La3 Ni2 O7 : structural relationships among n = 1, 2, and 3 phases Lan+1 Nin O3n+1 Journal of Solid State Chemistry, 2000, 152, 517-525 |
| 1529177 | CIF | F4 Mo O2 Rb2 | A m a m | 7.084; 14.273; 5.972 90; 90; 90 | 603.829 | Sergienko, V.S.; Porai-Koshits, M.A.; Shodatchova, T.S. Crystal Structure of Rb2 Mo O2 F4 Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 1972, 13, 461-467 |
| 1529744 | CIF | Li O5 V2 | A m a m | 11.2423; 9.9054; 3.6018 90; 90; 90 | 401.095 | Cava, R.J.; Fleming, R.M.; Santoro, A.; Murphy, D.W.; Zahurak, S.M.; Marsh, P.; Roth, R.S. The structure of the lithium-inserted metal oxide delta lithium vanadium oxide Li V2 O5 Journal of Solid State Chemistry, 1986, 65, 63-71 |
| 1530710 | CIF | F13 O9 Pb3 Ta5 | A m a m | 22.48; 20.83; 3.928 90; 90; 90 | 1839.32 | Savborg, O. Structures of Niobium and Tantalum Oxide Fluorides Containing Lone Pair-Ions III.Pb3 Ta5 O9 F13: A Layer Structure Comprising Unidimensional Infinite Pb X (X = O or F) Elements Journal of Solid State Chemistry, 1985, 57, 148-153 |
| 1532844 | CIF | Bi4 O11 V2 | A m a m | 11.2333; 5.64925; 15.3471 90; 90; 90 | 973.923 | Mairesse, G.; Roussel, P.; Vannier, R.N.; Anne, M.; Nowogrocki, G.; Pirovano, C. Crystal structure determination of alpha-, beta- and gamma-(Bi4 V2 O11) polymorphs. Part I: gamma- and beta-(Bi4 V2 O11) Solid State Sciences, 2003, 5, 851-859 |
| 1542177 | CIF | Cl5 Cs2 H2 O Rh | A m a m | 8.023; 17.271; 7.353 90; 90; 90 | 1018.87 | Thomas, C.K.; Stanko, J.A. The crystal structure of cesium aquopentachlororhodate(II) Journal of Coordination Chemistry, 1973, 2, 231-234 |
| 2310516 | CIF | Rh3 Te2 | A m a m | 7.694; 12.446; 3.697 90; 90; 90 | 354.023 | Zachariasen, W.H. The Crystal Structure of Rh2 Te3 Acta Crystallographica (1,1948-23,1967), 1966, 20, 334-349 |
| 4123987 | CIF | C H2 Cl4 Cs2 O2 Ru | A m a m | 8.096; 17.19; 7.437 90; 90; 90 | 1035.01 | Stanko, J.A.; Chaipayungpundhu, S. Crystal structure of cesium trans-tetrachloroaquocarbonylruthenate(II) Journal of the American Chemical Society, 1970, 92, 5580-5585 |
| 9002376 | CIF | Cl2 O5 Pb3 W | A m a m | 11.073; 13.067; 5.617 90; 90; 90 | 812.729 | Grice, J. D.; Dunn, P. J. Crystal-structure determination of pinalite American Mineralogist, 2000, 85, 806-809 |
| 9010135 | CIF | Cl2 Mo O5 Pb3 | A m a m | 11.0116; 13.1149; 5.59485 90; 90; 90 | 807.986 | Charkin, D. O.; Lightfoot, P. Synthesis of novel lead - molybdenum and tungsten oxyhalides with the pinalite structure, Pb3MoO5Cl2 and Pb3WO5Br2 American Mineralogist, 2006, 91, 1918-1921 |
| 9015088 | CIF | Al H0.08 O2 | A m a m | 3.693; 12.221; 2.865 90; 90; 90 | 129.304 | Hill, R. J. Hydrogen atoms in boehmite: A single crystal X-ray diffraction and molecular orbital study Clays and Clay Minerals, 1981, 29, 435-445 |
| 9015125 | CIF | O7 Si2 Sr V | A m a m | 7.06; 14.64; 5.33 90; 90; 90 | 550.9 | Takeuchi, Y.; Joswig, W. The structure of haradaite and a note on the Si-O bond lengths in silicates Mineralogical Journal, 1967, 5, 98-123 |
| 9017086 | CIF | Al0.22 Cr0.3 Fe2.15 Mg0.26 O4 Si0.08 | A m a m | 9.8; 9.6; 2.87 90; 90; 90 | 270.01 | Koch-Muller M; Mugnaioli, E.; Rhede, D.; Speziale, S.; Kolb, U.; Wirth, R. Synthesis of a quenchable high-pressure form of magnetite (h-Fe3O4) with composition Fe1(Fe2+0.75Mg0.26)Fe2(Fe3+0.70Cr0.15Al0.11Si0.04)2O4 Note: Sample Crystal 1 American Mineralogist, 2014, 99, 2405-2415 |
| 9017087 | CIF | Al0.22 Cr0.3 Fe2.15 Mg0.26 O4 Si0.08 | A m a m | 9.8; 9.6; 2.87 90; 90; 90 | 270.01 | Koch-Muller M; Mugnaioli, E.; Rhede, D.; Speziale, S.; Kolb, U.; Wirth, R. Synthesis of a quenchable high-pressure form of magnetite (h-Fe3O4) with composition Fe1(Fe2+0.75Mg0.26)Fe2(Fe3+0.70Cr0.15Al0.11Si0.04)2O4 Note: Sample Crystal 2 American Mineralogist, 2014, 99, 2405-2415 |
| 1001725 | CIF | Cr Cu4 O20 Sr8 Tl3 | A m m 2 | 3.778; 15.244; 17.67699 90; 90; 90 | 1018.1 | Martin, C; Letouze, F; Maignan, A; Seshadri, R; Michel, C; Hervieu, M; Raveau, B The superconducting copper oxychromate Tl3 (Cr O4) Sr8 Cu4 O16 : long- range ordering between thallium and chromium Chemistry of Materials (1,1989-, 1996, 8, 865-873 |
| 1001822 | CIF | B0.8 Mn3.2 O10 Sr4 | A m m 2 | 3.7865; 15.854; 7.654 90; 90; 90 | 459.5 | Pelloquin, D; Hervieu, M; Michel, C; Nguyen, N; Raveau, B A new manganese oxyborate, Sr4 Mn3 (B1-x Mnx) O10, closely related to the perovskite structure type Journal of Solid State Chemistry, 1997, 134, 395-408 |
| 1508068 | CIF | C60 Cl6 Li Sb | A m m 2 | 12.297; 9.9506; 29.05 90; 90; 90 | 3554.6 | Aoyagi, Shinobu; Nishibori, Eiji; Sawa, Hiroshi; Sugimoto, Kunihisa; Takata, Masaki; Miyata, Yasumitsu; Kitaura, Ryo; Shinohara, Hisanori; Okada, Hiroshi; Sakai, Takeshi; Ono, Yoshihiro; Kawachi, Kazuhiko; Yokoo, Kuniyoshi; Ono, Shoichi; Omote, Kenji; Kasama, Yasuhiko; Ishikawa, Shinsuke; Komuro, Takashi; Tobita, Hiromi A layered ionic crystal of polar Li@C(60) superatoms. Nature chemistry, 2010, 2, 678-683 |
| 1509917 | CIF | Ag5 Cl2 P S4 | A m m 2 | 7.409; 11.143; 6.258 90; 90; 90 | 516.651 | Mewis, A.; Joergens, S. Ag5 P S4 Cl2 and Ag15 (P S4)4 Cl3 - crystal structures and their relation to Ag3 P S4 Solid State Sciences, 2007, 9, 213-217 |
| 1510476 | CIF | Au2 V | A m m 2 | 4.684; 8.482; 4.81 90; 90; 90 | 191.1 | Schubert, K.; Stolz, E. Strukturuntersuchungen in einigen zu T4-B1 homologen und quasihomologen Systemen Zeitschrift fuer Metallkunde, 1962, 53, 433-444 |
| 1510507 | CIF | Au3 Mg | A m m 2 | 23.59; 5.74; 19.83 90; 90; 90 | 2685.11 | Burkhardt, K.; Schubert, K. Ueber die Strukturen einiger Phasen in der Naehe der Zusammensetzung Au3 Mg Zeitschrift fuer Metallkunde, 1965, 56, 864-870 |
| 1521131 | CIF | Al D1.04 Ni Tb | A m m 2 | 3.8257; 12.4668; 7.2964 90; 90; 90 | 347.996 | Hauback, B.C.; Palhaugen, L.; Fjellvag, H.; Yartys', V.A.; Yvon, K. Crystal and magnetic structure of Tb Ni Al - based deuterides, Tb Ni Al D0.3 and Tb Ni Al D1.04, studied by neutron diffraction and synchrotron radiation Journal of Alloys Compd., 1999, 293, 178-184 |
| 1522913 | CIF | Gd Sn3 | A m m 2 | 4.3552; 4.4039; 22.044 90; 90; 90 | 422.801 | Skolozdra, R.V.; Pecharskii, V.K.; Aksel'rud, L.G.; Koretskaya, O.E. Two crystal structures in the Gd - Sn system Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya B: Geologichni, Khimichni ta Biologichni Nauki, 1986, 1986, 51-54 |
| 1523063 | CIF | Rh5 V3 | A m m 2 | 4.32; 5.42; 9.276 90; 90; 90 | 217.192 | Waterstrat, R.M.; Dickens, B. The crystal structure of V3 Rh5 Journal of the Less-Common Metals, 1973, 31, 61-67 |
| 1524452 | CIF | Eu3 Ga5 | A m m 2 | 15.333; 4.577; 11.018 90; 90; 90 | 773.234 | Grin', Yu.; Yatsenko, S.P.; Fedorova, E.G.; Sabirzyanov, N.A.; Sichevich, O.M.; Yarmolyuk, Ya.P. Die Kristallstruktur von Eu3 Ga5 Journal of the Less-Common Metals, 1987, 136, 55-60 |
| 1524607 | CIF | Cu11 Sb3 | A m m 2 | 4.324; 19.08; 4.724 90; 90; 90 | 389.739 | Jandali, M.Z.; Rajasekharan, T.; Schubert, K. Crystal structure of Au10 In3 Zeitschrift fuer Metallkunde, 1982, 73, 354-359 |
| 1526310 | CIF | P7 Pd9 Zr5 | A m m 2 | 3.815; 26.3189; 6.511 90; 90; 90 | 653.747 | Heerdmann, A.; Mewis, A.; Johrendt, D. Palladiumpnictide des Zirconiums und Hafniums mit einem Metall: Nichtmetall-Verhaeltnis von 2:1 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 1393-1399 |
| 1526312 | CIF | Hf5 P7 Pd9 | A m m 2 | 3.776; 26.382; 6.5 90; 90; 90 | 647.52 | Heerdmann, A.; Johrendt, D.; Mewis, A. Palladiumpnictide des Zirconiums und Hafniums mit einem Metall:Nichtmetall-Verhaeltnis von 2:1 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 1393-1399 |
| 1531157 | CIF | Al D1.23 Ni Tb | A m m 2 | 3.6689; 12.3714; 7.6583 90; 90; 90 | 347.606 | Brinks, H.W.; Yartys', V.A.; Fjellvag, H.; Hauback, B.C. Structure and magnetic properties of (Tb Ni Al)-based deuterides Journal of Alloys Compd., 2002, 330, 169-174 |
| 1533266 | CIF | Ni Si3 Y | A m m 2 | 4.01; 3.947; 20.958 90; 90; 90 | 331.712 | Yarovets, V.I. The crystal structure of Y Ni Si3 compound Vestn. L'vov. Un-ta. Ser. Khim., 1977, 1977, 30-34 |
| 1540302 | CIF | Ce2 Cu Ge6 | A m m 2 | 4.0756; 4.2152; 21.5408 90; 90; 90 | 370.06 | Konyk, M.B.; Salamakha, P.S.; Bodak, O.I.; Pecharskii, V.K. Crystal structue of Cu2 Cu Ge6 Soviet Physics, Crystallography (= Kristallografiya), 1988, 33, 494-495 |
| 1540777 | CIF | C2 Dy Ni | A m m 2 | 3.552; 4.49; 6.018 90; 90; 90 | 95.978 | Yakinthos, J.K.; Reimers, W.; Kotsanidis, P.A.; Schaefer, W.; Will, G.; Kockelmann, W. The two-component non-collinear antiferromagnetic structures of Dy Ni C2 and Ho Ni C2 Journal of Magnetism and Magnetic Materials, 1994, 136, 327-334 |
| 1540778 | CIF | C2 Ho Ni | A m m 2 | 3.53; 4.486; 6.014 90; 90; 90 | 95.235 | Yakinthos, J.K.; Kotsanidis, P.A.; Will, G.; Schaefer, W.; Kockelmann, W.; Reimers, W. The two-component non-collinear antiferromagnetic structures of Dy Ni C2 and Ho Ni C2 Journal of Magnetism and Magnetic Materials, 1994, 136, 327-334 |
| 1541393 | CIF | C24 H68 F4 N4 O116 Si56 | A m m 2 | 12.525; 11.391; 22.053 90; 90; 90 | 3146.35 | Corma, A.; Puche, M.; Teat, S.J.; Rey, F.; Sankar, G. A zeolite structure (ITQ-13) with three sets of medium-pore crossing channels formed by 9- and 10-rings Angew. Chem. Int. ed., 2003, 42, 1156-1159 |
| 1541780 | CIF | O34 U13 | A m m 2 | 4.143; 51.532; 6.74 90; 90; 90 | 1438.97 | Kovba, L.M.; Komarevtseva, N.I.; Kuz'mitcheva, E.U. On the Crystal Structures of U13 O34 and delta-U2 O5 Radiokhimiya, 1979, 21, 754-757 |
| 1567997 | CIF | C2 H2 I2 O4 Pb Rb2 | A m m 2 | 6.0662; 6.7946; 13.7817 90; 90; 90 | 568.046 | Zhang, Xiang-Yu; Zhou, Zi-Qi; Bao, Wen-Xiu; Tang, Hong-Xin; Fu, Rui-Biao; Ma, Zu-Ju; Wu, Xin-Tao New lead-iodide formates with a strong second-harmonic generation response and suitable birefringence obtained by the substitution strategy. Chemical science, 2022, 14, 136-142 |
| 1567998 | CIF | C2 H2 I2 K2 O4 Pb | A m m 2 | 5.8024; 6.774; 13.626 90; 90; 90 | 535.58 | Zhang, Xiang-Yu; Zhou, Zi-Qi; Bao, Wen-Xiu; Tang, Hong-Xin; Fu, Rui-Biao; Ma, Zu-Ju; Wu, Xin-Tao New lead-iodide formates with a strong second-harmonic generation response and suitable birefringence obtained by the substitution strategy. Chemical science, 2022, 14, 136-142 |
| 1568981 | CIF | Nb O3 Rb | A m m 2 | 3.99152; 5.8223; 5.86394 90; 90; 90 | 136.277 | Fukuda, M.; Yamaura, K. Experimental studies on crystal structures and phase transitions in perovskite-type RbNbO3 : At 300 K Journal of the Ceramic Society of Japan, 2023, 131, 126-129 |
| 1572534 | CIF | B3 K2 La2 Na O9 | A m m 2 | 5.1775; 11.4157; 7.2715 90; 90; 90 | 429.78 | Song, Jie; Zhao, Huijian; Li, Conggang; Ye, Ning; Hu, Zhanggui; Wu, Yicheng A-site cation manipulation of exemplary second harmonic generation response and optical anisotropy in rare-earth borates. Chemical science, 2024, 15, 16196-16204 |
| 2002323 | CIF | Ba4 Co O30 Ta10 | A m m 2 | 3.905; 10.203; 14.954 90; 90; 90 | 595.8 | Jasper-Toennies, B; Mueller-Buschbaum, Hk Ein neues Oxotantalat mit bronzeaehnlicher Kristallstruktur: Ba4 Co Ta10 O30 Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-), 1984, 115, 1151-1157 |
| 2002363 | CIF | Ba4 Fe O30 Ta10 | A m m 2 | 3.906; 10.201; 14.99 90; 90; 90 | 597.3 | Brandt, R; Mueller-Buschbaum, Hk Ba4 Fe Ta10 O30, eine neue Verbindung mit Verwandtschaft zum Na Nb6 O15 F-Typ Zeitschrift fuer Anorganische und Allgemeine Chemie, 1986, 542, 18-24 |
| 2002368 | CIF | Ba4 Mg O30 Ta10 | A m m 2 | 3.9001; 10.2225; 14.9737 90; 90; 90 | 597 | Brandt, R; Mueller-Buschbaum, Hk Zur Kenntnis von Ba4 Mg Ta10 O30 und Ba4 Ni Ta10 O30 Verbindungen mit Verwandtschaft zur tetragonalen Wolfram Bronze und zu Na Nb6 O15 F - Typ Zeitschrift fuer Anorganische und Allgemeine Chemie, 1987, 551, 13-20 |
| 2002369 | CIF | Ba4 Ni O30 Ta10 | A m m 2 | 3.911; 10.2; 14.955 90; 90; 90 | 596.6 | Brandt, R; Mueller-Buschbaum, Hk Zur Kenntnis von Ba4 Mg Ta10 O30 und Ba4 Ni Ta10 O30 Verbindungen mit Verwandtschaft zur tetragonalen Wolfram Bronze und zu Na Nb6 O15 F - Typ Zeitschrift fuer Anorganische und Allgemeine Chemie, 1987, 551, 13-20 |
| 2003116 | CIF Paper | C19 Er10 Ru10 | A m m 2 | 3.6097; 18.632; 7.289 90; 90; 90 | 490.23 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2003117 | CIF Paper | C19 Er10 Ru10 | A m m 2 | 3.6097; 18.632; 7.289 90; 90; 90 | 490.23 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2003119 | CIF Paper | C19 Er10 Ru10 | A m m 2 | 37.264; 7.219; 14.578 90; 90; 90 | 3921.6 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2106981 | CIF | O8 U3 | A m m 2 | 4.136; 11.816; 6.822 90; 90; 90 | 333.398 | Herak, R. The Crystal Structure of the High Temperature Modification of U3 O8 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2505-2508 |
| 2220901 | CIF HKL Paper | C22 H26 O6 S | A m m 2 | 19.751; 10.904; 5.092 90; 90; 90 | 1096.6 | Yi, Shi-xu; Men, Jian; Wang, Yang; Xiao, Yong; Gao, Guo-wei 2,2'-Dimethyl-4,4'-(sulfonyldi-<i>p</i>-phenylene)dibut-3-yn-2-ol dihydrate Acta Crystallographica Section E, 2009, 65, o212 |
| 2243035 | CIF HKL Paper | C5 H15 Br3 K N2 O0.5 | A m m 2 | 13.411; 9.488; 9.79 90; 90; 90 | 1245.7 | Ferrandin, Sarah; Slawin, Alexandra M. Z.; Harrison, William T. A. Syntheses and crystal structures of a new family of hybrid perovskites: C~5~H~14~N~2~·<i>A</i>Br~3~·0.5H~2~O (<i>A</i> = K, Rb, Cs) Acta Crystallographica Section E, 2019, 75, 1243-1248 |
| 2243036 | CIF HKL Paper | C5 H15 Br3 N2 O0.5 Rb | A m m 2 | 13.477; 9.5617; 9.85 90; 90; 90 | 1269.3 | Ferrandin, Sarah; Slawin, Alexandra M. Z.; Harrison, William T. A. Syntheses and crystal structures of a new family of hybrid perovskites: C~5~H~14~N~2~·<i>A</i>Br~3~·0.5H~2~O (<i>A</i> = K, Rb, Cs) Acta Crystallographica Section E, 2019, 75, 1243-1248 |
| 2243037 | CIF HKL Paper | C5 H15 Br3 Cs N2 O0.5 | A m m 2 | 13.61; 9.7201; 9.977 90; 90; 90 | 1319.9 | Ferrandin, Sarah; Slawin, Alexandra M. Z.; Harrison, William T. A. Syntheses and crystal structures of a new family of hybrid perovskites: C~5~H~14~N~2~·<i>A</i>Br~3~·0.5H~2~O (<i>A</i> = K, Rb, Cs) Acta Crystallographica Section E, 2019, 75, 1243-1248 |
| 2300499 | CIF Paper | K0.5 Na0.5 Nb O3 | A m m 2 | 3.9443; 5.6425; 5.6763 90; 90; 90 | 126.33 | Orayech, B.; Faik, A.; López, G. A.; Fabelo, O.; Igartua, J. M. Mode-crystallography analysis of the crystal structures and the low- and high-temperature phase transitions in Na~0.5~K~0.5~NbO~3~ Journal of Applied Crystallography, 2015, 48 |
| 4002436 | CIF | O2.25 Si | A m m 2 | 18.36; 18.36; 5.147 90; 90; 90 | 1735 | Wojdel, J.C.; Zwijnenburg, M.A.; Bromley, S.T. Magic silica clusters as nanoscale building units for super-(tris)tetrahedral materials Chemistry of Materials (1,1989-), 2006, 18, 1464-1469 |
| 4002709 | CIF | Mg4 O21 P6 Rb4 | A m m 2 | 5.2878; 21.1901; 9.6973 90; 90; 90 | 1086.57 | Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv M4Mg4(P2O7)3 (M = K, Rb): Structural Engineering of Pyrophosphates for Nonlinear Optical Applications Chemistry of Materials, 2017, 29, 1845 |
| 4110502 | CIF | O2 Si | A m m 2 | 12.4802; 21.0374; 13.4698 90; 90; 90 | 3536.5 | Angel Cantín; Avelino Corma; Maria J. Diaz-Cabanas; Jose L. Jordá; Manuel Moliner Rational Design and HT Techniques Allow the Synthesis of New IWR Zeolite Polymorphs Journal of the American Chemical Society, 2006, 128, 4216-4217 |
| 4126951 | CIF | C4 H12 Cl4 Fe N | A m m 2 | 7.218; 9.019; 9.362 90; 90; 90 | 609.5 | Harada, Jun; Yoneyama, Naho; Yokokura, Seiya; Takahashi, Yukihiro; Miura, Atsushi; Kitamura, Noboru; Inabe, Tamotsu Ferroelectricity and Piezoelectricity in Free-Standing Polycrystalline Films of Plastic Crystals. Journal of the American Chemical Society, 2017 |
| 4132051 | CIF | C H5 I3 N2 Pb0.96 | A m m 2 | 6.3652; 9.002; 9.0065 90; 90; 90 | 516.1 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4135405 | CIF | C7 H13 F N O4 Re | A m m 2 | 6.2249; 8.8294; 9.3691 90; 90; 90 | 514.95 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135406 | CIF | C7 H13 F N O4 Re | A m m 2 | 6.1587; 8.8322; 9.3515 90; 90; 90 | 508.674 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4305043 | CIF | La4 O4 Se3 | A m m 2 | 8.5794; 4.0944; 13.1649 90; 90; 90 | 462.45 | Sabine Strobel; Amitava Choudhury; Peter K. Dorhout; Christian Lipp; Thomas Schleid Rare-Earth Metal(III) Oxide Selenides M4O4Se[Se2] (M = La, Ce, Pr, Nd, Sm) with Discrete Diselenide Units: Crystal Structures, Magnetic Frustration, and Other Properties Inorganic Chemistry, 2008, 47, 4936-4944 |
| 4305044 | CIF | Ce4 O4 Se3 | A m m 2 | 8.5137; 4.0482; 12.9683 90; 90; 90 | 446.95 | Sabine Strobel; Amitava Choudhury; Peter K. Dorhout; Christian Lipp; Thomas Schleid Rare-Earth Metal(III) Oxide Selenides M4O4Se[Se2] (M = La, Ce, Pr, Nd, Sm) with Discrete Diselenide Units: Crystal Structures, Magnetic Frustration, and Other Properties Inorganic Chemistry, 2008, 47, 4936-4944 |
| 4305045 | CIF | O4 Pr4 Se3 | A m m 2 | 8.4992; 4.0278; 12.9257 90; 90; 90 | 442.49 | Sabine Strobel; Amitava Choudhury; Peter K. Dorhout; Christian Lipp; Thomas Schleid Rare-Earth Metal(III) Oxide Selenides M4O4Se[Se2] (M = La, Ce, Pr, Nd, Sm) with Discrete Diselenide Units: Crystal Structures, Magnetic Frustration, and Other Properties Inorganic Chemistry, 2008, 47, 4936-4944 |
| 4305046 | CIF | Nd4 O4 Se3 | A m m 2 | 8.4568; 3.9883; 12.8245 90; 90; 90 | 432.55 | Sabine Strobel; Amitava Choudhury; Peter K. Dorhout; Christian Lipp; Thomas Schleid Rare-Earth Metal(III) Oxide Selenides M4O4Se[Se2] (M = La, Ce, Pr, Nd, Sm) with Discrete Diselenide Units: Crystal Structures, Magnetic Frustration, and Other Properties Inorganic Chemistry, 2008, 47, 4936-4944 |
| 4305047 | CIF | O4 Se3 Sm4 | A m m 2 | 8.4008; 3.9404; 12.6383 90; 90; 90 | 418.36 | Sabine Strobel; Amitava Choudhury; Peter K. Dorhout; Christian Lipp; Thomas Schleid Rare-Earth Metal(III) Oxide Selenides M4O4Se[Se2] (M = La, Ce, Pr, Nd, Sm) with Discrete Diselenide Units: Crystal Structures, Magnetic Frustration, and Other Properties Inorganic Chemistry, 2008, 47, 4936-4944 |
| 4320177 | CIF | C24 H54 N6 O17 S3 | A m m 2 | 10.7345; 29.6422; 5.7286 90; 90; 90 | 1822.81 | Thomas Clifford; Andrew Danby; José M. Llinares; Susan Mason; Nathaniel W. Alcock; Douglas Powell; Juan A. Aguilar; Enrique García-España; Kristin Bowman-James Anion Binding with Two Polyammonium Macrocycles of Different Dimensionality Inorganic Chemistry, 2001, 40, 4710-4720 |
| 4335084 | CIF | Ag2 Nb3 S6 Te | A m m 2 | 8.8215; 9.903; 5.719 90; 90; 90 | 499.61 | Sandy L. Nguyen; Christos D. Malliakas; Melanie C. Francisco; Mercouri G. Kanatzidis Lattice-Matched Transition Metal Disulfide Intergrowths: The Metallic Conductors Ag2Te(MS2)3 (M = V, Nb) Inorganic Chemistry, 2013, 52, 6520-6532 |
| 4335633 | CIF | C H5 I3 N2 Sn | A m m 2 | 6.3286; 8.9554; 8.9463 90; 90; 90 | 507.03 | Constantinos C. Stoumpos; Christos D. Malliakas; Mercouri G. Kanatzidis Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties Inorganic Chemistry, 2013, 52, 9019-9038 |
| 5910192 | CIF | F Na Nb6 O15 | A m m 2 | 3.949; 10.192; 14.721 90; 90; 90 | 592.494 | Wyckoff, R. W. G. Pages 79 & 80 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 4, 79-80 |
| 6000056 | CIF | Al D1.1 Ni Tb | A m m 2 | 3.6554; 12.3954; 7.6316 90; 90; 90 | 345.79 | Brinks, H. W.; Yartys, V. A.; Hauback, B. C.; Fjellvag, H.; Yvon, K.; Gingl, F.; Vogt, T. The magnetic structure of TbNiAlD1.1 Journal of Alloys and Compounds, 2000, 311, 114-119 |
| 7120415 | CIF | F2 N2 O7 Pb2 | A m m 2 | 5.1684; 15.051; 4.9061 90; 90; 90 | 381.64 | Peng, Guang; Yang, Yi; Tang, Yu-Huan; Luo, Min; Yan, Tao; Zhou, Yuqiao; Lin, Chensheng; Lin, Zheshuai; Ye, Ning Collaborative Enhancement from Pb2+ and F- in Pb2(NO3)2(H2O)F2 Generates the Largest Second Harmonic Generation Effect Among Nitrates Chem. Commun., 2017 |
| 7128629 | CIF | Ag5 Cl2 P S4 | A m m 2 | 7.44; 11.17; 6.3 90; 90; 90 | 524 | Gao, Lihua; Chu, Yu; Wu, Xiaowen; Zhang, Bingbing; Wu, Kui From thiophosphate to chalcohalide: mixed-anion AgS<sub>x</sub>Cl<sub>y</sub> ligands concurrently enhancing nonlinear optical effects and laser-damage threshold. Chemical communications (Cambridge, England), 2021, 57, 8218-8221 |
| 7129420 | CIF | C21.5 H16.5 N8.5 O22.5 Zr3 | A m m 2 | 19.017; 23.361; 21.208 90; 90; 90 | 9422 | Gimeno-Fonquernie, Pol; Liang, W.; Albalad, Jorge; Kuznicki, Andrew; Price, Jason; Bloch, Eric D.; Doonan, Christian J.; Sumby, Christopher J. Templated synthesis of zirconium(IV)-based metal-organic layers (MOLs) with accessible chelating sites Chemical Communications, 2022 |
| 7212939 | CIF | K0.7 Na0.3 Nb O3 | A m m 2 | 3.970162; 5.67111; 5.69467 90; 90; 90 | 128.217 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212940 | CIF | K0.7 Na0.3 Nb O3 | A m m 2 | 3.96867; 5.67069; 5.69626 90; 90; 90 | 128.195 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212941 | CIF | K0.7 Na0.3 Nb O3 | A m m 2 | 3.97024; 5.662; 5.68624 90; 90; 90 | 127.82 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212942 | CIF | K0.7 Na0.3 Nb O3 | A m m 2 | 3.96136; 5.65428; 5.68474 90; 90; 90 | 127.33 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212943 | CIF | K0.93 Na0.07 Nb O3 | A m m 2 | 3.98381; 5.689; 5.70757 90; 90; 90 | 129.356 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212944 | CIF | K0.903 Na0.097 Nb O3 | A m m 2 | 3.981973; 5.68731; 5.70733 90; 90; 90 | 129.252 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212945 | CIF | K0.86 Na0.14 Nb O3 | A m m 2 | 3.977443; 5.68725; 5.70678 90; 90; 90 | 129.091 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212946 | CIF | K0.84 Na0.16 Nb O3 | A m m 2 | 3.973479; 5.68046; 5.70266 90; 90; 90 | 128.716 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212947 | CIF | K0.83 Na0.17 Nb O3 | A m m 2 | 3.973479; 5.68046; 5.70266 90; 90; 90 | 128.716 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212948 | CIF | K0.77 Na0.23 Nb O3 | A m m 2 | 3.972623; 5.68015; 5.7037 90; 90; 90 | 128.705 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212949 | CIF | K0.73 Na0.27 Nb O3 | A m m 2 | 3.97304; 5.67576; 5.69703 90; 90; 90 | 128.468 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212950 | CIF | K0.75 Na0.25 Nb O3 | A m m 2 | 3.970626; 5.67573; 5.69855 90; 90; 90 | 128.424 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7212951 | CIF | K0.72 Na0.28 Nb O3 | A m m 2 | 3.96953; 5.6731; 5.69719 90; 90; 90 | 128.298 | Handoko, Albertus D.; Goh, Gregory K. L. Hydrothermal synthesis of sodium potassium niobate solid solutions at 200 °C Green Chemistry, 2010, 12, 680 |
| 7236867 | CIF | C3 Ca2 Na2 O9 | A m m 2 | 4.972; 11.068; 7.1271 90; 90; 90 | 392.2 | Song, Yunxia; Luo, Min; Zhao, Dan; Peng, Guang; Lin, Chensheng; Ye, Ning Explorations of new UV nonlinear optical materials in the Na2CO3‒CaCO3system Journal of Materials Chemistry C, 2017, 5, 8758 |
| 7245721 | CIF | C2 H2 Eu O6 | A m m 2 | 4.807; 15.1947; 7.8938 90; 90; 90 | 576.57 | Takano, Rina; Ishida, Takayuki; Ay, Burak Synthesis, crystal structure, and luminescence properties of a three-dimensional coordination polymer from europium(iii) carbonate hemioxalate hydrate CrystEngComm, 2022 |
| 7706030 | CIF | Ph as e kn n ow un | A m m 2 | 3.978; 17.401; 17.742 90; 90; 90 | 1228.12 | Caggiu, Laura; Iacomini, Antonio; Pistidda, Claudio; Farina, Valeria; Senes, Nina; Cao, Hujun; Gavini, Elisabetta; Mulas, Gabriele; Garroni, Sebastiano; Enzo, Stefano <i>In situ</i> synchrotron radiation investigation of V<sub>2</sub>O<sub>5</sub>-Nb<sub>2</sub>O<sub>5</sub> metastable compounds: transformational kinetics at high temperatures with a new structural solution for the orthorhombic V<sub>4</sub>Nb<sub>20</sub>O<sub>60</sub> phase. Dalton transactions (Cambridge, England : 2003), 2020, 49, 17584-17593 |
| 7712753 | CIF | C216 H304 Br8 Cl8 N16 O16 P16 Rh8 | A m m 2 | 32.9022; 37.7479; 12.5306 90; 90; 90 | 15562.9 | Pandey, Madhusudan Kumar; Sheokand, Sonu; Balakrishna, Maravanji Shivaramaiah Synthesis and characterization of cyclodiphosphazanes embedded macrocycle tetrabromo-resorcin[4]arene-tetrakis(cyclodiphospha-zane) and its tetra-rhodium(I) complex Dalton Transactions, 2023 |
| 7715583 | CIF | Nb O3 Rb | A m m 2 | 3.99374; 5.8217; 5.8647 90; 90; 90 | 136.356 | Yamamoto, Ayako; Murase, Kimitoshi; Sato, Takeru; Sugiyama, Kazumasa; Kawamata, Toru; Inaguma, Yoshiyuki; Yamaura, Jun-Ichi; Shitara, Kazuki; Yokoi, Rie; Moriwake, Hiroki Crystal structure and properties of perovskite-type rubidium niobate, a high-pressure phase of RbNbO<sub>3</sub>. Dalton transactions (Cambridge, England : 2003), 2024, 53, 7044-7052 |
| 8103475 | CIF | B18 Cu3 O44 Tl4 | A m m 2 | 12.836; 24.933; 7.482 90; 90; 90 | 2394.54 | Behm, H.; Smykalla, C. Crystal and molecular structure of tetrathalliummonocopper(Cyclo-octahydroxooctacosaoxooctadec borato)dicuprate(II) decahydrate, Tl4 Cu (Cu2 B18 O28 (O H)8 ) * 10 H2 O Zeitschrift fuer Kristallographie (149,1979-), 1988, 183, 63-70 |
| 9000822 | CIF | O7 Si U | A m m 2 | 7.106; 17.9; 7.087 90; 90; 90 | 901.448 | Stohl, F. V.; Smith, D. K. The crystal chemistry of the uranyl silicate minerals American Mineralogist, 1981, 66, 610-625 |
| 9008053 | CIF | Cd Cl2 N2 | A m m 2 | 3.968; 8.307; 8.196 90; 90; 90 | 270.158 | MacGillavry, C. H.; Bijvoet, J. M. Die kristallstruktur der cadmium-und quecksilber-diammin-dihalogenide Zeitschrift fur Kristallographie, 1936, 94, 231-245 |
| 9008057 | CIF | Br2 Cd N2 | A m m 2 | 4.13; 8.55; 8.55 90; 90; 90 | 301.913 | MacGillavry, C. H.; Bijvoet, J. M. Die kristallstruktur der cadmium-und quecksilber-diammin-dihalogenide Zeitschrift fur Kristallographie, 1936, 94, 231-245 |
| 9009888 | CIF | C3 Ca2 Na2 O9 | A m m 2 | 4.947; 11.032; 7.108 90; 90; 90 | 387.921 | Dickens, B.; Hyman, A.; Brown, W. E. Crystal structure of Ca2Na2(CO3)3 (shortite) Note: Y- and z-coordinates of Ca adjusted to match reported bond lengths Journal of Research of the National Bureau of Standards - Physics and Chemistry, 1971, 129-135 |
| 9014492 | CIF | Ba O3 Ti | A m m 2 | 3.9828; 5.6745; 5.6946 90; 90; 90 | 128.7 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 190 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9014627 | CIF | Ba O3 Ti | A m m 2 | 3.9806; 5.671; 5.6904 90; 90; 90 | 128.455 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 210 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9014645 | CIF | Ba O3 Ti | A m m 2 | 3.9855; 5.6738; 5.6903 90; 90; 90 | 128.674 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 250 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9014774 | CIF | Ba O3 Ti | A m m 2 | 3.99; 5.669; 5.682 90; 90; 90 | 128.523 | Shirane, G.; Danner, H.; Pepinsky, R. Neutron diffraction study of orthorhombic BaTiO3 Note: orthorhombic structure Physical Review, 1957, 105, 856-860 |
| 9015715 | CIF | Ba O3 Ti | A m m 2 | 4.0094; 5.6214; 5.6386 90; 90; 90 | 127.085 | Xiao, C. J.; Jin, C. Q.; Wang, X. H. Crystal structure of dense nanocrystalline BaTiO3 ceramics Note: phase O (orthorhombic) Materials Chemistry and Physics, 2008, 111, 209-212 |
| 9016084 | CIF | Ba O3 Ti | A m m 2 | 3.9841; 5.6741; 5.6916 90; 90; 90 | 128.665 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 230 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9016638 | CIF | Ba O3 Ti | A m m 2 | 3.9874; 5.6751; 5.6901 90; 90; 90 | 128.761 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 270 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 1529540 | CIF | Al7.956 Ca2.816 H4.5 Na0.384 O73.28 Si28.044 | A m m a | 13.616; 17.158; 16.681 90; 90; 90 | 3897.07 | Alberti, A.; Rinaldi, R.; Vezzalini, G. Dynamics of dehydration in stilbite-type structures; stellerite phase B Physics and Chemistry of Minerals (Germany), 1978, 2, 365-375 |
| 2105046 | CIF HKL Paper | Ca4 Fe2 Mn0.5 O9 Ti0.5 | A m m a | 5.351; 26.669; 5.4914 90; 90; 90 | 783.65 | Krüger, H.; Stöber, S.; Welberry, T. R.; Withers, R. L.; Fitz Gerald, J. D. Stacking faults and superstructures in a layered brownmillerite Acta Crystallographica Section B, 2011, 67, 476-485 |
| 2310506 | CIF | Nb10 O29 Ti2 | A m m a | 28.5; 3.805; 20.51 90; 90; 90 | 2224.16 | Wadsley, A.D. Mixed oxides of titanium and niobium. II. The crystal structures of the dimorphic forms of Ti2 Nb10 O29 Acta Crystallographica (1,1948-23,1967), 1961, 14, 664-670 |
| 3000391 | On hold until 2022-11-20 | O167.88 Pb11.42 Si72 | A m m a | 13.6684; 17.869; 17.6896 90; 90; 90 | 4320.52 | Cametti, Georgia; Roos, Diana; Prieur, Damien; Scheinost, Andreas; Churakov, Sergey To be published in Scientific Reports |
| 4001906 | CIF | Fe Nb11 O29 | A m m a | 28.7093; 3.82563; 20.6241 90; 90; 90 | 2265.17 | Pinus, Ilya; Catti, Michele; Ruffo, Riccardo; Salamone, Matteo M.; Mari, Claudio M. Neutron Diffraction and Electrochemical Study of FeNb11O29/Li11FeNb11O29for Lithium Battery Anode Applications Chemistry of Materials, 2014, 26, 2203 |
| 4001907 | CIF | Fe Li11 Nb11 O29 | A m m a | 28.4036; 4.08447; 20.70671 90; 90; 90 | 2402.26 | Pinus, Ilya; Catti, Michele; Ruffo, Riccardo; Salamone, Matteo M.; Mari, Claudio M. Neutron Diffraction and Electrochemical Study of FeNb11O29/Li11FeNb11O29for Lithium Battery Anode Applications Chemistry of Materials, 2014, 26, 2203 |
| 4345503 | CIF | C5 H6 Cd Cl3 N | A m m a | 6.7876; 7.3532; 17.718 90; 90; 90 | 884.3 | Sun, Xiao-Fen; Wang, Zhongxia; Li, Peng-Fei; Liao, Wei-Qiang; Ye, Heng-Yun; Zhang, Yi Tunable Dielectric Responses Triggered by Dimensionality Modification in Organic-Inorganic Hybrid Phase Transition Compounds (C5H6N)CdnCl2n+1 (n = 1 and 2). Inorganic chemistry, 2017, 56, 3506-3511 |
| 5000040 | CIF | Ca O4 S | A m m a | 6.991; 6.996; 6.238 90; 90; 90 | 305.1 | Cheng, G C H; Zussman, J The crystal structure of anhydrite (Ca S O4) Acta Crystallographica (1,1948-23,1967), 1963, 16, 767-769 |
| 9001865 | CIF | Al0.72 Ca0.12 H0.333 Na0.068 O6.69 Si2.28 | A m m a | 13.72; 17.6808; 17.4461 90; 90; 90 | 4232.08 | Cruciani, G.; Artioli, G.; Gualtieri, A.; Stahl, K.; Hanson, J. C. Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction Sample: at T = 441 K American Mineralogist, 1997, 82, 729-739 |
| 9001866 | CIF | Al3.12 Ca0.4 H1.96 Na0.235 O19.3 Si9.88 | A m m a | 13.5849; 17.6213; 17.1148 90; 90; 90 | 4097 | Cruciani, G.; Artioli, G.; Gualtieri, A.; Stahl, K.; Hanson, J. C. Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction Sample: at T = 521 K American Mineralogist, 1997, 82, 729-739 |
| 9004017 | CIF | Al3.96 Ca1.46 H6.796 Na0.19 O37.97 Si15.84 | A m m a | 13.6629; 17.6064; 17.3629 90; 90; 90 | 4176.72 | Arletti, R.; Mazzucato, E.; Vezzalini, G. Influence of dehydration kinetics on T-O-T bridge breaking in zeolites with framework type STI: The case of stellerite Sample: T = 503 K Note: occupancies invented to match formula American Mineralogist, 2006, 91, 628-634 |
| 9004018 | CIF | Al3.56 Ca1.14 H0.88 Na0.14 O38.13 Si15.84 | A m m a | 13.5426; 17.557; 17.102 90; 90; 90 | 4066.3 | Arletti, R.; Mazzucato, E.; Vezzalini, G. Influence of dehydration kinetics on T-O-T bridge breaking in zeolites with framework type STI: The case of stellerite Sample: T = 740 K Note: occupancies invented to match formula American Mineralogist, 2006, 91, 628-634 |
| 9004096 | CIF | Ca O4 S | A m m a | 6.993; 6.995; 6.245 90; 90; 90 | 305.481 | Hawthorne, F. C.; Ferguson, R. B. Anhydrous sulphates. II. Refinement of the crystal structure of anhydrite The Canadian Mineralogist, 1975, 13, 289-292 |
| 9005756 | CIF | Al3.978 Ca1.389 H2.8 K0.014 Mg0.008 Na0.189 O36.64 Si14.022 | A m m a | 13.62; 17.16; 16.68 90; 90; 90 | 3898.44 | Alberti, A.; Rinaldi, R.; Vezzalini, G. Dynamics of dehydration in stilbite-type structures; stellerite phase B Sample: Stellerite phase B Physics and Chemistry of Minerals, 1978, 2, 365-375 |
| 9009956 | CIF | Al3.974 Ca0.56 H56 K0.864 Na2.476 O47.17 Si14.026 | A m m a | 13.598; 18.177; 17.79 90; 90; 90 | 4397.17 | Sacerdoti, M.; Sani, A.; Vezzalini, G. Structural refinement of two barrerites from Alaska Note: sample 1 Microporous and Mesoporous Materials, 1999, 30, 103-109 |
| 9009957 | CIF | Al3.974 Ca0.97 H58 K1.68 Na2.79 O46.3 Si14.026 | A m m a | 13.586; 18.184; 17.812 90; 90; 90 | 4400.42 | Sacerdoti, M.; Sani, A.; Vezzalini, G. Structural refinement of two barrerites from Alaska Note: sample 3 Microporous and Mesoporous Materials, 1999, 30, 103-109 |
| 9013286 | CIF | Al4.158 Ca0.492 H46 K0.797 Mg0.069 Na1.981 O45.6 Si13.842 | A m m a | 13.6336; 18.2056; 17.8445 90; 90; 90 | 4429.15 | Ori, S.; Mazzucato, E.; Vezzalini, G. Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-A, T = 339 K American Mineralogist, 2009, 94, 64-73 |
| 9013287 | CIF | Al2.079 Ca0.246 H8.28 K0.398 Mg0.035 Na0.986 O20.38 Si6.921 | A m m a | 13.6744; 17.8937; 17.5723 90; 90; 90 | 4299.69 | Ori, S.; Mazzucato, E.; Vezzalini, G. Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-A, T = 482 K American Mineralogist, 2009, 94, 64-73 |
| 9013288 | CIF | Al4.158 Ca0.498 H12.5 K0.792 Mg0.07 Na1.975 O37.85 Si13.842 | A m m a | 13.5502; 17.1487; 16.0919 90; 90; 90 | 3739.25 | Ori, S.; Mazzucato, E.; Vezzalini, G. Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-B, T = 637 K American Mineralogist, 2009, 94, 64-73 |
| 9017312 | CIF | Ca O4 S | A m m a | 7.006; 6.998; 6.245 90; 90; 90 | 306.18 | Kirfel, A.; Will, G. Charge density in anhydrite, CaSO4, from X-ray and neutron diffraction measurements Acta Crystallographica, Section B, 1980, 36, 2881-2890 |
| 9017809 | CIF | Ca O4 S | A m m a | 7.00032; 6.99234; 6.24097 90; 90; 90 | 305.487 | Antao, S. Crystal-structure analysis of four mineral samples of anhydrite, Ca(SO4), using synchrotron high-resolution powder X-ray diffraction data Powder Diffraction, 2011, 26, 326-330 |
| 9017810 | CIF | Ca O4 S | A m m a | 7.00071; 6.99274; 6.24125 90; 90; 90 | 305.535 | Antao, S. Crystal-structure analysis of four mineral samples of anhydrite, Ca(SO4), using synchrotron high-resolution powder X-ray diffraction data Powder Diffraction, 2011, 26, 326-330 |
| 9017811 | CIF | Ca O4 S | A m m a | 7.00136; 6.99339; 6.24171 90; 90; 90 | 305.614 | Antao, S. Crystal-structure analysis of four mineral samples of anhydrite, Ca(SO4), using synchrotron high-resolution powder X-ray diffraction data Powder Diffraction, 2011, 26, 326-330 |
| 1000031 | CIF | Ba2 Cu4 O8 Y | A m m m | 3.8402; 3.8708; 27.2309 90; 90; 90 | 404.8 | Lightfoot, P.; Pei, S.; Jorgensen, J. D.; Yamada, Y.; Matsumoto, T.; Izumi, F.; Kodama, Y. Redetermination of the structure of the 80 K superconductor YBa~2~Cu~4~O~8~ by time-of-flight neutron powder diffraction Acta Crystallographica Section C, 1991, 47, 1143-1145 |
| 1000267 | CIF | Cu0.54 La2 Li0.46 O4 | A m m m | 5.2636; 5.258; 13.146 90; 90; 90 | 363.8 | Attfield, J P; Ferey, G Preparation and Crystal Structures of La~2~ Cu~1-x~ Li~x~ O~4~ Solid Solutions and Evidence for a New Oxide with a defect K~2~ Ni F~4~ Structure: La~4~ Li~2~ O~7~ Journal of Solid State Chemistry, 1989, 80, 112-119 |
| 1000268 | CIF | Cu0.5 La2 Li0.5 O4 | A m m m | 5.2517; 5.251; 13.1539 90; 90; 90 | 362.7 | Attfield, J P; Ferey, G Preparation and Crystal Structures of La~2~ Cu~1-x~ Li~x~ O~4~ Solid Solutions and Evidence for a New Oxide with a defect K~2~ Ni F~4~ Structure: La~4~ Li~2~ O~7~ Journal of Solid State Chemistry, 1989, 80, 112-119 |
| 1001652 | CIF | Ce0.5 Cu1.1 Hg0.4 La0.6 O5 Sr1.4 | A m m m | 3.7352; 7.5749; 17.9657 90; 90; 90 | 508.3 | Maignan, A; Martin, C; Michel, C; Hervieu, M; Raveau, B A new "1201" mercury-based cuprate with Hg Ce mixed layers: the oxide Hg0.4 Ce0.5 Cu0.1 Sr2-x Lax Cu O4+d Journal of Solid State Chemistry, 1995, 116, 347-354 |
| 1008369 | CIF | Ba4 Cu7 O14.3 Y2 | A m m m | 3.851; 3.869; 50.29 90; 90; 90 | 749.3 | Bordet, P; Chaillout, C; Chenavas, J; Hodeau, J L; Marezio, M; Karpinski, J; Kaldis, E Structure Determination of the new high-temperature Superconductor Y Ba Cu O (2/4/7/14.30) Nature (London), 1988, 334, 596-598 |
| 1008448 | CIF | Ba2 Cu4 O8.06 Y | A m m m | 3.8415; 3.8707; 27.24 90; 90; 90 | 405 | Karpinski, J; Kaldis, E; Rusiecki, S; Jilek, E; Fischer, P; Bordet, P; Chaillout, C; Chenavas, J; Hodeau, J L; Marezio, M Two New Bulk Superconducting Phases in the Y-Ba-Cu-O System: Y Ba~2~ Cu~3.5~ O~7+x~ (T~c~ 40K) and Y Ba~2~ Cu~4~ O~8+x~ (T~c~ 80K) Journal of the Less-Common Metals, 1989, 150, 129-137 |
| 1510248 | CIF | Au0.5 La2 Li0.5 O4 | A m m m | 5.7679; 5.7618; 12.4657 90; 90; 90 | 414.279 | Massa, W.; Warda, S.A.; Reinen, D.; Pietzuch, W. Die Kristallstruktur von La2 Li1/2 Au1/2 O4 und bindungschemische Aspekte. Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 113-117 |
| 1510589 | CIF | Au0.16 Ba4 Cu6.84 Er2 O15 | A m m m | 3.837; 3.875; 50.492 90; 90; 90 | 750.734 | Waszczak, J.V.; Siegrist, T.; Schneemeyer, L.F.; van Dover, R.B. Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al Journal of Solid State Chemistry, 2000, 150, 228-232 |
| 1520980 | CIF | Ba1.962 Ca0.121 Cu3.937 Fe0.048 O8.429 Y0.938 | A m m m | 3.8461; 3.8727; 27.2278 90; 90; 90 | 405.552 | Escamilla, R.; Marquina, V.; Gomez, R.; Akachi, T.; Ridaura, R.; Marquina, M.L.; Jimenez, M. Estudio de la estructura cristalina para el sistema (Y1-x Cax) Ba2 (Cu1-x Fex)4 Od con z=0.1 y x=0.0125 Revista Mexicana de Fisico, 1999, 45, 64-65 |
| 1521321 | CIF | Ba | A m m m | 5.7; 7.3; 3.91 90; 90; 90 | 162.695 | Migliori, A.; Gemmi, M.; Belletti, D.; Calestani, G.; Nozar, P.; Matacotta, F.C.; Dionigi, C. Structure determination by electron diffraction and HREM of the incommensurate modulated phase Bax Cu O2 (0.67 < x < 0.70) Physica C (Amsterdam), 1999, 328, 89-103 |
| 1521927 | CIF | Al0.42 Ba4 Cu6.58 Er2 O14.88 | A m m m | 3.8526; 3.8746; 50.41049 90; 90; 90 | 752.492 | Siegrist, T.; Waszczak, J.V.; van Dover, R.B.; Schneemeyer, L.F. Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al Journal of Solid State Chemistry, 2000, 150, 228-232 |
| 1522263 | CIF | Ba2 Cu4 O8 Pr | A m m m | 3.8837; 3.90269; 27.293 90; 90; 90 | 413.677 | Yamada, Y.; Ye, J.; Horii, S.; Matsushita, A.; Kubo, S. Crystal structure in Pr Ba2 Cu4 O8 single crystals Journal of Physics and Chemistry of Solids, 2001, 62, 191-194 |
| 1526550 | CIF | Ba1.78 Cu4 O8 Sr0.22 Y | A m m m | 3.8299; 3.8676; 27.1707 90; 90; 90 | 402.467 | Karpinski, J.; Kazakov, S.M.; Angst, M.; Mironov, A.; Mali, M.; Roos, J. Influence of Sr substitution on the structure, charge distribution,and critical temperature of Y (Ba1-x Srx)2 Cu4 O8 single crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 64, 945181-9451812 |
| 1526552 | CIF | Ba1.68 Cu4 O8 Sr0.32 Y | A m m m | 3.8232; 3.8644; 27.1387 90; 90; 90 | 400.957 | Karpinski, J.; Kazakov, S.M.; Mironov, A.; Angst, M.; Roos, J.; Mali, M. Influence of Sr substitution on the structure, charge distribution,and critical temperature of Y (Ba1-x Srx)2 Cu4 O8 single crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 64, 945181-9451812 |
| 1526554 | CIF | Ba1.38 Cu4 O8 Sr0.62 Y | A m m m | 3.8086; 3.8601; 27.0588 90; 90; 90 | 397.807 | Karpinski, J.; Mironov, A.; Kazakov, S.M.; Angst, M.; Roos, J.; Mali, M. Influence of Sr substitution on the structure, charge distribution,and critical temperature of Y (Ba1-x Srx)2 Cu4 O8 single crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 64, 945181-9451812 |
| 1532363 | CIF | Ba2 Cu4 Nd0.375 O8 Y0.625 | A m m m | 3.8578; 3.8803; 27.26 90; 90; 90 | 408.066 | Valo, J.; Leskela, M.; Hauback, B.C.; Fjellvag, H.; Koo, S.-M.; Rao, K.V. Nd substitution effects in Y Ba2 Cu4 O8 prepared using a conversionreaction from Y1-x Ndx Ba2 Cu3 O7-d and Cu O International Journal of Inorganic Materials, 2000, 2, 269-276 |
| 1532365 | CIF | Ba2 Cu4 Nd0.5 O8 Y0.5 | A m m m | 3.8652; 3.884; 27.295 90; 90; 90 | 409.764 | Valo, J.; Leskela, M.; Koo, S.-M.; Fjellvag, H.; Hauback, B.C.; Rao, K.V. Nd substitution effects in Y Ba2 Cu4 O8 prepared using a conversionreaction from Y1-x Ndx Ba2 Cu3 O7-d and Cu O International Journal of Inorganic Materials, 2000, 2, 269-276 |
| 1532367 | CIF | Ba2 Cu4 Nd0.625 O8 Y0.375 | A m m m | 3.8759; 3.8864; 27.308 90; 90; 90 | 411.349 | Valo, J.; Fjellvag, H.; Leskela, M.; Hauback, B.C.; Koo, S.-M.; Rao, K.V. Nd substitution effects in Y Ba2 Cu4 O8 prepared using a conversionreaction from Y1-x Ndx Ba2 Cu3 O7-d and Cu O International Journal of Inorganic Materials, 2000, 2, 269-276 |
| 1533001 | CIF | Ba2 Mn4 O11 Y2 | A m m m | 3.771; 8.159; 15.2709 90; 90; 90 | 469.849 | Karppinen, M.; Okamoto, H.; Motohashi, R.; Fjellvag, H.; Yamauchi, H. Oxygen and cation ordered perovskite, Ba2 Y2 Mn4 O11 Journal of Solid State Chemistry, 2004, 177, 2122-2128 |
| 1533150 | CIF | Ba2 Cu3.904 Fe0.052 O7.895 Pr0.19 Y0.79 | A m m m | 3.8456; 3.877; 27.192 90; 90; 90 | 405.416 | Escamilla, R.; Akachi, T.; Gomez, R.; Ridaura, R.; Marquina, V.; Marquina, M.L. Effect of Fe substitution in the structure and superconducting properties of the (Y0.8 Pr0.2) Ba2 Cu4-x Fex O8 system Physica C (Amsterdam), 2003, 385, 373-382 |
| 1534724 | CIF | Ba4 Cu6.77 O14.26 Y2 | A m m m | 3.851; 3.869; 50.29 90; 90; 90 | 749.297 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534728 | CIF | Ba4 Cu6.76 O14.54 Y2 | A m m m | 3.8584; 3.8776; 50.367 90; 90; 90 | 753.557 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534731 | CIF | Ba3.888 Ca0.17 Cu6.73 O14.4 Y1.942 | A m m m | 3.8572; 3.8731; 50.352 90; 90; 90 | 752.225 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534734 | CIF | Ba4 Cu6.83 O14.6 Y2 | A m m m | 3.8592; 3.8799; 50.495 90; 90; 90 | 756.077 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534737 | CIF | Ba4 Cu6.72 O14.63 Y2 | A m m m | 3.8593; 3.8796; 50.478 90; 90; 90 | 755.784 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534741 | CIF | Ba4 Cu6.98 O14.8 Y2 | A m m m | 3.8347; 3.8836; 50.679 90; 90; 90 | 754.734 | Schwer, H.; Kaldis, E.; Rossel, C.; Karpinski, J. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534744 | CIF | Ba4 Cu6.74 O14.6 Y2 | A m m m | 3.8642; 3.8717; 50.471 90; 90; 90 | 755.098 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534748 | CIF | Ba3.87 Ca0.246 Cu6.73 O14.63 Y1.884 | A m m m | 3.8501; 3.8626; 50.181 90; 90; 90 | 746.262 | Schwer, H.; Rossel, C.; Karpinski, J.; Kaldis, E. The effect of Ca doping on the structures of YBa2Cu4O8 and Y2Ba4Cu7O14+x single crystals Journal of Solid State Chemistry, 1994, 111, 96-103 |
| 1534752 | CIF | Ba1.988 Ca0.043 Cu4 O8 Y0.969 | A m m m | 3.8445; 3.8721; 27.2714 90; 90; 90 | 405.97 | Schwer, H.; Rossel, C.; Kaldis, E.; Karpinski, J. Effect of structural changes on the transition temperatures in Y2Ba4Cu7O14+x single crystals Physica C (Amsterdam), 1993, 211, 165-178 |
| 1534756 | CIF | Ba2 Cu4 O8 Y | A m m m | 3.8386; 3.8689; 27.201 90; 90; 90 | 403.966 | Schwer, H.; Kaldis, E.; Karpinski, J.; Rossel, C. Effect of structural changes on the transition temperatures in Y2Ba4Cu7O14+x single crystals Physica C (Amsterdam), 1993, 211, 165-178 |
| 1534760 | CIF | Ba1.986 Ca0.035 Cu4 O8 Y0.979 | A m m m | 3.8538; 3.8661; 27.302 90; 90; 90 | 406.777 | Schwer, H.; Rossel, C.; Kaldis, E.; Karpinski, J. Effect of structural changes on the transition temperatures in Y2Ba4Cu7O14+x single crystals Physica C (Amsterdam), 1993, 211, 165-178 |
| 1539859 | CIF | Ba4 Cu6.72 Nd2 O15.08 | A m m m | 3.89369; 3.90156; 50.67673 90; 90; 90 | 769.854 | Currie, D.B.; Lanchester, P.C.; Weller, M.T.; Walia, R. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1539861 | CIF | Ba4 Cu6.78 Nd2 O14.85 | A m m m | 3.89385; 3.90132; 50.79012 90; 90; 90 | 771.561 | Currie, D.B.; Weller, M.T.; Lanchester, P.C.; Walia, R. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1539862 | CIF | Ba4 Cu6.84 Ho2 O14.36 | A m m m | 3.84999; 3.871; 50.77141 90; 90; 90 | 756.662 | Currie, D.B.; Weller, M.T.; Lanchester, P.C.; Walia, R. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1539864 | CIF | Ba4 Cu6.91 O14.94 Y2 | A m m m | 3.83941; 3.87541; 50.55865 90; 90; 90 | 752.277 | Currie, D.B.; Weller, M.T.; Lanchester, P.C.; Walia, R. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1539866 | CIF | Ba4 Cu6.92 O14.33 Y2 | A m m m | 3.84847; 3.87166; 50.7643 90; 90; 90 | 756.386 | Currie, D.B.; Weller, M.T.; Walia, R.; Lanchester, P.C. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1539868 | CIF | Ba4 Cu6.87 Er2 O15 | A m m m | 3.83501; 3.87292; 50.53368 90; 90; 90 | 750.561 | Currie, D.B.; Weller, M.T.; Lanchester, P.C.; Walia, R. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1539870 | CIF | Ba4 Cu6.9 Er2 O14.3 | A m m m | 3.83868; 3.87139; 50.623 90; 90; 90 | 752.31 | Currie, D.B.; Walia, R.; Weller, M.T.; Lanchester, P.C. Superconductivity and crystal structure of Ln2Ba4Cu7O14+d (Ln= Er, Y, Ho, Dy, Nd). A high-resolution powder neutrondiffraction study Physica C (Amsterdam), 1994, 224, 43-50 |
| 1540332 | CIF | Ba2 Cu4 O8 Y | A m m m | 3.8548; 3.86878; 26.7668 90; 90; 90 | 399.183 | Ludwig, H.A.; Fietz, W.H.; Wuehl, H. Calculation of the structural parameters of YBa2Cu3 O7-delta and YBa2Cu4O8 under pressure Physica C (Amsterdam), 1992, 197, 113-122 |
| 1540335 | CIF | Ba2 Cu4 O8 Y | A m m m | 3.72273; 3.8098; 25.9752 90; 90; 90 | 368.403 | Ludwig, H.A.; Fietz, W.H.; Wuehl, H. Calculation of the structural parameters of YBa2Cu3 O7-delta and YBa2Cu4O8 under pressure Physica C (Amsterdam), 1992, 197, 113-122 |
| 1544380 | CIF | Ba2.15 Fe4 O13 Pb2.85 Sn | A m m m | 5.799; 4.04293; 26.9561 90; 90; 90 | 631.984 | Korneychik, O.E.; Batuk, M.; Abakumov, A.M.; Hadermann, J.; Rozova, M.G.; Sheptyakov, D.V.; Pokholok, K.V.; Filimonov, D.S.; Antipov, E.V. Pb2.85Ba2.15Fe4SnO13: a new member of the AnBnO3n-2 anion-deficient perovskite-based homologous series sample: T = 550 K Journal of Solid State Chemistry, 2011, 184, 3150-3157 |
| 1558726 | CIF | Co0.5 La1.24 Li1.07 O3.15 | A m m m | 5.352; 5.355; 12.632 90; 90; 90 | 362 | Takami, T.; Ishikawa, Y.; Yonemura, M.; Fukunaga, T.; Matsubara, E.; Abe, T. Crystal structure, ionic conductivity and lithium-ion diffusion pathway in a La-Li-Co-O system Journal of the Ceramic Society of Japan, 2020, 128, 453-456 |
| 1559344 | CIF | Ba2 Cu4 O8 Y | A m m m | 3.834; 3.868; 27.15 90; 90; 90 | 402.6 | Karen, P.; Kjekshus, A.; Andresen, A. F. Superconducting and Structural Properties of Strontium-Substituted YBa2Cu4O8 Acta Chemica Scandinavica, 1992, 46, 1059-1064 |
| 4126258 | CIF | C48 H24 N6 O8 Pd Zn2 | A m m m | 16.677; 16.673; 45.237 90; 90; 90 | 12578 | Ding, Yanjun; Chen, Ying-Pin; Zhang, Xinlei; Chen, Liang; Dong, Zhaohui; Jiang, Hai-Long; Xu, Hangxun; Zhou, Hong-Cai Controlled Intercalation and Chemical Exfoliation of Layered Metal-Organic Frameworks Using a Chemically Labile Intercalating Agent. Journal of the American Chemical Society, 2017 |
| 4316808 | CIF HKL | Ba2.1 Fe4 O13 Pb2.9 Ti | A m m m | 5.7687; 4.0048; 26.9236 90; 90; 90 | 622 | Artem M. Abakumov; Joke Hadermann; Maria Batuk; Hans D'Hondt; Oleg A. Tyablikov; Marina G. Rozova; Konstantin V. Pokholok; Dmitry S. Filimonov; Denis V. Sheptyakov; Alexander A. Tsirlin; Daniel Niermann; Joachim Hemberger; Gustaaf Van Tendeloo; Evgeny V. Antipov Slicing the Perovskite Structure with Crystallographic Shear Planes: The AnBnO3n-2 Homologous Series Inorganic Chemistry, 2010, 49, 9508-9516 |
| 6000638 | CIF | Ba2 Cu4 O8 Pr | A m m m | 3.8901; 3.9041; 27.3219 90; 90; 90 | 414.95 | Lee, T. J.; Chou, C. H.; Wan, C. Y.; Ku, H. C.; Huang, J. C.; Cheng, C. H.; Sheen, S. R.; Wu, M. K. X-ray profile refinement study of the PrBa2Cu4O8 compound Chinese Journal of Physics, 1998, 36, 336-343 |
| 7037657 | CIF | C22 H18.4 Br1.6 N2 O8 Zn2 | A m m m | 9.628; 12.759; 17.572 90; 90; 90 | 2158.61 | Cadman, Laura K.; Bristow, Jessica K.; Stubbs, Naomi E.; Tiana, Davide; Mahon, Mary F.; Walsh, Aron; Burrows, Andrew D. Compositional control of pore geometry in multivariate metal-organic frameworks: an experimental and computational study. Dalton transactions (Cambridge, England : 2003), 2016, 45, 4316-4326 |
| 7037658 | CIF | C22 H18.3 Br1.7 N2 O8 Zn2 | A m m m | 9.623; 12.858; 17.48 90; 90; 90 | 2162.84 | Cadman, Laura K.; Bristow, Jessica K.; Stubbs, Naomi E.; Tiana, Davide; Mahon, Mary F.; Walsh, Aron; Burrows, Andrew D. Compositional control of pore geometry in multivariate metal-organic frameworks: an experimental and computational study. Dalton transactions (Cambridge, England : 2003), 2016, 45, 4316-4326 |
| 7037663 | CIF | C22 H18.48 Br1.52 N2 O8 Zn2 | A m m m | 9.6342; 16.488; 14.229 90; 90; 90 | 2260.3 | Cadman, Laura K.; Bristow, Jessica K.; Stubbs, Naomi E.; Tiana, Davide; Mahon, Mary F.; Walsh, Aron; Burrows, Andrew D. Compositional control of pore geometry in multivariate metal-organic frameworks: an experimental and computational study. Dalton transactions (Cambridge, England : 2003), 2016, 45, 4316-4326 |
| 6000637 | CIF | Cu2 Nd4 O7 | A2/m | 8.4493; 3.7591; 12.6006 90; 109.576; 90 | 377.08 | Pederzolli, D. R.; Attfield, J. P. Nd~4~Cu~2~O~7~: a Copper(I) Oxide with a Novel Cooperatively Distorted T' Type Structure Journal of Solid State Chemistry, 1998, 136, 137-140 |
| 1008536 | CIF | O9 V5 | B -1 | 7.002; 8.3516; 10.9052 91.91; 108.39; 110.5 | 559.4 | Le Page, Y; Bordet, P; Marezio, M Valence ordering in V~5~O~9~ below 120K Journal of Solid State Chemistry, 1991, 92, 380-385 |
| 1010913 | CIF | As Fe S | B -1 | 9.51; 5.65; 6.42 90; 90; 90 | 345 | Buerger, M J The symmetry and crystal structure of the minerals of the arsenopyrite group Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 95, 83-113 |
| 2103700 | CIF HKL Paper | C28 H32 Si | B -1 | 8.012; 16.171; 18.28 80.78; 83.45; 84.07 | 2313.8 | Xia, Aibing; Selegue, John P.; Carrillo, Alberto; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt Two fluoradene derivatives: pseudosymmetry, eccentric ellipsoids and a phase transition Acta Crystallographica Section B, 2001, 57, 507-516 |
| 2311997 | CIF | C17 H14 Cl2 N2 O2 | B -1 | 16.7989; 17.0054; 22.1341 78.897; 100.411; 90.042 | 6098.8 | Garraza, María Soledad; Gimenez, María Emilia; Vega, Daniel Roberto; Baggio, Ricardo Crystal structure and pseudosymmetry analysis of the triclinic prodrug cloxazolam (Z' = 4). Acta crystallographica. Section C, Structural chemistry, 2019, 75, 851-858 |
| 4133977 | CIF | C16 H10 F6 Fe | B -1 | 7.167; 9.2494; 11.888 76.621; 77.687; 83.786 | 747.6 | Bear, Joseph C.; Cockcroft, Jeremy K.; Williams, Jeffrey H. Influence of Solvent in Crystal Engineering: A Significant Change to the Order-Disorder Transition in Ferrocene. Journal of the American Chemical Society, 2020, 142, 1731-1734 |
| 4133978 | CIF | C16 H10 F6 Fe | B -1 | 7.1618; 9.2536; 11.8972 76.583; 77.727; 83.757 | 747.94 | Bear, Joseph C.; Cockcroft, Jeremy K.; Williams, Jeffrey H. Influence of Solvent in Crystal Engineering: A Significant Change to the Order-Disorder Transition in Ferrocene. Journal of the American Chemical Society, 2020, 142, 1731-1734 |
| 4133979 | CIF | C16 H10 F6 Fe | B -1 | 7.1683; 9.2643; 11.916 76.588; 77.763; 83.749 | 750.78 | Bear, Joseph C.; Cockcroft, Jeremy K.; Williams, Jeffrey H. Influence of Solvent in Crystal Engineering: A Significant Change to the Order-Disorder Transition in Ferrocene. Journal of the American Chemical Society, 2020, 142, 1731-1734 |
| 4343747 | CIF | As2 F12 S18.64 | B -1 | 7.536; 13.406; 27.226 89.02; 91.58; 93.24 | 2744.8 | Burns, R.C.; Gillespie, R.J.; Sawyer, J.F. Preparation and Crystal Structure of S19 (As F6)2 and an ESR and Absorption Spectral Study of Solutions Containing the S19(2+) Cation and Related Systems Inorganic Chemistry, 1980, 19, 1423-1432 |
| 4511756 | CIF | As K O3 | B -1 | 9.192; 10.285; 11.992 105.74; 90; 103.69 | 1057.7 | Stöger, Berthold; Dušek, Michal Complex Polymorphism and Polytypism of Potassium Metaarsenate, KAsO3 Crystal Growth & Design, 2014, 14, 4640 |
| 4511757 | CIF | As K0.798 O3 Rb0.202 | B -1 | 9.0742; 10.2593; 12.007 105.375; 90.02; 104.188 | 1042.4 | Stöger, Berthold; Dušek, Michal Complex Polymorphism and Polytypism of Potassium Metaarsenate, KAsO3 Crystal Growth & Design, 2014, 14, 4640 |
| 7000498 | CIF | C60 H81 Cl2 Cr Li N5 O4 | B -1 | 13.7888; 20.6256; 21.5347 93.354; 100.909; 96.853 | 5950.2 | Redshaw, Carl; Homden, Damien; Hughes, David L.; Wright, Joseph A.; Elsegood, Mark R. J. New structural motifs in chromium(iii) calix[4 and 6]arene chemistry Dalton Transactions, 2009, 1231-1242 |
| 9002503 | CIF | Cl4 O12 Pb10 S | B -1 | 19.727; 8.796; 13.631 82.21; 78.08; 100.04 | 2242.38 | Welch, M. D.; Cooper, M. A.; Hawthorne, F. C.; Criddle, A. J. Symesite, Pb10(SO4)O7Cl4(H2O), a new PbO-related sheet mineral: Description and crystal structure American Mineralogist, 2000, 85, 1526-1533 |
| 1541192 | CIF | H O4 Rb Se | B 1 | 19.852; 4.622; 7.575 90.63; 90.04; 102.75 | 677.868 | Makarova, I.P.; Rider, E.E.; Aleksandrova, I.P.; Sarin, V.A.; Simonov, V.I. Neutron structural investigation of ferro- and paraphases of acid rubidium selenate Kristallografiya, 1989, 34, 853-861 |
| 2100899 | CIF Paper | H O4 Rb Se | B 1 | 19.852; 4.622; 7.575 90.64; 90.04; 102.75 | 677.9 | Makarova, I. P. Thermal vibrations of atoms and phase transition in RbHSeO~4~ and NH~4~HSeO~4~ single crystals Acta Crystallographica Section B, 1993, 49, 11-18 |
| 2100897 | CIF Paper | H O4 Rb Se | B 1 1 2 | 19.962; 4.634; 7.611 90; 90; 102.76 | 686.7 | Makarova, I. P. Thermal vibrations of atoms and phase transition in RbHSeO~4~ and NH~4~HSeO~4~ single crystals Acta Crystallographica Section B, 1993, 49, 11-18 |
| 2100900 | CIF Paper | H5 N O4 Se | B 1 1 2 | 19.863; 4.62; 7.593 90; 90; 102.59 | 680 | Makarova, I. P. Thermal vibrations of atoms and phase transition in RbHSeO~4~ and NH~4~HSeO~4~ single crystals Acta Crystallographica Section B, 1993, 49, 11-18 |
| 2100901 | CIF Paper | H5 N O4 Se | B 1 1 2 | 19.754; 4.607; 7.55 90; 90; 102.59 | 670.6 | Makarova, I. P. Thermal vibrations of atoms and phase transition in RbHSeO~4~ and NH~4~HSeO~4~ single crystals Acta Crystallographica Section B, 1993, 49, 11-18 |
| 2106841 | CIF | F3 H4 N Sn | B 1 1 2 | 11.66; 6.507; 6.859 90; 90; 125 | 426.29 | Bergerhoff, G.; Goost, L. Ammoniumfluorostannat(II) Acta Crystallographica B (24,1968-38,1982), 1973, 29, 632-633 |
| 8103533 | CIF | Ba Ge3 K4 O9 | B 1 1 2 | 8.364; 11.399; 12.366 90; 90; 90.61 | 1178.92 | Baumgartner, O.; Voellenkle, H. Die Kristallstruktur der Verbindung K4 Ba Ge3 O9 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1977, 146, 293-302 |
| 9017457 | CIF | Ca H1.323 O4.662 S | B 1 1 2 | 12.028; 12.674; 6.927 90; 90; 90.21 | 1055.96 | Bushuev, N. N. On the structural features of CaSO4*0,5H2O and CaSO4*0,67H2O Doklady Akademii Nauk SSSR, 1980, 255, 1104-1109 |
| 1001838 | CIF | O5 Si Y2 | B 1 1 2/b | 14.59; 10.52; 6.82 90; 90; 122.25 | 885.3 | Michel, C; Buisson, G; Bertaut, E F Structure de Y2 Si O5 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie B, 1967, 264, 397-399 |
| 1008094 | CIF | Cs2 Cu N6 O12 Pb | B 1 1 2/b | 7.734; 15.531; 21.376 90; 90; 90.1 | 2567.6 | Klein, S.; Reinen, D. The Structure of the Low-Temperature γ-Modification of Cs~2~PbCu(NO~2~)~6~: A Powder Neutron Diffraction Study at 160 K Journal of Solid State Chemistry, 1980, 32, 311-319 |
| 1525665 | CIF | O8 P2 Pb3 | B 1 1 2/b | 10.905; 8.88; 8.78 90; 90; 113 | 782.635 | Belokoneva, E.L.; Gurbanova, O.A.; Dimitrova, O.V. A new crystal structure of Pb3 (P O4)2 and its comparison with formula analogues Zhurnal Neorganicheskoi Khimii, 2000, 45, 1448-1452 |
| 1526431 | CIF | Cs H4 In O10 Se2 | B 1 1 2/b | 9.439; 7.159; 14.84 90; 90; 105.03 | 968.49 | Saf'yanov, Yu.N.; Kuz'min, E.A.; Belov, N.V.; Ilyukhin, V.V. Crystal structure of cesium indium double selenate dihydrate Cs In (Se O4)2 * 2(H2 O) Doklady Akademii Nauk SSSR, 1975, 224, 335-337 |
| 1526729 | CIF | Cd Ge O3 | B 1 1 2/b | 10.6; 5.36; 9.73 90; 90; 104 | 536.399 | Kornev, A.N.; Dem'yanets, L.N.; Ilyukhin, V.V.; Maksimov, B.A.; Belov, N.V. Hydrothermal synthesis in the K Cl - Cd O - Ge O2 - H2 O System and the crystal structure of Cd2 (Ge2 O6) Kristallografiya, 1972, 17, 289-291 |
| 1527426 | CIF | H60 Na8 O66 U W10 | B 1 1 2/b | 18.139; 18.509; 18.602 90; 90; 96 | 6211.12 | Golubev, A. M.; Spitsyn, V. I.; Muradyan, L. A.; Torchenkova, E. A.; Simonov, V. I.; Kazanskii, L. P. Determination and refinement of the crystal structure of sodium decatungstouranate(IV) Na8 (U W10 O36) (H2 O)30 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1977, 3, 920-925 |
| 1528349 | CIF | C0.8 H2 B5 Na2.4 O12.4 Sr1.1 | B 1 1 2/b | 11.322; 27.182; 6.565 90; 90; 94.66 | 2013.73 | Belokoneva, E.L.; Dimitrova, O.V.; Mochenova, N.N. Synthetic Na,Sr-carbonatoborate with a new type of pentaborate layer: The OD nature of the structure and its correlation with volkovskite, veatchites, and hilgardites Kristallografiya, 2009, 54, 13-19 |
| 1528678 | CIF | Nb2 O5 | B 1 1 2/b | 12.73; 5.56; 4.88 90; 90; 105.05 | 333.553 | Laves, F.; Petter, W.; Wulf, H. Die Kristallstruktur von zeta-Nb2 O5 Naturwissenschaften, 1964, 51, 633-634 |
| 1529665 | CIF | Na3.12 O12 P0.88 Si2.12 Zr2 | B 1 1 2/b | 15.669; 9.246; 9.055 90; 90; 124.2 | 1085 | Boilot, J.P.; Collin, G.; Colomban, P. Crystal structure of the true Nasicon Na3 Zr2 Si2 P O12 Materials Research Bulletin, 1987, 22, 669-676 |
| 1530137 | CIF | Ce K2 O15 Si6 | B 1 1 2/b | 17.661; 11.854; 8.698 90; 90; 132.32 | 1346.41 | Karpov, O.G.; Pobedimskaya, E.A.; Belov, N.V. Crystal structure of a K, Ce silicate with a three-dimensional anion framework: K2 Ce Si6 O15 Kristallografiya, 1977, 22, 382-384 |
| 1530156 | CIF | Cs4 F19 H16 O8 Rh Sn6 | B 1 1 2/b | 19.267; 17.513; 9.284 90; 90; 107.9 | 2981 | Khodashova, T.S.; Porai-Koshits, M.A.; Vetrova, I.V. Structure of a rhodium(III) complex with unusual fluorotin ligands, Cs4 (Rh (Sn F2 (H2 O)2)2 (Sn4 F15)) (H2 O)4 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1979, 5, 754-761 |
| 1530169 | CIF | Ba Mo4 Nd2 O16 | B 1 1 2/b | 5.329; 19.396; 12.804 90; 90; 91.05 | 1323.22 | Kiseleva, I.I.; Sirota, M.I.; Ozerov, R.P.; Balakireva, T.P.; Maier, A.A. Barium-lanthanide double molybdates Ba Ln2 (Mo O4)4. II. Crystal structure of Ba Nd2 (Mo O4)4 Kristallografiya, 1979, 24, 1277-1279 |
| 1530198 | CIF | Ba O4 Sc2 | B 1 1 2/b | 9.836; 20.578; 5.8147 90; 90; 89.88 | 1176.92 | Kovba, L.M.; Lykova, L.N.; Kalinina, T.A.; Chizhov, S.M. Crystal structure of Ba Sc2 O Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1982, 8, 553-556 |
| 1530216 | CIF | Al0.5 Ba0.0835 Ca0.75 F1.16 Fe4.42 K0.125 Li0.25 Mg0.25 Mn1.42 Na1.13 O23.82 P6 Pb0.0835 Sr0.0835 Zn0.42 | B 1 1 2/b | 16.476; 24.581; 9.996 90; 90; 105.79 | 3895.58 | Krutik, V.M.; Pushcharovskii, D.Yu.; Pobedimskaya, E.A.; Belov, N.V. Crystal structure of arrojadite Kristallografiya, 1979, 24, 743-750 |
| 1530261 | CIF | C7 H12 Eu K4 N7 O6 S7 | B 1 1 2/b | 25.41; 20.32; 6.52 90; 90; 122 | 2854.94 | Lazarev, P.I.; Aslanov, L.A.; Ionov, V.M.; Porai-Koshits, M.A. Results of X-ray radiografic studies of potassium polyhydrates hepta rhodinates of the rare earths Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1975, 1, 710-715 |
| 1530300 | CIF | K Nd O12 P4 | B 1 1 2/b | 7.888; 10.77; 12.447 90; 90; 112.7 | 975.51 | Litvin, B.N.; Dorokhova, G.I.; Filipenko, O.S. Production, structure and properties of single crystals of K, Nd-tetraphosphates Doklady Akademii Nauk SSSR, 1981, 259, 1102-1105 |
| 1530580 | CIF | Bi2 O11 Ti4 | B 1 1 2/b | 14.604; 14.943; 3.8049 90; 90; 92.1 | 829.776 | Petushkova, L.V.; Dmitrieva, S.P.; Pobedimskaya, E.A.; Belov, N.B. The crystal structure of Bi2 O3 (Ti O2)4 = Bi2 Ti4 O11 Doklady Akademii Nauk SSSR, 1974, 216, 544-546 |
| 1530775 | CIF | Cd Ge O3 | B 1 1 2/b | 10.204; 5.3852; 9.669 90; 90; 102.23 | 519.259 | Simonov, M.A.; Belokoneva, E.L.; Belov, N.V. The refinement of the crystal structure of Cd2 (Ge O4) and Cd2 (Ge2 O6) Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 1981, 22, 199-200 |
| 1530780 | CIF | Nd2 O12 S3 | B 1 1 2/b | 21.72; 6.904; 6.673 90; 90; 109.78 | 941.61 | Sirotinkin, S.P.; Efremov, V.A.; Kovba, L.M.; Pokrovskii, A.N. The crystal structure of anhydrous neodymium sulfate Nd2 (S O4)3 Kristallografiya, 1977, 22, 1272-1273 |
| 1530924 | CIF | Cs3 F6 N3 O9 Sb2 | B 1 1 2/b | 22.243; 9.883; 7.602 90; 90; 90.17 | 1671.12 | Udovenko, A.A.; Volkova, L.M.; Zemnukhova, L.A.; Davidovich, R.L. Crystal structure of cesium trinitratohexafluorodiantimonate(III) Cs3 Sb2 F6 (N O3)3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1979, 5, 595-597 |
| 1531749 | CIF | O4 Ta Yb | B 1 1 2/b | 6.9306; 5.2649; 10.8243 90; 90; 133.76 | 285.262 | Markiv, V.Ya.; Titov, Yu.A.; Markiv, M.V.; Belyavina, N.M.; Kapshuk, A.A.; Sych, A.M.; Sokolov, A.N.; Slobodyanik, N.S. Peculiarities of polymorphic transformations in Yb Ta O4 and crystal structure of its modifications Journal of Alloys Compd., 2002, 346, 263-268 |
| 1534912 | CIF | Ge O5 Sc2 | B 1 1 2/b | 10.927; 10.656; 10.486 90; 90; 93.5 | 1218.69 | Maksimov, B.A.; Gorbunov, Yu.A.; Kharitonov, Yu.A.; Belov, N.V. Crystal structure of scandium oxyorthogermanate Sc2 Ge O5 Kristallografiya, 1974, 19, 1081-1083 |
| 1537602 | CIF | Cl6 Pd Se2 | B 1 1 2/b | 16.521; 7.048; 8.451 90; 90; 100.12 | 968.725 | Rybakov, V.B.; Volkov, S.V.; Aslanov, L.A.; Grafov, A.V.; Pekhn'o, V.I.; Fokina, Z.A. X-ray structural study of palladium(II) chlorochalcogenide complexes. Zhurnal Neorganicheskoi Khimii, 1991, 36, 1197-1201 |
| 1539111 | CIF | B2 Ca H4 O6 | B 1 1 2/b | 10.026; 4.44; 9.558 90; 90; 91.31 | 425.367 | Simonov, M.A.; Belov, N.V.; Egorov-Tismenko, Yu.K. Refined crystal structure of vimsite Ca (B2 O2 (O H)4) Kristallografiya, 1976, 21, 592-594 |
| 1540366 | CIF | Cl4 Cs3 Np O2 | B 1 1 2/b | 15.435; 12.796; 7.306 90; 90; 117.23 | 1283.06 | Lychev, A.A.; Mashirov, L.G.; Smolin, Yu.I.; Shepelev, Yu.F. Crystal structure refinement for Cs3 Np O2 Cl4 Radiokhimiya, 1988, 30, 412-416 |
| 1541959 | CIF | F4 H4 O2 Rb V | B 1 1 2/b | 11.921; 9.114; 6.343 90; 90; 124.04 | 571.066 | Bukvetskii, B.V.; Muradyan, L.A.; Davidovich, R.L.; Simonov, V.I. Crystal structure of rubidium tetrafluorovanadate dihydrate Rb V F4 (H2 O)2 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1976, 2, 1129-1134 |
| 2105372 | CIF | Ag4 P2 S7 | B 1 1 2/b | 10.778; 16.211; 6.534 90; 90; 106.8 | 1092.91 | Khodadad, P.; Rodier, N.; Toffoli, P. Structure cristalline du pyrothiophosphate d'argent, Ag4 P2 S7 Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1492-1494 |
| 2105378 | CIF | Ag7.15 P3 S11 | B 1 1 2/b | 23.97; 24.88; 6.361 90; 90; 110.85 | 3545.11 | Khodadad, P.; Rodier, N.; Toffoli, P. Structure du tetrathiomonophosphate(V) heptathiodiphosphate(V) d'argent Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2374-2378 |
| 2107146 | CIF | Br6 Nd4 S3 | B 1 1 2/b | 29.346; 7.156; 6.837 90; 90; 94.65 | 1431.04 | Rysanek, N.; Mazurier, A.; Laruelle, P.; Dagron, C. Structure du Bromure Sulfure de Neodyme Nd4 Br6 S3 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2930-2932 |
| 9009545 | CIF | Ca5 H2 K2 O25 S6 | B 1 1 2/b | 17.519; 18.252; 6.84 90; 90; 113.33 | 2008.31 | Mukhtarova, N. N.; Kalinin, V. R.; Rastsvetaeva, R. K.; Ilyukhin, V. V.; Belov, N. V. Crystal structure of gorgeyite K2Ca5(SO4)6*H2O Doklady Akademii Nauk SSSR, 1980, 252, 102-105 |
| 9009549 | CIF | H4 Na2 O11 Si3 Zr | B 1 1 2/b | 23.917; 20.148; 7.432 90; 90; 147.46 | 1926.35 | Ilyushin, G. D.; Voronkov, A. A.; Ilyukhin, V. V.; Nevskii, N. N.; Belov, N. V. Crystal structure of natural monoclinic catapleiite, Na2ZrSi3O9*2H2O Doklady Akademii Nauk SSSR, 1981, 260, 623-627 |
| 9011897 | CIF | B6 Ca3 H16 O20 | B 1 1 2/b | 13.119; 13.445; 9.526 90; 90; 118.4 | 1478.02 | Simonov, M. A.; Egorov-Tismenko Y K; Kazanskaya, E. V.; Belokoneva, E. L.; Belov, N. V. The hydrogen bonds in the crystal structure of the niphontovite Ca2/B5O3(OH)6/2*2H2O Soviet Physics Doklady, 1978, 23, 159-161 |
| 9016441 | CIF | Al Ba0.25 Ca F3.32 Fe12 H1.32 K0.25 Mn2 Na2.25 O46.68 P12 Sr0.25 | B 1 1 2/b | 16.476; 24.581; 9.996 90; 90; 105.79 | 3895.58 | Krutik, V. M.; Pushcharovskii, D. Y.; Podebimskaya, E. A.; Belov, N. V. Crystal structure of arrojadite Kristallografiya, 1979, 24, 743-750 |
| 1521922 | CIF | Mg0.7 Na5.42 O18 Ti7.3 | B 1 1 2/m | 23.063; 10.689; 2.944 90; 90; 76.4 | 705.407 | Shilov, G.V.; Atovmyan, L.O.; Volochaev, V.A.; Nalbadyan, V.B. Crystal structure and ionic conductivity of a new sodium magnesium titanium oxide Kristallografiya, 1999, 44, 1029-1033 |
| 1523729 | CIF | Ga21 Ho4 Ni10 | B 1 1 2/m | 20.802; 15.346; 4.0736 90; 90; 125.8 | 1054.71 | Grin', Yu.; Yarmolyuk, Ya.P.; Gladyshevskii, E.I. The crystal structure of Ga21 Ho4 Ni10 Doklady Akademii Nauk SSSR, 1979, 245, 1102-1106 |
| 1526100 | CIF | Cl30 Cu18 H4 O2 Rb11 | B 1 1 2/m | 24.787; 13.126; 11.318 90; 90; 122.36 | 3110.5 | Mykhalichko, B.M.; Gelzak-Kotsvin, K.; Mys'kiv, M.G. Guest-host copper(I,II) complex (Rb11 (Cu(I)2 (H2 O)2)) (Cu(I)15 Cl24 (Cu(II) Cl6)). Effect of the nature of the (Cu(I)2 (H2 O)2)(2+) guest on crystal structure formation Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 2000, 41, 559-566 |
| 1526485 | CIF | Ho5 O12 Re2 | B 1 1 2/m | 12.365; 7.482; 5.638 90; 90; 107.73 | 496.824 | Jeitschko, W.; Heumannskaemper, D.H.; Schriewer-Poettgen, M.S.; Rodewald, U.C. Preparation and crystal structure of rare earth rhenates: the series Ln5 Re2 O12 with Ln = Y, Gd-Lu, and the praseodymium rhenates Pr3 Re O8, Pr3 Re2 O10 and Pr4 Re2 O11 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 80-88 |
| 1527405 | CIF | Cl8 H16 N4 O2 Ru2 | B 1 1 2/m | 15.91; 8.399; 7.642 90; 90; 121.09 | 874.5 | Gee, R.J.D.; Powell, H.M. The crystal and molecular structure of ammonium mue-nitrido-bis(aquotetrachlororuthenate(IV)) Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971), 1971, 1971, 1795-1797 |
| 1530005 | CIF | Al Cs2 F6 Na | B 1 1 2/m | 10.697; 10.561; 6.176 90; 90; 109.73 | 656.749 | Golovastikov, N.I.; Belov, N.V. The crystal structure of sodium cesium fluoroaluminate Cs2 Na Al F6 Kristallografiya, 1978, 23, 42-46 |
| 1530521 | CIF | F6 H10 Mn O5 Zr | B 1 1 2/m | 15.715; 8.896; 7.514 90; 90; 56.506 | 876.026 | Otroshchenko, L.P.; Davidovich, R.L.; Simonov, V.I. Crystal structure of manganese hexafluorozirconate pentahydrate Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1978, 4, 1416-1419 |
| 1530922 | CIF | F7 K3 N2 O6 Sb2 | B 1 1 2/m | 15.02; 7.17; 5.69 90; 90; 92.3 | 612.282 | Udovenko, A.A.; Volkova, L.M.; Davidovich, R.L.; Simonov, M.A. Crystal structure of di- and trinitraroheptafluorodiantimonates(III) of potassium K (Sb2 F7) (K N O3)2 and K (Sb2 F7) (K N O3)3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1979, 5, 133-137 |
| 1530944 | CIF | Ge2 In2 O7 | B 1 1 2/m | 6.59; 4.91; 8.72 90; 90; 102 | 275.986 | Vavilin, V.I.; Ilyukhin, V.V.; Soldatov, E.A.; Kuz'min, E.A.; Gladkih, E.A.; Belov, N.V. About the crystal structure of indium pyrogermanate In2 Ge2 O7 Doklady Akademii Nauk SSSR, 1973, 213, 837-839 |
| 1530966 | CIF | S17 Sc U8 | B 1 1 2/m | 13.39; 10.58; 8.463 90; 90; 101.6 | 1174.43 | Vovan, T.; Rodier, N. Sur un nouveau sulfure mixte de scandium et d'uranium de formule Sc U8 S17. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-), 1979, 289, 17-20 |
| 1530999 | CIF | Cr Nd O S2 | B 1 1 2/m | 11.43; 7.89; 3.67 90; 90; 90.2 | 330.968 | Wintenberger, M.; Dugue, J.; Guittard, M.; Tien, V.; Dung, N.H. Ferro- and antiferromagnetism in oxychalcogenides Ln Cr O X2 (Ln= La or Nd and X= S or Se) Journal of Solid State Chemistry, 1987, 70, 295-302 |
| 1532935 | CIF | Ge2 Ru Sm2 | B 1 1 2/m | 10.948; 10.839; 4.302 90; 90; 123.23 | 427.02 | Morozkin, A.V.; Seropegin, Yu.D. Sm - Ru - Ge system at 1070 K Journal of Alloys Compd., 2004, 365, 168-172 |
| 1532942 | CIF | Ge4 Ru2 Sm3 | B 1 1 2/m | 10.899; 8.139; 4.319 90; 90; 109.29 | 361.616 | Morozkin, A.V.; Seropegin, Yu.D. Sm - Ru - Ge system at 1070 K Journal of Alloys Compd., 2004, 365, 168-172 |
| 1533729 | CIF | Ga2.924 Ge3.876 Y2 | B 1 1 2/m | 8.146; 10.756; 8.359 90; 90; 100.92 | 719.14 | Speka, M.V.; Zakharenko, M.I.; Markiv, V.Ya.; Belyavina, N.M. Isothermal section of the Y - Ge - Ga system at 600 C in the region up to 37 at% Y Journal of Alloys Compd., 2004, 368, 41-46 |
| 1534498 | CIF | Cs6 F26 H8 Hf5 O4 | B 1 1 2/m | 22.964; 10.792; 6.777 90; 90; 112.2 | 1555.03 | Gerasimenko, A.V.; Bukvetskii, B.V.; Logvinova, V.B.; Davidovich, R.L. Crystal structure of double cesium fluorohafnate Cs4(Hf4F20(H2O)4)*Cs2HfF6 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1991, 17, 1486-1487 |
| 1534849 | CIF | Mg2 Na20 O52 Ti20 | B 1 1 2/m | 37.586; 9.451; 2.969 90; 90; 86.29 | 1052.45 | Shilov, G.V.; Atovmyan, L.O. Composition and structure of solid electrolyte: sodium-magnesium-titanium ternary oxide. Kristallografiya, 1995, 40, 824-828 |
| 1538155 | CIF | H17.68 K4.61 Na2.736 O65.84 Si16 Ti8.72 | B 1 1 2/m | 14.18; 15.48; 13.7 90; 90; 117 | 2679.47 | Golovastikov, N.I. Crystal structure of the alkali titanosilicate labuntsovite Kristallografiya, 1973, 18, 950-955 |
| 1541944 | CIF | Er H6 O6 P3 | B 1 1 2/m | 14.4; 12.1; 5.64 90; 90; 111.3 | 915.586 | Aslanov, L.A.; Ionov, V.M.; Porai-Koshits, M.A.; Gilyarov, O.N.; Lebedev, V.G.; Kulikovskii, B.N.; Novoderezhkina, T.L. Crystal structure of erbium hypophosphite Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy, 1975, 11, 117-119 |
| 2106259 | CIF | P6 S18 Zn4 | B 1 1 2/m | 21.41; 6.552; 10.68 90; 90; 122.28 | 1266.63 | Bouchetiere, M.; Toffoli, P.; Khodadad, P.; Rodier, N. Structure cristalline de Zn4 (P2 S6)3 Acta Crystallographica B (24,1968-38,1982), 1978, 34, 384-387 |
| 2106301 | CIF | Ce Cr O S2 | B 1 1 2/m | 11.518; 7.951; 3.703 90; 90; 90.07 | 339.119 | Dugue, J.; Villers, J.; Vovan, T. Etude Structurale des Oxysulfures de Chrome(III) et de Terres Rares. II. Structure de l'Oxysulfure Ce Cr O S2 Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1294-1297 |
| 2106325 | CIF | Cr0.3333 I2 Mn0.6666 | B 1 1 2/m | 7.441; 7.448; 3.978 90; 90; 113.66 | 201.932 | Guen, L.; Nguyen, H.D. Manganese(II) chrome(II) diiodure: phase beta des (Mn, Cr) I2 Acta Crystallographica B (24,1968-38,1982), 1976, 32, 311-312 |
| 2106853 | CIF | Er9 La10 S27 | B 1 1 2/m | 29.71; 21.83; 3.941 90; 90; 122 | 2167.62 | Carre, D.; Laruelle, P. Structure cristalline du sulfure d'erbium et de lanthanum, Er9 La10 S27 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 70-73 |
| 8104358 | CIF | Al5.2 Ca1.7 H25.4 K0.7 Na1.1 O60.7 Si18.8 | B 1 1 2/m | 18.73; 10.3; 7.54 90; 90; 107.9 | 1384.2 | Gottardi, G.; Meier, W.M. The crystal structure of dachiardite Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1963, 119, 53-64 |
| 9011859 | CIF | H17 K2.305 Na1.37 O32.425 Si8 Ti4.61 | B 1 1 2/m | 14.18; 7.74; 13.7 90; 90; 117 | 1339.73 | Golovastikov, N. I. Crystal structure of the alkali titanosilicate labuntsovite Sample: half-cell Soviet Physics Crystallography, 1974, 18, 596-599 |
| 9011862 | CIF | H18 K4.61 Na2.736 Nb0.5 O64.836 Si16 Ti8.22 | B 1 1 2/m | 14.18; 15.48; 13.7 90; 90; 117 | 2679.47 | Golovastikov, N. I. Crystal structure of the alkali titanosilicate labuntsovite Sample: double cell Soviet Physics Crystallography, 1973, 18, 950-955 |
| 9014209 | CIF | Cu4 H6 Mo2 O16 U | B 1 1 2/m | 19.8392; 5.5108; 6.1009 90; 90; 104.477 | 645.832 | Tali, R.; Tabachenko, V. V.; Kovba, L. M. Crystal structure of Cu4UO2(MoO4)2(OH)6 Russian Journal of Inorganic Chemistry, 1993, 38, 1350-1352 |
| 1006134 | CIF | La1.9 Ni O2.9 Sr0.1 | B 1 1 2/n | 5.4402; 5.4764; 12.591 90; 90; 90 | 375.1 | Medarde, M.; Rodriguez-Carvajal, J. Oxygen vacancy ordering in La~2-x~Sr~x~NiO~4-δ~ (0 <= x <= 0.5): the crystal structure and defects investigated by neutron diffraction Zeitschrift für Physik B: Condensed Matter, 1997, 102, 307-315 |
| 1006139 | CIF | Nd1.8 Ni O3.7 Sr0.2 | B 1 1 2/n | 5.3473; 5.4554; 12.275 90; 90; 90.782 | 358 | Medarde, M; Rodriguez-Carvajal, J; Vallet-Regi, M; Gonzalez-Calbet, J M; Alonso, J Crystal structure and microstructure of Nd1.8 Sr0.2 NiO3.72: a K2 Ni F4- type nickelate with monoclinic symmetry and ordered oxygen vacancies Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1994, 49, 8591-8599 |
| 1006140 | CIF | Nd1.8 Ni O3.72 Sr0.2 | B 1 1 2/n | 5.3578; 5.4394; 12.25 90; 90; 90.788 | 357 | Medarde, M; Rodriguez-Carvajal, J; Vallet-Regi, M; Gonzalez-Calbet, J M; Alonso, J Crystal structure and microstructure of Nd1.8 Sr0.2 NiO3.72: a K2 Ni F4- type nickelate with monoclinic symmetry and ordered oxygen vacancies Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1994, 49, 8591-8599 |
| 1528348 | CIF | I3 La O9 | B 1 1 b | 12.549; 27.84; 7.091 90; 90; 101.86 | 2424.46 | Belokoneva, E.L. Prediction of the structures in the family of La (I O3)3 iodates based on topology and symmetry analysis within the OD theory Kristallografiya, 2008, 53, 431-436 |
| 1529797 | CIF | K3 O12 S3 Yb | B 1 1 b | 10.39; 8.99; 14.65 90; 90; 124.15 | 1132.45 | Degtyarev, P.A.; Pokrovskii, A.N.; Korytnaya, F.M.; Kovba, L.M. Crystal structure of K3 Yb (S O4)3 Kristallografiya, 1978, 23, 1036-1039 |
| 1535661 | CIF | F5 H5.5 N O0.75 Zr | B 1 1 b | 23.013; 15.158; 6.721 90; 90; 118.76 | 2055.28 | Bukvetskii, B.V.; Gerasimenko, A.V.; Davidovich, R.L. Crystal structures of ammonium fluorozirkonates NH4ZrF5*0.75H2O and (NH4)2ZrF6 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1991, 17, 35-43 |
| 1539807 | CIF | Na3 O12 P3 Sc2 | B 1 1 b | 15.404; 9.103; 8.919 90; 90; 123.53 | 1042.53 | Collin, G.; Comes, R.; Boilot, J.P.; Colomban, P. Disorder of tetrahedra in Nasicon-type structure - part I. Na3 Sc2 (P O4)3: structures and ion-ion correlations Journal of Physics and Chemistry of Solids, 1986, 47, 843-854 |
| 1541740 | CIF | Na3 O12 P3 Sc2 | B 1 1 b | 16; 9.109; 8.928 90; 90; 127.15 | 1037.13 | Efremov, V.A.; Kalinin, V.B. Determination of the crystal structure of Na3 Sc2 (P O4)3 Kristallografiya, 1978, 23, 703-708 |
| 2020137 | CIF | Ga2 Se3 | B 1 1 b | 6.66; 6.66; 11.65 90; 90; 108.12 | 491.116 | Ghemard, G.; Jaulmes, S.; Etienne, J.; Flahaut, J. Structure de la phase ordonnee du sesquiseleniure de gallium, Ga2 Se3 Acta Crystallographica C (39,1983-), 1983, 39, 968-971 |
| 2106737 | CIF | C11 H44 Ce N18 O19 | B 1 1 b | 16.05; 16.63; 13.14 90; 90; 108.1 | 3333.67 | Voliotis, S.; Rimsky, A.; Faucherre, J. Etude structurale des carbonates complexes de cerium et de thorium. I. Structure cristalline et moleculaire du pentacarbonatocerate de guanidine tetrahydrate, (C (N H2)3)6 Ce (C O3)5 (H2 O)4 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2607-2611 |
| 2106738 | CIF | C11 H44 N18 O19 Th | B 1 1 b | 16.15; 16.7; 13.23 90; 90; 108.41 | 3385.58 | Voliotis, S.; Rimsky, A. Etude structurale des carbonates complexes de cerium et de thorium II. Structure cristalline et moleculaire du pentacarbonatothorate de guanidine tetrahydrate, (C (N H2)3)6 Th (C O3)5 (H2 O)4 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2612-2615 |
| 9013974 | CIF | Ca2.5 H11 O12.5 Si3 | B 1 1 b | 6.735; 7.425; 27.987 90; 90; 123.25 | 1170.43 | Bonaccorsi, E.; Merlino, S. The crystal of tobermorite 14 A (plombierite) a CSH phase Journal of the American Ceramic Society, 2005, 88, 505-512 |
| 1509593 | CIF | Ag1.43 O10 V4 | B 1 1 m | 11.93; 8.81; 3.69 90; 90; 90.4 | 387.822 | Belov, N.V.; Kuz'min, E.A.; Drozdov, Yu.N. The crystal structure of silver vanadate Ag(2-x) V4 O10 (x=0.57) Doklady Akademii Nauk SSSR, 1973, 210, 339-341 |
| 1509754 | CIF | Ag2.95 O12 V4 | B 1 1 m | 18.33; 8.09; 3.6 90; 90; 104.5 | 516.839 | Kuz'min, E.A.; Belov, N.V.; Drozdov, Yu.N. Crystal structure of silver vanadate Ag4-X V4 O12 (X=1.05) using the Shenk method Kristallografiya, 1974, 19, 65-69 |
| 1525526 | CIF | Cu3 S8 V4 | B 1 1 m | 11.602; 7.325; 6.657 90; 90; 121.83 | 480.665 | le Nagard, N.; Collin, G.; Gorochov, O. Structure cristalline et propprietes physiques de Cu0.75 V S2 Materials Research Bulletin, 1977, 12, 975-982 |
| 1527001 | CIF | Al0.5 Ca4.9 H10.7 O22 Si5.5 | B 1 1 m | 6.7296; 7.355; 22.61 90; 90; 123.242 | 935.981 | Yamazaki, S.; Toraya, H. Determination of positions of zeolitic calcium atoms and water molecules in hydrothermally formed aluminium-substituted tobermorite-1.1 nm using synchrotron radiation powder diffraction data Journal of the American Ceramic Society, 2001, 84, 2685-2690 |
| 1530262 | CIF | Al Mo4 O16 Rb5 | B 1 1 m | 10.52; 8.47; 6.078 90; 90; 114.49 | 492.853 | Lazoryak, B.I.; Efremov, V.A.; Fabrichnyi, P.B.; Gizhinskii, A.R. The crystal structure of alpha-Rb5 Al (Mo O4)4 Doklady Akademii Nauk SSSR, 1977, 237, 1354-1357 |
| 1532575 | CIF | Bi3.206 La0.794 O11.71 Si0.806 Ti2.194 | B 1 1 m | 5.4246; 5.419; 32.912 90; 90; 89.98 | 967.478 | Idemoto, Y.; Ishiwara, H.; Koura, N.; Miyahara, T.; Kijima, T. Crystal structure and ferroelectric properties of (Bi, La)4 (Ti, Si)3 O12 as a bulk ferroelectric material Solid State Communications, 2003, 128, 255-259 |
| 4114381 | CIF | Eu1.14 K0.5 Na1.08 O10.28 Si3 | B 1 1 m | 6.8309; 6.8118; 22.2279 90; 90; 113.993 | 944.91 | Artur Ferreira; Duarte Ananias; Luís D. Carlos; Cláudia M. Morais; João Rocha Novel Microporous Lanthanide Silicates with Tobermorite-Like Structure Journal of the American Chemical Society, 2003, 125, 14573-14579 |
| 9002246 | CIF | Ca2 H6 O11 Si3 | B 1 1 m | 6.735; 7.385; 22.487 90; 90; 123.25 | 935.351 | Merlino, S.; Bonaccorsi, E.; Armbruster, T. Tobermorites: Their real structure and order-disorder (OD) character Sample: 11 Angstrom American Mineralogist, 1999, 84, 1613-1621 |
| 9005498 | CIF | Ca2 H5 O11 Si3 | B 1 1 m | 6.735; 7.385; 22.487 90; 90; 123.25 | 935.351 | Merlino, S.; Bonaccorsi, E.; Armbruster, T. The real structure of tobermorite 11Å: normal and anomalous forms, OD character and polytypic modifications Note: sample MD02 European Journal of Mineralogy, 2001, 13, 577-590 |
| 9005499 | CIF | Ca2.25 H7 O11 Si3 | B 1 1 m | 6.732; 7.369; 22.68 90; 90; 123.18 | 941.668 | Merlino, S.; Bonaccorsi, E.; Armbruster, T. The real structure of tobermorite 11Å: normal and anomalous forms, OD character and polytypic modifications Note: sample MDO2 European Journal of Mineralogy, 2001, 13, 577-590 |
| 9005500 | CIF | Ca2.25 H7 O11 Si3 | B 1 1 m | 6.732; 7.369; 22.68 90; 90; 123.18 | 941.668 | Merlino, S.; Bonaccorsi, E.; Armbruster, T. The real structure of tobermorite 11Å: normal and anomalous forms, OD character and polytypic modifications Note: sample MDO2 European Journal of Mineralogy, 2001, 13, 577-590 |
| 2104235 | CIF HKL Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.176; 16.514; 17.876 90; 106.42; 90 | 4580.5 | Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5 Acta Crystallographica Section B, 2008, 64, 725-737 |
| 2104241 | CIF HKL Paper | C10 H24 Fe N2 O13 | B 1 21 1 | 14.507; 14.226; 68.39 90; 96.23; 90 | 14031 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ Acta Crystallographica Section B, 2008, 64, 738-749 |
| 2104242 | CIF HKL Paper | C10 H24 Mg N2 O13 | B 1 21 1 | 14.597; 14.135; 70.201 90; 96.95; 90 | 14378 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ Acta Crystallographica Section B, 2008, 64, 738-749 |
| 2104243 | CIF HKL Paper | C10 H24 N2 O13 Zn | B 1 21 1 | 14.737; 14.05; 69.935 90; 96.99; 90 | 14373 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ Acta Crystallographica Section B, 2008, 64, 738-749 |
| 2104912 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.182; 16.518; 17.876 90; 106.42; 90 | 4583.3 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104913 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.188; 16.526; 17.876 90; 106.41; 90 | 4587.4 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104914 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.194; 16.533; 17.878 90; 106.4; 90 | 4591.8 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104915 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.2; 16.54; 17.88 90; 106.39; 90 | 4596.2 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104916 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.208; 16.55; 17.882 90; 106.38; 90 | 4602 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104917 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.214; 16.56; 17.882 90; 106.36; 90 | 4607 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104918 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.222; 16.571; 17.882 90; 106.34; 90 | 4612.8 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104919 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.23; 16.584; 17.88 90; 106.32; 90 | 4618.6 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104920 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.238; 16.598; 17.878 90; 106.28; 90 | 4625.2 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104921 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.242; 16.608; 17.874 90; 106.26; 90 | 4628.6 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104922 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.246; 16.618; 17.87 90; 106.24; 90 | 4632 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104923 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.25; 16.631; 17.866 90; 106.2; 90 | 4636.6 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104924 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.254; 16.644; 17.86 90; 106.17; 90 | 4640.6 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104936 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.2526; 16.6254; 17.8851 90; 106.233; 90 | 4640 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104937 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.2401; 16.6007; 17.8912 90; 106.295; 90 | 4629.66 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104938 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.2238; 16.5763; 17.8917 90; 106.344; 90 | 4617.18 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104939 | CIF Paper | C10 H34 N2 Ni O18 | B 1 21 1 | 16.1879; 16.5322; 17.8839 90; 106.413; 90 | 4591.08 | Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory Acta Crystallographica Section B, 2011, 67, 130-143 |
| 2104996 | CIF HKL Paper | C10 H36 N2 Ni O19 | B 1 21 1 | 31.013; 12.56; 56.246 90; 129.19; 90 | 16981 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·2H~2~O: three phase transitions and an intermediate modulated phase stable over a range of <i>ca</i> 40K Acta Crystallographica Section B, 2011, 67, 486-498 |
| 2104997 | CIF HKL Paper | C10 H36 N2 Ni O19 | B 1 21 1 | 30.632; 12.594; 55.955 90; 129.46; 90 | 16666 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·2H~2~O: three phase transitions and an intermediate modulated phase stable over a range of <i>ca</i> 40K Acta Crystallographica Section B, 2011, 67, 486-498 |
| 2105172 | CIF HKL Paper | C14 H30 N4 Ni O13 | B 1 21 1 | 27.4626; 12.1845; 40.2287 90; 122.026; 90 | 11412.5 | Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt [Ni(MeCN)(H~2~O)~2~(NO~3~)~2~]·(15-crown-5)·MeCN: detailed study of a four-phase sequence that includes an intermediate modulated phase Acta Crystallographica Section B, 2012, 68, 389-400 |
| 2108645 | CIF HKL Paper | C21 H16 N2 O4 | B 1 21 1 | 15.5993; 49.062; 15.6099 90; 119.896; 90 | 10357 | Nespolo, Massimo; Smaha, Rebecca W.; Parkin, Sean Zero-obliquity twin lattice quasi-symmetry threefold twinning in 1-{(<i>R</i>)-1-[(3-oxo-2-isoindolinoyl)methyl]-2-propenyl}-5-methyl-2,3-indolinedione Acta Crystallographica Section B, 2020, 76 |
| 4505247 | CIF | C10 H24 Fe N2 O13 | B 1 21 1 | 14.521; 14.229; 68.443 90; 96.26; 90 | 14057.3 | Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt [M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases† Crystal Growth & Design, 2005, 5, 2225 |
| 9009514 | CIF | Al0.635 As Cu Fe0.365 H2 O6 | B 1 21 1 | 5.7012; 5.1801; 29.265 90; 89.99; 90 | 864.277 | Burns, P. C.; Smith, J. V.; Steele, I. M. Arizona porphyry copper/hydrothermal deposits I. The structure of chenevixite and luetheite Note: Luetheite-chenevixite series Mineralogical Magazine, 2000, 64, 25-30 |
| 1010025 | CIF | As Fe S | B 1 21/d 1 | 9.51; 5.65; 6.42 90; 90; 90 | 345 | Buerger, M J The Symmetry and Crystal Structure of the Minerals of the Arsenopyrite Group. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 95, 83-113 |
| 1011012 | CIF | H Mn O2 | B 1 21/d 1 | 8.86; 5.24; 5.7 90; 90; 90 | 264.6 | Buerger, M J The Symmetry and Crystal Structure of Manganite, Mn (O H) O Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 95, 163-174 |
| 9000018 | CIF | Fe S Sb | B 1 21/d 1 | 10; 5.93; 6.73 90; 90; 90 | 399.089 | Buerger, M. J. The crystal structure of gudmundite American Mineralogist, 1939, 24, 183-184 |
| 9011409 | CIF | Mn O2 | B 1 21/d 1 | 8.86; 5.24; 5.7 90; 90; 90 | 264.63 | Buerger, M. J. The symmetry and crystal structure of manganite, Mn(OH)O Locality: Ilfeld, Germany Zeitschrift fur Kristallographie, 1936, 95, 163-174 |
| 9012076 | CIF | As2 Co | B 1 21/d 1 | 10.12; 5.86; 6.24 90; 90.6; 90 | 370.032 | Darmon, R.; Wintenberger, M. Structure cristalline de CoAs2 Bulletin de la Societe Francaise de Mineralogie et de Cristallographie, 1966, 89, 213-215 |
| 3000225 | CIF | Cl K O3 | B 1 21/m 1 | 4.684; 5.614; 13.528 90; 90; 90 | 355.73 | Reiner, G.; Wartchow, R. On Potassiumchlorate, K Cl O3, Rubidiumchlorate, Rb Cl O3, and Cesiumchlorat, Cs Cl O3 . I. Crystal structure of twinned K Cl O3 at 415 K Institutionelles Repositorium der Leibniz Universitaet Hannover, 2019 |
| 9000069 | CIF | Mn O8 Pb2 V2 | B 1 21/m 1 | 7.681; 6.155; 16.524 90; 93.75; 90 | 779.525 | Donaldson, D. M.; Barnes, W. H. The structures of the minerals of the descloizite and adelite groups: III- brackebuschite American Mineralogist, 1955, 40, 597-613 |
| 4133839 | CIF | C24 H56 N12 O28 Rb Tb | B 2 2 2 | 9.9892; 9.9304; 24.261 90; 90; 90 | 2406.61 | Shi, Chao; Ye, Le; Gong, Zhi-Xin; Ma, Jia-Jun; Wang, Qin-Wen; Jiang, Jia-Ying; Hua, Miao-Miao; Wang, Chang-Feng; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Two-Dimensional Organic-Inorganic Hybrid Rare-Earth Double Perovskite Ferroelectrics. Journal of the American Chemical Society, 2019 |
| 4133841 | CIF | C24 H56 Dy N12 O28 Rb | B 2 2 2 | 9.9498; 9.8982; 24.245 90; 90; 90 | 2387.8 | Shi, Chao; Ye, Le; Gong, Zhi-Xin; Ma, Jia-Jun; Wang, Qin-Wen; Jiang, Jia-Ying; Hua, Miao-Miao; Wang, Chang-Feng; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Two-Dimensional Organic-Inorganic Hybrid Rare-Earth Double Perovskite Ferroelectrics. Journal of the American Chemical Society, 2019 |
| 4133845 | CIF | C24 H56 Ce K N12 O28 | B 2 2 2 | 9.9293; 9.8697; 24.3702 90; 90; 90 | 2388.26 | Shi, Chao; Ye, Le; Gong, Zhi-Xin; Ma, Jia-Jun; Wang, Qin-Wen; Jiang, Jia-Ying; Hua, Miao-Miao; Wang, Chang-Feng; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Two-Dimensional Organic-Inorganic Hybrid Rare-Earth Double Perovskite Ferroelectrics. Journal of the American Chemical Society, 2019 |
| 4133847 | CIF | C24 H56 Ce K N12 O28 | B 2 2 2 | 9.9301; 9.8678; 24.3846 90; 90; 90 | 2389.4 | Shi, Chao; Ye, Le; Gong, Zhi-Xin; Ma, Jia-Jun; Wang, Qin-Wen; Jiang, Jia-Ying; Hua, Miao-Miao; Wang, Chang-Feng; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Two-Dimensional Organic-Inorganic Hybrid Rare-Earth Double Perovskite Ferroelectrics. Journal of the American Chemical Society, 2019 |
| 4133850 | CIF | C24 H56 Ce N13 O28 | B 2 2 2 | 10.0737; 9.993; 24.153 90; 90; 90 | 2431.4 | Shi, Chao; Ye, Le; Gong, Zhi-Xin; Ma, Jia-Jun; Wang, Qin-Wen; Jiang, Jia-Ying; Hua, Miao-Miao; Wang, Chang-Feng; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Two-Dimensional Organic-Inorganic Hybrid Rare-Earth Double Perovskite Ferroelectrics. Journal of the American Chemical Society, 2019 |
| 1528730 | CIF | Bi2 O6 W | B 2 c b | 5.533997; 5.49983; 16.55071 90; 90; 90 | 503.738 | McDowell, N.A.; Knight, K.S.; Lightfoot, P. Unusual high-temperature structural behaviour in ferroelectric Bi2 W O6 Chemistry - A European Journal, 2006, 12, 1493-1499 |
| 7012859 | CIF | C26 H21.24 F9 N9 O0.37 P1.5 Ru | B 2 c b | 17.4944; 17.5143; 19.5605 90; 90; 90 | 5993.4 | Browne, Wesley R.; Hesek, Dusan; Gallagher, John F.; O'Connor, Christine M.; Killeen, J. Scott; Aoki, Fumiko; Ishida, Hitoshi; Inoue, Yoshihisa; Villani, Claudio; Vos, Johannes G. Structural and photophysical characterisation of coordination and optical isomers of mononuclear ruthenium(ii) polypyridyl 1,2,4-triazole complexesElectronic supplementary information (ESI) available: analytical and semipreparative HPLC chromatograms, CD and UV/vis spectra. See http://www.rsc.org/suppdata/dt/b3/b301961f/ Dalton Transactions, 2003, 2597 |
| 1562799 | CIF | Bi0.67 La0.67 O4 Ti | B 2 e b | 5.4182; 5.41048; 32.9798 90; 90; 90 | 966.8 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562800 | CIF | Bi0.67 La0.33 Nd0.33 O4 Ti | B 2 e b | 5.40644; 5.39783; 32.8972 90; 90; 90 | 960.04 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562801 | CIF | Bi0.67 La0.33 O4 Pr0.33 Ti | B 2 e b | 5.4077; 5.4011; 32.9211 90; 90; 90 | 961.54 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562802 | CIF | Bi0.67 Nd0.67 O4 Ti | B 2 e b | 5.38744; 5.38468; 32.8051 90; 90; 90 | 951.66 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562803 | CIF | Bi0.67 O4 Pr0.67 Ti | B 2 e b | 5.39475; 5.3931; 32.858 90; 90; 90 | 955.98 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562804 | CIF | Bi0.67 Nd0.33 O4 Pr0.33 Ti | B 2 e b | 5.3924; 5.3884; 32.8298 90; 90; 90 | 953.92 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562805 | CIF | Bi0.17 Nb0.17 O Sr0.17 Ti0.08 | B 2 e b | 5.50595; 5.50916; 33.20309 90; 90; 90 | 1007.15 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562806 | CIF | Ba0.04 Bi0.17 Nb0.17 O Sr0.13 Ti0.08 | B 2 e b | 5.52168; 5.52725; 33.48115 90; 90; 90 | 1021.83 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562807 | CIF | Ba0.04 Bi0.17 O Sr0.12 Ta0.17 Ti0.08 | B 2 e b | 5.5251; 5.5252; 33.44076 90; 90; 90 | 1020.86 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562808 | CIF | Bi0.17 Ca0.04 Nb0.17 O Sr0.13 Ti0.08 | B 2 e b | 5.48102; 5.47557; 33.0644 90; 90; 90 | 992.32 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562809 | CIF | Ba0.08 Bi0.17 Nb0.17 O Sr0.09 Ti0.08 | B 2 e b | 5.5445; 5.5441; 33.65056 90; 90; 90 | 1034.4 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562810 | CIF | Ba0.08 Bi0.17 O Sr0.08 Ta0.17 Ti0.08 | B 2 e b | 5.5418; 5.5421; 33.596 90; 90; 90 | 1031.84 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562811 | CIF | Bi0.17 Ca0.08 Nb0.17 O Sr0.08 Ti0.08 | B 2 e b | 5.47261; 5.46984; 33.0398 90; 90; 90 | 989.02 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 1562812 | CIF | Bi0.17 Ca0.08 O Sr0.08 Ta0.17 Ti0.08 | B 2 e b | 5.4791; 5.4779; 33.011 90; 90; 90 | 990.8 | Nichols, Eric J.; Shi, Jiawanjun; Huq, Ashfia; Vogel, Sven C.; Misture, Scott T. Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides Journal of Solid State Chemistry, 2013, 197, 475-482 |
| 3000321 | On hold until 2022-01-13 | Bi3 Nb O12 Pb Ti2 | B 2 e b | 5.4572; 5.4658; 33.506 90; 90; 90 | 999.42 | Olga Krasheninnikova To be published in Solid State Sciences |
| 3000322 | On hold until 2022-01-13 | Bi3 Nb O12 Pb Ti2 | B 2 e b | 5.4535; 5.4586; 33.3485 90; 90; 90 | 992.73 | Olga Krasheninnikova To be published in Solid State Sciences |
| 9007470 | CIF | Al2.48 H20 K0.5 Na2 O21 Si5.52 | B 2 m b | 9.965; 14.252; 14.252 90; 90; 90 | 2024.09 | Steinfink, H. The crystal structure of the zeolite, phillipsite Acta Crystallographica, 1962, 15, 644-651 |
| 9007845 | CIF | Ba3 Ca Cu O17 Si6 | B 2 m b | 14.405; 16.077; 7.088 90; 90; 90 | 1641.5 | Angel, R. J.; Ross, N. L.; Finger, L. W.; Hazen, R. M. Ba3CaCuSi6O17: a new {1B,11}[4Si6O17] chain silicate Acta Crystallographica, Section C, 1990, 46, 2028-2030 |
| 1521087 | CIF | Ba Cu3 Nd2 O6.995 | B 2 m m | 7.7878; 3.8349; 23.1521 90; 90; 90 | 691.448 | Goodilin, E.; Khasanova, N.; Tajima, S.; Wu, X.-J.; Kamiyama, T.; Shiohara, Y.; Izumi, F. Phase diagram and structure-related studies of the Nd-rich Nd1+x Ba2-x Cu3 Oz solid solution High Temperature Superconductor and Novel Inorganic Materials, 1999, 62, 145-150 |
| 2106299 | CIF | La4 O4 Se3 | B 2 m m | 13.232; 8.59; 4.101 90; 90; 90 | 466.131 | Dugue, J.; Adolphe, C.; Khodadad, P. Structure cristalline de l'oxyseleniure de lanthane La4 O4 Se3 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1627-1628 |
| 2300039 | CIF | Ni2 O7 P2 | B 21/c | 13.1459; 8.2711; 8.9714 90; 104.949; 90 | 942.5 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 1535174 | CIF | La1.14 Nb S3.14 | B b 2 b | 23.216; 5.806; 23.031 90; 90; 90 | 3104.4 | Meerschaut, A.; Rabu, P.; Monceau, P.; Rouxel, J.; Smontara, A. Structural investigation of (La S)1.14 Nb S2 and resistivity measurements Materials Research Bulletin, 1990, 25, 855-861 |
| 1001009 | CIF | Nb2 O6 Pb | B b 21 m | 35.292; 17.943; 7.746 90; 90; 90 | 4905.1 | Labbe, P; Frey, M; Raveau, B; Monier, J C Structure cristalline de la phase ferroelectrique du niobate de plomb Pb Nb~2~ O~6~ . Deplacements des atomes metalliques et interpretation de la surstructure Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2201-2212 |
| 1521507 | CIF | H12.162 O19 Pb0.919 U4 | B b 21 m | 14.022; 16.45; 14.355 90; 90; 90 | 3311.15 | Li, Y.-P.; Burns, P.C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Canadian Mineralogist, 2000, 38, 737-749 |
| 1521508 | CIF | H12.29 O19 Pb0.855 U4 | B b 21 m | 14.01; 16.468; 14.369 90; 90; 90 | 3315.17 | Li, Y.-P.; Burns, P.C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Canadian Mineralogist, 2000, 38, 737-749 |
| 1521509 | CIF | H13.006 O19 Pb0.497 U4 | B b 21 m | 13.938; 16.638; 14.672 90; 90; 90 | 3402.44 | Li, Y.-P.; Burns, P.C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Canadian Mineralogist, 2000, 38, 737-749 |
| 1538548 | CIF | Br D | B b 21 m | 5.44; 5.614; 6.12 90; 90; 90 | 186.906 | Sandor, E.; Johnson, M.W. Crystal structure and the lower phase transition in solid deuterium bromide Nature (London), 1968, 217, 541-543 |
| 2006894 | CIF Paper | C18 H22 N4 O8 Ru2 | B b 21 m | 9.292; 13.731; 18.639 90; 90; 90 | 2378.1 | Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Huang, Chao-Hao; Tung, Shu-Fang; Shiu, Kom-Bei Di-μ-acetato-bis[dicarbonyl(pyrazole)ruthenium(I)] and Di-μ-acetato-bis[dicarbonyl(3,5-dimethylpyrazole)ruthenium(I)] Acta Crystallographica Section C, 1997, 53, 1782-1784 |
| 2008697 | CIF Paper | Ca2 Na2 Nb4 O13 | B b 21 m | 5.474; 5.51; 36.15 90; 90; 90 | 1090.3 | Chiba, Koji; Ishizawa, Nobuo; Oishi, Shuji A Ruddlesden‒Popper-type layered perovskite, Na~2~Ca~2~Nb~4~O~13~ Acta Crystallographica Section C, 1999, 55, 1041-1044 |
| 2102070 | CIF Paper | K3 Nd O15 Si6 | B b 21 m | 14.37; 15.518; 14.265 90; 90; 90 | 3181 | Haile, S. M.; Wuensch, B. J. Structure, phase transitions and ionic conductivity of K~3~NdSi~6~O~15~·<i>x</i>H~2~O. II. Structure of β-K~3~NdSi~6~O~15~ Acta Crystallographica Section B, 2000, 56, 349-362 |
| 2108043 | CIF | Al4.8 O9.6 Si1.2 | B b 21 m | 75.817; 7.6752; 5.7686 90; 90; 90 | 3356.8 | Klar, Paul B.; de la Pinta, Noelia; Lopez, Gabriel A.; Etxebarria, Iñigo; Breczewski, Tomasz; Madariaga, Gotzon Ordered vacancy distribution in 2/1 mullite: a superspace model Acta Crystallographica Section B, 2017, 73 |
| 4107896 | CIF HKL | Ba Fe2 O4 | B b 21 m | 18.99784; 5.38025; 8.43848 90; 90; 90 | 862.523 | Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments Journal of the American Chemical Society, 2008, 130, 7570-7583 |
| 4340711 | CIF | K0.5 Nb5 O15 Pb2 | B b 21 m | 35.2811; 17.96624; 7.74968 90; 90; 90 | 4912.28 | Lin, Kun; Rong, Yangchun; Wu, Hui; Huang, Qingzhen; You, Li; Ren, Yang; Fan, Longlong; Chen, Jun; Xing, Xianran Ordered Structure and Thermal Expansion in Tungsten Bronze Pb2K0.5Li0.5Nb5O15. Inorganic chemistry, 2014, 53, 9174-9180 |
| 9000093 | CIF | Pb4.5 S11 Sb4.5 | B b 21 m | 42.28; 23.46; 8.07 90; 90; 90 | 8004.54 | Born, L.; Hellner, E. A structural proposal for boulangerite American Mineralogist, 1960, 45, 1266-1271 |
| 9001516 | CIF | C3 H2 O11 Y2 | B b 21 m | 6.078; 9.157; 15.114 90; 90; 90 | 841.189 | Miyawaki, R.; Kuriyama, J.; Nakai, I. The redefinition of tengerite-(Y), Y2(CO3)3.2-3H2O, and its crystal structure American Mineralogist, 1993, 78, 425-432 |
| 9004579 | CIF | H10 O19 Pb U4 | B b 21 m | 14.01; 16.401; 14.317 90; 90; 90 | 3289.73 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMCNC 81096 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004580 | CIF | H10 O19 Pb U4 | B b 21 m | 14.014; 16.419; 14.33 90; 90; 90 | 3297.27 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMCNC 81097 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004581 | CIF | H10 O19 Pb U4 | B b 21 m | 14.013; 16.42; 14.329 90; 90; 90 | 3297.01 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81098 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004582 | CIF | H10 O19 Pb U4 | B b 21 m | 14.014; 16.412; 14.322 90; 90; 90 | 3294.03 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81099 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004583 | CIF | H10 O19 Pb U4 | B b 21 m | 14.022; 16.45; 14.355 90; 90; 90 | 3311.15 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81100 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004584 | CIF | H10 O19 Pb U4 | B b 21 m | 14.02; 16.441; 14.348 90; 90; 90 | 3307.25 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 53066 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004585 | CIF | H10 O19 Pb U4 | B b 21 m | 14.02; 16.425; 14.334 90; 90; 90 | 3300.81 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample M30767 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004586 | CIF | H10 O19 Pb U4 | B b 21 m | 14; 16.417; 14.357 90; 90; 90 | 3299.78 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample M31669 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004587 | CIF | H10 O19 Pb U4 | B b 21 m | 14.018; 16.468; 14.368 90; 90; 90 | 3316.83 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81103 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004588 | CIF | H10 O19 Pb U4 | B b 21 m | 14.024; 16.42; 14.338 90; 90; 90 | 3301.67 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Sample: UMN753 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004589 | CIF | H10 O19 Pb U4 | B b 21 m | 14.01; 16.468; 14.369 90; 90; 90 | 3315.17 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample UMN486 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004590 | CIF | H10 O19 Pb U4 | B b 21 m | 14.026; 16.476; 14.382 90; 90; 90 | 3323.57 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Note: sample CMNMC 81101 The Canadian Mineralogist, 2000, 38, 737-749 |
| 9004591 | CIF | H10 O19 Pb U4 | B b 21 m | 13.938; 16.638; 14.672 90; 90; 90 | 3402.44 | Li, Y.; Burns, P. C. Investigations of crystal-chemical variability in lead uranyl oxide hydrates. II. Fourmarierite Sample: Synthetic The Canadian Mineralogist, 2000, 38, 737-749 |
| 9016437 | CIF | Cl H | B b 21 m | 5.053; 5.373; 5.825 90; 90; 90 | 158.147 | Sandor, E.; Farrow, R. F. C. Crystal structure of solid hydrogen chloride and deuterium chloride Note T = 77.4 K Nature, 1967, 213, 171-172 |
| 1530700 | CIF | Ca0.38 Na1.31 O15 Si6 Zr | B b a 2 | 14.48; 14.28; 14.09 90; 90; 90 | 2913.45 | Sapozhnikov, A.N.; Kashaev, A.A. The crystal structure of calcined Ca-containing Elpidite Kristallografiya, 1980, 25, 620-623 |
| 9009613 | CIF | C3 H22 Ca2 O22 U | B b a 2 | 16.699; 17.557; 13.697 90; 90; 90 | 4015.75 | Mereiter, K. The crystal structure of liebigite, Ca2UO2(CO3)3*~11H2O Locality: Joachimsthal, Bohmen Tschermaks Mineralogische und Petrographische Mitteilungen, 1982, 30, 277-288 |
| 1537239 | CIF | Bi2.667 Br2 O9 Se3 | B b a b :2 | 15.884; 15.884; 18.305 90; 90; 90 | 4618.38 | Ruck, M.; Schmidt, P. Synthesen und Kristallstrukturen der homoeotypen Selenitbromide Bi8 (Se O3)9 Br6 und Cs Sm21 (Se O3)24 Br16 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 2133-2143 |
| 1537242 | CIF | Br16 Cs O72 Se24 Sm21 | B b a b :2 | 15.797; 15.797; 17.963 90; 90; 90 | 4482.58 | Ruck, M.; Schmidt, P. Synthesen und Kristallstrukturen der homoeotypen Selenitbromide Bi8 (Se O3)9 Br6 und Cs Sm21 (Se O3)24 Br16 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 2133-2143 |
| 1533235 | CIF | O7 Rh2 Sr3 | B b c b :2 | 5.4744; 5.4716; 20.875 90; 90; 90 | 625.284 | Yamaura, K.; Huang, Q.; Young, D.P.; Noguchi, Y.; Takayama-Muromachi, E. Crystal structure and electronic and magnetic properties of the bilayered rhodium oxide Sr3 Rh2 O7 Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2002, 66, 134431-1-134431-7 |
| 1527126 | CIF | I14 Ta6 | B b c m | 14.445; 12.505; 15 90; 90; 90 | 2709.52 | Bauer, D.; von Schnering, H.G.; Schaefer, H. Darstellung, Eigenschaften, Struktur von Ta6 J14 Journal of the Less-Common Metals, 1965, 8, 388-401 |
| 1529956 | CIF | Br Cl3 Cr Rb2 | B b c m | 7.201; 7.201; 16.073 90; 90; 90 | 833.456 | Fyne, P.J.; Day, P. Powder neutron diffraction study of the crystal and magnetic structures of ferromagnetic mixed anion salts Rb2 Cr Cl4-x Xx Materials Research Bulletin, 1985, 20, 197-201 |
| 1529957 | CIF | Br2 Cl2 Cr Rb2 | B b c m | 7.216; 7.234; 16.373 90; 90; 90 | 854.68 | Fyne, P.J.; Day, P. Powder neutron diffraction study of the crystal and magnetic structures of ferromagnetic mixed anion salts Rb2 Cr Cl4-x Xx Materials Research Bulletin, 1985, 20, 197-201 |
| 1529958 | CIF | Cl2 Cr I2 Rb2 | B b c m | 7.332; 7.34; 17.345 90; 90; 90 | 933.454 | Fyne, P.J.; Day, P. Powder neutron diffraction study of the crystal and magnetic structures of ferromagnetic mixed anion salts Rb2 Cr Cl4-x Xx Materials Research Bulletin, 1985, 20, 197-201 |
| 1534087 | CIF | Cu F6 Sr2 | B b c m | 5.708; 5.708; 16.446 90; 90; 90 | 535.831 | von Schnering, H.G.; Kolloch, B.; Kolodziejczyk, A. Zur Struktur ternaerer Kupfer(II)- und Chrom(II)-Fluoride Angewandte Chemie (German Edition), 1971, 83, 440-440 |
| 4030189 | CIF | D I | B b c m | 6.0114; 6.0735; 6.5506 90; 90; 90 | 239.164 | Cockcroft, Jeremy K.; Simon, Arndt; Borrmann, Horst; Obermeyer, Axel The crystal structures of the low-temperature modifications of deuterium iodide - a neutron study European Journal of Solid State and Inorganic Chemistry, 1988, 25, 471-481 |
| 4306605 | CIF | H K O4 S | B b c m | 8.429; 9.8938; 19.195 90; 90; 90 | 1600.8 | Diptikanta Swain; Tayur N. Guru Row In Situ Crystallography of KHSO4: Probing the Kinetic Pathway for the Evolution of a Pyrolysis Reaction in the Crystalline State Inorganic Chemistry, 2008, 47, 8613-8615 |
| 9009311 | CIF | Al Fe0.89 H4 Mn0.11 O7 P | B b e 2 | 10.395; 13.394; 6.918 90; 90; 90 | 963.197 | Giuseppetti, G.; Tadini, C. The crystal structure of childrenite from Tavistock (SW England), Ch89Eo11 term of childrenite-eosphorite series Note: this is the prefered model Locality: Tavistock, SW England Neues Jahrbuch fur Mineralogie, Monatshefte, 1984, 1984, 263-271 |
| 9009312 | CIF | Al Fe0.89 H3 Mn0.11 O5 P | B b e 2 | 10.395; 13.394; 6.918 90; 90; 90 | 963.197 | Giuseppetti, G.; Tadini, C. The crystal structure of childrenite from Tavistock (SW England), Ch89Eo11 term of childrenite-eosphorite series Note: this is not the preferred model Locality: Tavistock, SW England Neues Jahrbuch fur Mineralogie, Monatshefte, 1984, 1984, 263-271 |
| 1535261 | CIF | Cu F4 K2 | B b e m | 5.9043; 5.9043; 12.734 90; 90; 90 | 443.917 | Hidaka, M.; Inoue, K.; Yamada, I.; Walker, P.J. X-ray diffraction study of the crystal structures of K2 Cu F4 and K2 Cux Zn1-x F4 Physica B and C (Netherland) (79,1975-), 1983, 121, 343-350 |
| 1539091 | CIF | Br16 W6 | B b e m | 14.606; 14.262; 12.071 90; 90; 90 | 2514.52 | Siepmann, R.; von Schnering, H.G. Die Kristallstruktur von W6 Br16 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1968, 357, 289-298 |
| 1542039 | CIF | Cl14 Nb6 | B b e m | 12.252; 11.019; 13.494 90; 90; 90 | 1821.76 | Simon, A.; von Schnering, H.G.; Schaefer, H.; Woehrle, H. Nb6 Cl14 Synthese, Eigenschaften, Struktur Zeitschrift fuer Anorganische und Allgemeine Chemie, 1965, 339, 155-170 |
| 2310860 | CIF | Al Fe0.3333 H4 Mn0.6667 O7 P | B b e m | 10.52; 13.6; 6.97 90; 90; 90 | 997.212 | Hanson, A.W. The Crystal Structure of Eosphorite Acta Crystallographica (1,1948-23,1967), 1960, 13, 384-387 |
| 7234924 | CIF | C6 H16 Br5 N2 Sb | B b e m | 22.4485; 18.9653; 7.9488 90; 90; 90 | 3384.14 | Li, Maofan; Teng, Bing; Han, Shiguo; Yang, Tao; Li, Yaobin; Liu, Yi; Zhang, Xinyuan; Liu, Xitao; Luo, Junhua; Sun, Zhihua Near-room-temperature tunable dielectric response induced by dual phase transitions in a lead-free hybrid: (C3H8N)2SbBr5 CrystEngComm, 2019, 21, 3740 |
| 8104454 | CIF | Cl12 Mo6 | B b e m | 11.253; 11.277; 14.068 90; 90; 90 | 1785.23 | von Schnering, H.G.; May, W.; Peters, K. Crystal structure of dodecachloro octahedrohexamolybdenium Zeitschrift fuer Kristallographie (149,1979-), 1993, 208, 368-369 |
| 9000543 | CIF | H2 Mg1.214 Mn0.786 O6 Si Zn | B b e m | 8.185; 18.65; 6.256 90; 90; 90 | 954.98 | Moore, P. B.; Araki, T. Gerstmannite, a new zinc silicate mineral and a novel cubic close-packed oxide structure American Mineralogist, 1977, 62, 51-59 |
| 1001508 | CIF | Ba4 Na2 Nb10 O30 | B b m 2 | 35.1869; 17.6202; 7.9876 90; 90; 90 | 4952.3 | Labbe, P; Leligny, H; Raveau, B; Schneck, J; Toledano, J C X-ray structural determination of the quasi-commensurate phase of barium sodium niobate Journal of Physics: Condensed Matter, 1989, 2, 25-43 |
| 1540215 | CIF | Ba4 Na2 Nb10 O30 | B b m 2 | 35.1869; 17.6202; 7.9876 90; 90; 90 | 4952.31 | Labbe, P.; Raveau, B.; Leligny, H.; Toledano, J.C.; Schneck, J. X-ray structural determination of the quasi-commensurate phase of barium sodium niobate Journal of Physics: Condensed Matter, 1990, 2, 25-43 |
| 4000413 | CIF | F30 Fe10 K5.24 | B b m 2 | 35.73; 17.872; 7.903 90; 90; 90 | 5046.6 | Chemistry of Materials, 2004 |
| 4330278 | CIF HKL | Bi39.615 Cu5.671 Li6.72 O120 P20 | B b m 2 | 11.5048; 5.4565; 41.656 90; 90; 90 | 2615 | Diana Endara; Marie Colmont; Marielle Huvé; Frederic Capet; Julien Lejay; P. Aschehoug; Olivier Mentre Inorganic Polar Blocks into Controlled Acentric Assemblies Inorganic Chemistry, 2012, 51, 9557-9562 |
| 1534544 | CIF | Bi1.952 Ca0.23 Cu1.86 O8 Sr1.84 | B b m b | 5.407; 5.412; 30.771 90; 90; 90 | 900.442 | Levin, A.A.; Smolin, Yu.I.; Shepelev, Yu.F. Modulated structure of superconducting Bi2 Sr2 Ca Cu2 O8+x single crystal Zhurnal Neorganicheskoi Khimii, 1993, 38, 1755-1766 |
| 1536784 | CIF | Bi2 Ca Cu2 O9 Sr2 | B b m b | 5.3957; 5.3971; 30.649 90; 90; 90 | 892.534 | Yamamoto, A.; Onoda, A.; Takayama-Muromachi, E.; Izumi, F. Rietveld analysis of the modulated structure in the superconducting Oxide Bi2 (Sr,Ca)3 Cu2 O8+x Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1990, 42, 4228-4239 |
| 1000060 | CIF | Al2 O5 Ti | B b m m | 9.429; 9.636; 3.591 90; 90; 90 | 326.3 | Morosin, B; Lynch, R W Structure studies on Al~2~ Ti O~5~ at room temperature and at 600C Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1040-1046 |
| 1008077 | CIF | Ca O4 Ti2 | B b m m | 9.727; 9.976; 3.136 90; 90; 90 | 304.3 | Bertaut, E F; Blum, P Determination de la Structure de Ti~2~ Ca O~4~ par la Methode Self- Consistante d'Approche Directe Acta Crystallographica (1,1948-23,1967), 1956, 9, 121-126 |
| 1008153 | CIF | Ca O4 Ti2 | B b m m | 9.727; 9.976; 3.136 90; 90; 90 | 304.3 | Bertaut, F; Blum, P Determination de la structure de Ti~2~ Ca O~4~ par la methode statistique Journal de Physique et du Radium, 1956, 17, 517-518 |
| 1010214 | CIF | Cl Na O4 | B b m m | 6.48; 7.06; 7.08 90; 90; 90 | 323.9 | Zachariasen, W H The Crystal Structure of Sodium Perchlorate, Na Cl O~4~ Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1930, 73, 141-146 |
| 1509903 | CIF | Ag4.8 Pb2.4 S24 Sb12 | B b m m | 13; 19.17; 4.246 90; 90; 90 | 1058.15 | Kuz'mina, O.V.; Mozgova, N.N.; Organova, N.I.; Bortnikov, N.S. The crystal structure of the subcell of synthetic Andorite-24 Doklady Akademii Nauk SSSR, 1982, 267, 939-942 |
| 1525685 | CIF | Al2 Mo0.344 O5 Ti0.656 | B b m m | 9.4778; 9.7728; 3.6299 90; 90; 90 | 336.218 | Biswas, S.K.; Datta, T.K.; Chowdury, D.A.; Alamgir, M. Synthesis and X-ray diffraction study of Al2 Ti0.656 Mo0.344 O5 Nuclear Science and Applications, 1998, 7, 33-37 |
| 1533104 | CIF | Fe3 O4 | B b m m | 9.326; 9.288; 2.7555 90; 90; 90 | 238.681 | Dubrovinskii, L.S.; Dubrovinskaya, N.A.; McCammon, C.; Dmitriev, V.; Rozenberg, G.Kh.; Le Bihan, T.; Osorio-Guillen, J.M.; Johansson, B.; Weber, H.P. The structure of the metallic high-pressure Fe3 O4 polymorph: experimental and theoretical study Journal of Physics: Condensed Matter, 2003, 15, 7697-7706 |
| 1538451 | CIF | Bi2.342 Pb5.484 S9 | B b m m | 13.697; 31.355; 4.132 90; 90; 90 | 1774.57 | Otto, H.H.; Strunz, H. Zur Kristallchemie synthetischer Blei-Wismut-Spiessglanze Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-), 1968, 108, 1-19 |
| 1538452 | CIF | Bi2.12 Pb2.82 S6 | B b m m | 13.522; 20.608; 4.112 90; 90; 90 | 1145.86 | Otto, H.H.; Strunz, H. Zur Kristallchemie synthetischer Blei-Wismut-Spiessglanze Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-), 1968, 108, 1-19 |
| 1539113 | CIF | Fe0.5 Mg0.5 O5 Ti2 | B b m m | 9.743; 10.001; 3.728 90; 90; 90 | 363.255 | Smyth, J.R. The crystal chemistry of armacolites from apollo 17 Earth and Planetary Science Letters, 1974, 24, 262-270 |
| 1546943 | CIF | Al2 O5 Ti | B b m m | 9.4359; 9.6425; 3.593 90; 90; 90 | 326.91 | Ohta, Y.; Kawauchi, Y.; Ban, T. Cation distribution of pseudobrookite-type titanates and their phase stability Journal of the Ceramic Society of Japan, 2017, 125, 695-700 |
| 2002201 | CIF | Ga2 O5 Ti | B b m m | 9.792; 9.966; 3.597 90; 90; 90 | 351 | Mueller-Buschbaum, Hk; Freund, R Zur kristallchemie von Ga2 Ti O5 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977), 1974, 29, 590-593 |
| 2106068 | CIF | K O3 P | B b m m | 12.94; 4.54; 5.92 90; 90; 90 | 347.786 | Jost, K.H.; Schulze, H.J. Mechanismen der Phasentransformation des K (P O3) und die Struktur der Hoechsttemperatur Modifikation des K (P O3) Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1345-1353 |
| 2107079 | CIF | Al2 O5 Ti | B b m m | 9.481; 9.738; 3.583 90; 90; 90 | 330.804 | Morosin, B.; Lynch, R.W. Structure studies on Al2 Ti O5 at room temperature and at 600C Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1040-1046 |
| 4000656 | CIF | Fe3 Nd O9 Sr3 | B b m m | 5.5414; 5.4986; 28.81 90; 90; 90 | 877.8 | Barrier, N.; Pelloquin, D.; Nguyen, N.; Giot, M.; Bourrée, F.; Raveau, B. Ferrite Sr~3~NdFe~3~O~9~: An Original Intergrowth between the Brownmillerite and K~2~NiF~4~-type Structures Chemistry of Materials, 2005, 17, 6619-6623 |
| 8103594 | CIF | Bi20.9 Pb4.65 S36 | B b m m | 13.343; 60.022; 4.033 90; 90; 90 | 3229.92 | Takeuchi, Y.; Ozawa, T.; Takagi, J. Tropochemical cell-twinning and the 60-A-structure of phase V in the Pb S - Bi2 S3 system Zeitschrift fuer Kristallographie (149,1979-), 1979, 150, 75-84 |
| 9000193 | CIF | Fe5 H5 O17 P3 | B b m m | 13.783; 16.805; 5.172 90; 90; 90 | 1197.96 | Moore, P. B. Crystal chemistry of the basic iron phosphates American Mineralogist, 1970, 55, 135-169 |
| 9000579 | CIF | Fe0.5 Mg0.5 O5 Ti1.999 | B b m m | 9.7762; 10.0341; 3.7504 90; 90; 90 | 367.897 | Wechsler, B. A. Cation distribution and high-temperature crystal chemistry of armalcolite sample Arm-E, T = 24 deg C, before annealing American Mineralogist, 1977, 62, 913-920 |
| 9000580 | CIF | Fe0.044 Mg0.5 O5 Ti2 | B b m m | 9.745; 10.0625; 3.7422 90; 90; 90 | 366.957 | Wechsler, B. A. Cation distribution and high-temperature crystal chemistry of armalcolite sample Arm-E, T = 24 deg C, after annealing American Mineralogist, 1977, 62, 913-920 |
| 9000581 | CIF | Fe0.5 Mg0.5 O5 Ti2 | B b m m | 9.899; 10.1835; 3.76422 90; 90; 90 | 379.458 | Wechsler, B. A. Cation distribution and high-temperature crystal chemistry of armalcolite sample Arm-E, T = 1100 deg C American Mineralogist, 1977, 62, 913-920 |
| 9000582 | CIF | Fe0.499 Mg0.499 O5 Ti2 | B b m m | 9.7697; 10.041; 3.7473 90; 90; 90 | 367.601 | Wechsler, B. A. Cation distribution and high-temperature crystal chemistry of armalcolite sample Arm-E, T = 24 deg C, after heating American Mineralogist, 1977, 62, 913-920 |
| 9000583 | CIF | Fe0.5 Mg0.5 O5 Ti2 | B b m m | 9.7655; 10.0762; 3.7429 90; 90; 90 | 368.298 | Wechsler, B. A. Cation distribution and high-temperature crystal chemistry of armalcolite sample Arm-C, T = 400 deg C American Mineralogist, 1977, 62, 913-920 |
| 9000946 | CIF | Ca2 H4 Mn3 O14 Si2.5 | B b m m | 9.074; 19.13; 6.121 90; 90; 90 | 1062.52 | Moore, P. B.; Shen, J.; Araki, T. Crystal chemistry of the (M2)3+ phi2 sheet: Structural principles and crystal structures of ruizite, macfallite and orientite American Mineralogist, 1985, 70, 171-181 |
| 9002011 | CIF | Mg O5 Ti2 | B b m m | 9.7131; 10.019; 3.7363 90; 90; 90 | 363.6 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 0 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002012 | CIF | Mg O5 Ti2 | B b m m | 9.6944; 9.9924; 3.7316 90; 90; 90 | 361.481 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 1.03 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002013 | CIF | Mg O5 Ti2 | B b m m | 9.6739; 9.9651; 3.7265 90; 90; 90 | 359.24 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 2.16 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002014 | CIF | Mg O5 Ti2 | B b m m | 9.654; 9.9387; 3.7218 90; 90; 90 | 357.1 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 3.22 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002015 | CIF | Mg O5 Ti2 | B b m m | 9.6349; 9.9143; 3.7168 90; 90; 90 | 355.041 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 4.34 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002016 | CIF | Mg O5 Ti2 | B b m m | 9.5992; 9.8667; 3.7085 90; 90; 90 | 351.241 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 6.20 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002017 | CIF | Mg O5 Ti2 | B b m m | 9.5754; 9.8352; 3.7029 90; 90; 90 | 348.724 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 7.51 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002018 | CIF | Mg O5 Ti2 | B b m m | 9.7602; 9.9796; 3.7479 90; 90; 90 | 365.056 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 0.00 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002019 | CIF | Mg O5 Ti2 | B b m m | 9.7392; 9.9539; 3.7426 90; 90; 90 | 362.819 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 1.03 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002020 | CIF | Mg O5 Ti2 | B b m m | 9.7166; 9.9275; 3.7369 90; 90; 90 | 360.467 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 2.16 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002021 | CIF | Mg O5 Ti2 | B b m m | 9.6949; 9.9022; 3.7313 90; 90; 90 | 358.208 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 3.22 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002022 | CIF | Mg O5 Ti2 | B b m m | 9.6737; 9.8769; 3.7271 90; 90; 90 | 356.11 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 4.34 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002023 | CIF | Mg O5 Ti2 | B b m m | 9.6327; 9.8302; 3.7177 90; 90; 90 | 352.034 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 6.20 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002024 | CIF | Mg O5 Ti2 | B b m m | 9.608; 9.8024; 3.7114 90; 90; 90 | 349.545 | Yang, H.; Hazen, R. M. Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 7.51 GPa American Mineralogist, 1999, 84, 130-137 |
| 9002332 | CIF | Fe3 O4 | B b m m | 9.273; 9.239; 2.746 90; 90; 90 | 235.259 | Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D. Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at 40 GPa, CaTi2O4 structure type American Mineralogist, 2000, 85, 514-523 |
| 9004974 | CIF | Bi1.962 Pb2.962 S5.76 Se0.24 | B b m m | 13.567; 20.655; 4.1216 90; 90; 90 | 1154.98 | Pinto, D.; Balic-Zunic T; Garavelli, A.; Makovicky, E.; Vurro, F. Comparative crystal-structure study of Ag-free lillianite and galenobismutite from Vulcano, Aeolian Islands, Italy The Canadian Mineralogist, 2006, 44, 159-175 |
| 9009154 | CIF | Fe H O2 | B b m m | 12.4; 3.87; 3.06 90; 90; 90 | 146.843 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 290-295 |
| 9009155 | CIF | Al H O2 | B b m m | 12.227; 3.7; 2.866 90; 90; 90 | 129.658 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 290-295 |
| 9009156 | CIF | H O2 Sc | B b m m | 13.01; 4.01; 3.24 90; 90; 90 | 169.031 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 290-295 |
| 9009157 | CIF | Cu H2 O2 | B b m m | 10.59; 5.256; 2.949 90; 90; 90 | 164.144 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 290-295 |
| 9009250 | CIF | Bi2 Pb3 S6 | B b m m | 13.58; 20.51; 4.09 90; 90; 90 | 1139.17 | Makovicky, E. Chemistry and crystallography of the lillianite homologous series Part III. Crystal chemistry of lillianite homologues. Related phases Neues Jahrbuch fur Mineralogie, Abhandlungen, 1977, 131, 187-207 |
| 9009276 | CIF | Ag Pb S6 Sb3 | B b m m | 13; 19.15; 4.3 90; 90; 90 | 1070.48 | Kawada, I.; Hellner, E. Die kristallstruktur der pseudozelle (sub cell) von andorit VI (ramdohrit) Neues Jahrbuch fur Mineralogie, Monatshefte, 1971, 1971, 551-560 |
| 9011262 | CIF | Mg0.999 O5 Ti2.001 | B b m m | 9.7289; 10.0057; 3.7416 90; 90; 90 | 364.224 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 973 K Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011263 | CIF | Mg O5 Ti2 | B b m m | 9.7492; 9.9896; 3.746 90; 90; 90 | 364.825 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 1773 Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9012885 | CIF | Bi2 Pb6 S9 | B b m m | 13.712; 31.21; 4.131 90; 90; 90 | 1767.87 | Takeuchi, Yoshio; Takagi, Junkou The Structure of Heyrovskyite (6PbS•Bi~2~S~3~) Proceedings of the Japan Academy, 1974, 50, 76-79 |
| 9013282 | CIF | Ca O4 Ti2 | B b m m | 9.086; 9.335; 8.585 90; 90; 90 | 728.161 | Yamanaka, T.; Uchida, A.; Nakamoto, Y. Structural transition of post-spinel phases CaMn2O4, CaFe2O4, and CaTi2O4 under high pressures up to 80 GPa Note: Pressure = 80 GPa American Mineralogist, 2008, 93, 1874-1881 |
| 9013434 | CIF | Al0.24 Fe5.6 H6 O18 P3 Zn1.16 | B b m m | 13.865; 16.798; 5.151 90; 90; 90 | 1199.69 | Elliot, P.; Kolitsch, U.; Giester, G.; Libowitzky, E.; McCammon, C.; Pring, A.; Birch, W. D.; Brugger, J. Description and crystal structure of a new mineral - plimerite, ZnFe3+4(PO4)3(OH)5 - the Zn-analogue of rockbridgeite and frondelite, from Broken Hill, New South Wales, Australia Locality: Broken Hill, New South Wales, Australia Mineralogical Magazine, 2009, 73, 131-148 |
| 9014172 | CIF | Bi2 Pb3 S6 | B b m m | 13.216; 20.163; 4.03 90; 90; 90 | 1073.89 | Olsen, L. A.; Balic Zunic, T.; Makovicky, E. High-pressure anisotropic distortion of Pb3Bi2S6: a pressure-induced, reversible phase transition with migration of chemical bonds Note: P = 3.73 GPa Note: occupancies not refined Inorganic Chemistry, 2008, 47, 6756-6762 |
| 9014485 | CIF | Bi2 Pb3 S6 | B b m m | 13.353; 20.367; 4.0615 90; 90; 90 | 1104.57 | Olsen, L. A.; Balic Zunic, T.; Makovicky, E. High-pressure anisotropic distortion of Pb3Bi2S6: a pressure-induced, reversible phase transition with migration of chemical bonds Note: P = 1.95 GPa Note: occupancies not refined Inorganic Chemistry, 2008, 47, 6756-6762 |
| 9015122 | CIF | Bi2 Pb3 S6 | B b m m | 13.535; 20.451; 4.104 90; 90; 90 | 1136.01 | Takagi, J.; Takeuchi, Y. The crystal structure of lillianite Acta Crystallographica, Section B, 1972, 28, 649-651 |
| 9015398 | CIF | Bi2 Pb3 S6 | B b m m | 13.54; 20.637; 4.1103 90; 90; 90 | 1148.52 | Olsen, L. A.; Balic Zunic, T.; Makovicky, E. High-pressure anisotropic distortion of Pb3Bi2S6: a pressure-induced, reversible phase transition with migration of chemical bonds Note: P = 0.0001 GPa Note: occupancies not refined Inorganic Chemistry, 2008, 47, 6756-6762 |
| 9015615 | CIF | Bi2 Pb3 S6 | B b m m | 13.28; 20.26; 4.0448 90; 90; 90 | 1088.27 | Olsen, L. A.; Balic Zunic, T.; Makovicky, E. High-pressure anisotropic distortion of Pb3Bi2S6: a pressure-induced, reversible phase transition with migration of chemical bonds Note: P = 2.90 GPa Note: occupancies not refined Inorganic Chemistry, 2008, 47, 6756-6762 |
| 9016550 | CIF | Bi2.12 Pb5.828 S8.7 Se0.3 | B b m m | 13.7498; 31.5053; 4.1475 90; 90; 90 | 1796.66 | Pinto, D.; Balic-Zunic T; Garavelli, A.; Vurro, F. Structure refinement of Ag-free heyrovskyite from Vulcano (Aeolian Islands, Italy) American Mineralogist, 2011, 96, 1120-1128 |
| 9017258 | CIF | Fe4.44 H5.88 Mn0.52 O17 P3 Zn0.04 | B b m m | 14.0016; 16.8593; 5.1831 90; 90; 90 | 1223.51 | Grey, I. E.; Kampf, A. R.; Keck, E.; Cashion, J. D.; MacRae, C. M.; Gozukara, Y.; Peterson, V. K.; Shanks, F. L. The rockbridgeite group approved and a new member, ferrorockbridgeite, (Fe2+,Mn2+)2(Fe3+)3(PO4)3(OH)4(H2O), described from the Hagendorf Sud pegmatite, Oberpfalz, Bavaria Note: neutron powder on sample IGC90 European Journal of Mineralogy, 2019, 31, 389-397 |
| 9017259 | CIF | Fe4.17 H5.78 Mn0.77 O17 P3 Zn0.06 | B b m m | 13.995; 16.884; 5.1866 90; 90; 90 | 1225.55 | Grey, I. E.; Kampf, A. R.; Keck, E.; Cashion, J. D.; MacRae, C. M.; Gozukara, Y.; Peterson, V. K.; Shanks, F. L. The rockbridgeite group approved and a new member, ferrorockbridgeite, (Fe2+,Mn2+)2(Fe3+)3(PO4)3(OH)4(H2O), described from the Hagendorf Sud pegmatite, Oberpfalz, Bavaria Note: X-ray single crystal on sample IGC29 Note: T = 100 K European Journal of Mineralogy, 2019, 31, 389-397 |
| 9017404 | CIF | Ca O4 S | B b m m | 6.24; 6.98; 6.97 90; 90; 90 | 303.58 | Wasastjerna, J. The crystal structure of anhydrite, CaSO4 Commentationes Physico-Mathematicae, 1927, 2, 1-46 |
| 9017826 | CIF | Ca O4 S | B b m m | 6.23; 6.98; 6.97 90; 90; 90 | 303.093 | Hohne, E. A more accurate determination of the crystal structure of anhydrite, CaSO4 Soviet Physics Crystallography, 1962, 7, 559-569 |
| 1001582 | CIF | C Cu11 O28 Sr8 Y4 | B m 2 m | 15.311; 3.851; 22.371 90; 90; 90 | 1319.1 | Domenges, B; Hervieu, M; Raveau, B Ordered substitution of "CO~3~" groups for CuO~4~ square groups in the "123" structure. The oxycarbonate Y~4~Sr~8~Cu~11~CO~3~O~25~, n=4 member of the series Y~n~Sr~2n~Cu~3n-1~CO~3~O~7n-3~ Physica C (Amsterdam) (152,1988-), 1993, 207, 65-78 |
| 1001615 | CIF | C Ba4 Ca0.7 Cu5 O14 Y1.3 | B m 2 m | 7.7704; 3.8876; 22.98119 90; 90; 90 | 694.2 | Domenges, B; Boullay, Ph; Hervieu, M; Raveau, B The substitution of CO~3~ groups for copper in Y~1- x~Ca~x~Ba~2~Cu~3~O~7~: HREM study Journal of Solid State Chemistry, 1994, 108, 219-229 |
| 1006010 | CIF | Ni O4 Pr2 | B m a b | 5.4042; 5.578; 12.22 90; 90; 90 | 368.4 | Puche, R S; Fernandez, F; Rodriguez Carvajal, J; Martinez, J L Magnetic And X-Ray Diffraction Characterization of Stoichiometric Pr~2~ Ni O~4~ and Nd~2~ Ni O~4~ Oxides Solid State Communications, 1989, 72, 273-277 |
| 1006011 | CIF | Nd2 Ni O4 | B m a b | 5.3814; 5.585; 12.1143 90; 90; 90 | 364.1 | Puche, R S; Fernandez, F; Rodriguez Carvajal, J; Martinez, J L Magnetic And X-Ray Diffraction Characterization of Stoichiometric Pr~2~ Ni O~4~ and Nd~2~ Ni O~4~ Oxides Solid State Communications, 1989, 72, 273-277 |
| 1006025 | CIF | Nd2 Ni O4 | B m a b | 5.3876; 5.5883; 12.135 90; 90; 90 | 365.4 | Rodriguez-Carvajal, J; Fernandez-Diaz, M T; Martinez, J L; Fernandez, F; Saez-Puche, R Structural phase transitions and three-dimensional magnetic ordering in the Nd~2~NiO~4~ oxide Europhysics Letters, 1990, 11, 261-268 |
| 1006026 | CIF | Nd2 Ni O4 | B m a b | 5.37325; 5.5913; 12.0976 90; 90; 90 | 363.5 | Rodriguez-Carvajal, J; Fernandez-Diaz, M T; Martinez, J L; Fernandez, F; Saez-Puche, R Structural phase transitions and three-dimensional magnetic ordering in the Nd~2~NiO~4~ oxide Europhysics Letters, 1990, 11, 261-268 |
| 1006042 | CIF | La2 Ni O4 | B m a b | 5.4618; 5.4967; 12.561 90; 90; 90 | 377.1 | Rodriguez-Carvajal, J; Fernandez-Diaz, M T; Martinez, J L Neutron diffraction study on structural and magnetic properties of La~2~NiO~4~ Journal of Physics: Condensed Matter, 1991, 3, 3215-3234 |
| 1006044 | CIF | La2 Ni O4 | B m a b | 5.4419; 5.5364; 12.4896 90; 90; 90 | 376.3 | Rodriguez-Carvajal, J; Fernandez-Diaz, M T; Martinez, J L Neutron diffraction study on structural and magnetic properties of La~2~NiO~4~ Journal of Physics: Condensed Matter, 1991, 3, 3215-3234 |
| 1006045 | CIF | La2 Ni O4 | B m a b | 5.4499; 5.5275; 12.5118 90; 90; 90 | 376.9 | Rodriguez-Carvajal, J; Fernandez-Diaz, M T; Martinez, J L Neutron diffraction study on structural and magnetic properties of La~2~NiO~4~ Journal of Physics: Condensed Matter, 1991, 3, 3215-3234 |
| 1006131 | CIF | La2 Ni O4 | B m a b | 5.4324; 5.5277; 12.488 90; 90; 90 | 375 | Medarde, M.; Rodriguez-Carvajal, J. Oxygen vacancy ordering in La~2-x~Sr~x~NiO~4-δ~ (0 <= x <= 0.5): the crystal structure and defects investigated by neutron diffraction Zeitschrift für Physik B: Condensed Matter, 1997, 102, 307-315 |
| 1006132 | CIF | La1.97 Ni O4 Sr0.03 | B m a b | 5.4325; 5.5148; 12.523 90; 90; 90 | 375.2 | Medarde, M.; Rodriguez-Carvajal, J. Oxygen vacancy ordering in La~2-x~Sr~x~NiO~4-δ~ (0 <= x <= 0.5): the crystal structure and defects investigated by neutron diffraction Zeitschrift für Physik B: Condensed Matter, 1997, 102, 307-315 |
| 1006133 | CIF | La1.94 Ni O3.94 Sr0.06 | B m a b | 5.4332; 5.4994; 12.5734 90; 90; 90 | 375.7 | Medarde, M.; Rodriguez-Carvajal, J. Oxygen vacancy ordering in La~2-x~Sr~x~NiO~4-δ~ (0 <= x <= 0.5): the crystal structure and defects investigated by neutron diffraction Zeitschrift für Physik B: Condensed Matter, 1997, 102, 307-315 |
| 1006173 | CIF | Ca0.03 Cu La1.97 O4 | B m a b | 5.3513; 5.3907; 13.1603 90; 90; 90 | 379.6 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006174 | CIF | Ca0.05 Cu La1.95 O4 | B m a b | 5.349; 5.3822; 13.1638 90; 90; 90 | 379 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006175 | CIF | Ca0.08 Cu La1.92 O4 | B m a b | 5.3456; 5.3673; 13.1698 90; 90; 90 | 377.9 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006176 | CIF | Ca0.1 Cu La1.9 O4 | B m a b | 5.344; 5.358; 13.1752 90; 90; 90 | 377.2 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006178 | CIF | Ca0.03 Cu La1.97 O4 | B m a b | 5.3336; 5.4; 13.1256 90; 90; 90 | 378 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006179 | CIF | Ca0.05 Cu La1.95 O4 | B m a b | 5.3291; 5.3946; 13.1282 90; 90; 90 | 377.4 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006180 | CIF | Ca0.08 Cu La1.92 O4 | B m a b | 5.3271; 5.3793; 13.1327 90; 90; 90 | 376.3 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006181 | CIF | Ca0.1 Cu La1.9 O4 | B m a b | 5.3239; 5.3709; 13.1446 90; 90; 90 | 375.9 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006182 | CIF | Ca0.12 Cu La1.88 O4 | B m a b | 5.3304; 5.3663; 13.1464 90; 90; 90 | 376 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006183 | CIF | Ca0.03 Cu La1.97 O4.091 | B m a b | 5.351; 5.3801; 13.194 90; 90; 90 | 379.8 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006184 | CIF | Ca0.05 Cu La1.95 O4.09 | B m a b | 5.3514; 5.373; 13.1945 90; 90; 90 | 379.4 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006185 | CIF | Ca0.08 Cu La1.92 O4.079 | B m a b | 5.3508; 5.364; 13.1925 90; 90; 90 | 378.6 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006186 | CIF | Ca0.1 Cu La1.9 O4.058 | B m a b | 5.3474; 5.3581; 13.187 90; 90; 90 | 377.8 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006188 | CIF | Ca0.03 Cu La1.97 O4.12 | B m a b | 5.3299; 5.387; 13.1614 90; 90; 90 | 377.9 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006189 | CIF | Ca0.05 Cu La1.95 O4.1 | B m a b | 5.331; 5.3826; 13.1623 90; 90; 90 | 377.7 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006190 | CIF | Ca0.08 Cu La1.92 O4.07 | B m a b | 5.336; 5.3671; 13.1638 90; 90; 90 | 377 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006191 | CIF | Ca0.1 Cu La1.9 O4.05 | B m a b | 5.3311; 5.3653; 13.157 90; 90; 90 | 376.3 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1006192 | CIF | Ca0.12 Cu La1.88 O4.05 | B m a b | 5.3313; 5.3666; 13.1531 90; 90; 90 | 376.3 | Rial, C; Moran, E; Alario-Franco, M A; Amador, U; Martinez, J L; Rodriguez-Carvajal, J; Andersen, N H Effects of extra oxygen on the structure and superconductivity of La2-x Cax Cu O4+y prepared by chemical oxidation Physica C (Amsterdam) (152,1988-), 1998, 297, 277-293 |
| 1008541 | CIF | Cu La2 O4 | B m a b | 5.352; 5.4; 13.157 90; 90; 90 | 380.2 | Tuilier, M H; Chevalier, B; Tressaud, A; Brisson, C; Soubeyroux, J L; Etourneau, J EXAFS study at the LaL~III~ X-ray absorption edge of superconducting materials obtained by fluorination of La~2-x~Sr~x~CuO~4~ oxides (0<x<0.15) Physica C (Amsterdam) (152,1988-), 1992, 200, 113-121 |
| 1008542 | CIF | Cu La2 O4.178 | B m a b | 5.328; 5.427; 13.194 90; 90; 90 | 381.5 | Tuilier, M H; Chevalier, B; Tressaud, A; Brisson, C; Soubeyroux, J L; Etourneau, J EXAFS study at the LaL~III~ X-ray absorption edge of superconducting materials obtained by fluorination of La~2-x~Sr~x~CuO~4~ oxides (0<x<0.15) Physica C (Amsterdam) (152,1988-), 1992, 200, 113-121 |
| 1010325 | CIF | P | B m a b | 3.31; 4.38; 10.5 90; 90; 90 | 152.2 | Hultgren, R; Gingrich, N S; Warren, B E The Atomic Distribution in Red and Black Phosphorus and the Crystal Structure of Black Phosphorus Journal of Chemical Physics, 1935, 3, 351-355 |
| 1511351 | CIF | C6 B10 N12 O8 U | B m a b | 13.675; 19.792; 20.49 90; 90; 90 | 5545.73 | Mikhailov, Yu. N.; Kuznetsov, N. T.; Zemskova, L. A.; Mistryukov, V. E.; Kanishcheva, A. S.; Solntsev, K. A. A Preliminary determination of the crystal structures of uranyl complexes with neutral ligands and closoborate anions (U O2 (C O (N H2)2)5 (B10 H10) (C O (N H2)2)2 and (U O2 (H2 O)5) (B12 H12) (H2 O)6 Zhurnal Neorganicheskoi Khimii, 1982, 27, 2343-2347 |
| 1521132 | CIF | Cu0.84 La1.84 O3.96 Sr0.15 Zn0.16 | B m a b | 5.389; 5.417; 13.238 90; 90; 90 | 386.447 | Ganguly, R.; Rajagopal, H.; Sequeira, A.; Yakhmi, J.V. Structural features of La1.85 Sr0.15 Cu O4 as influenced by substitution of Zn: neutron diffraction studies Journal of Superconductivity, 2000, 13, 163-170 |
| 1521133 | CIF | Cu0.59 La1.82 O3.96 Sr0.15 Zn0.41 | B m a b | 5.425; 5.455; 13.123 90; 90; 90 | 388.354 | Ganguly, R.; Rajagopal, H.; Sequeira, A.; Yakhmi, J.V. Structural features of La1.85 Sr0.15 Cu O4 as influenced by substitution of Zn: neutron diffraction studies Journal of Superconductivity, 2000, 13, 163-170 |
| 1521522 | CIF | La4 Ni3 O10 | B m a b | 5.41327; 5.46233; 27.96049 90; 90; 90 | 826.766 | Ling, C.D.; Argyriou, D.N.; Wu, G.-Q.; Neumeier, J.J. Neutron diffraction study of La3 Ni2 O7 : structural relationships among n = 1, 2, and 3 phases Lan+1 Nin O3n+1 Journal of Solid State Chemistry, 2000, 152, 517-525 |
| 1526923 | CIF | Cu0.7 La1.85 O4 Sr0.15 Zn0.3 | B m a b | 5.36369; 5.3932; 13.0635 90; 90; 90 | 377.894 | Wang, F.Z.; Wu, X.S.; Jiang, S.S. Microstructure of Zn, Ni, Mg doped La1.85 Sr0.15 Cu O4 in high doping level Wu Li Hsueh Pao (= Acta Physica Sinica), 2000, 49, 1541-1544 |
| 2310604 | CIF | H K O3 Si | B m a b | 11.5; 11.25; 9.65 90; 90; 90 | 1248.47 | Hilmer, W. Die Kristallstruktur des sauren Kaliummetasilicates K4 (H Si O3)4. Korrektur. Acta Crystallographica (1,1948-23,1967), 1965, 18, 574-574 |
| 4030534 | CIF | Cu La2 O4.09 | B m a b | 5.3236; 5.4033; 13.1835 90; 90; 90 | 379.223 | Lagueyte, N.; Weill, F.; Wattiaux, A.; Grenier, J.-C. Observation of superstructures in La2CuO4.09 European Journal of Solid State and Inorganic Chemistry, 1993, 30, 859-869 |
| 4030535 | CIF | Cu La2 O4.09 | B m a b | 5.3412; 5.4033; 13.2191 90; 90; 90 | 381.5 | Lagueyte, N.; Weill, F.; Wattiaux, A.; Grenier, J.-C. Observation of superstructures in La2CuO4.09 European Journal of Solid State and Inorganic Chemistry, 1993, 30, 859-869 |
| 4342929 | CIF | Ce2 Fe0.75 O2 Se2 Zn0.25 | B m a b | 22.74948; 5.69246; 17.63155 90; 90; 90 | 2283.29 | Ainsworth, Chris M.; Wang, Chun-Hai; Johnston, Hannah E.; McCabe, Emma E.; Tucker, Matthew G.; Brand, Helen E. A.; Evans, John S. O. Infinitely Adaptive Transition-Metal Ordering in Ln2O2MSe2-Type Oxychalcogenides. Inorganic chemistry, 2015, 54, 7230-7238 |
| 6000190 | CIF | Ca Cr Nd O4 | B m a b | 5.3739; 5.5411; 11.9536 90; 90; 90 | 355.95 | de Paz, J. R.; Velasco, J. H.; Fernandez-Diaz, M. T.; Porcher, P.; Martinez, J. L.; Puche, R. S. Structural and magnetic characterization of NdCaCrO4 oxide Journal of Solid State Chemistry, 1999, 148, 361-369 |
| 7221398 | CIF | Co La2 O4.22 | B m a b | 5.47813; 5.53399; 12.65714 90; 90; 90 | 383.713 | Aguadero, A.; Daza, L.; Alonso, J.A. Oxygen excess in La2 Co O(4+delta): a neutron diffraction study Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2008, 63, 615-622 |
| 9013006 | CIF | As | B m a b | 3.65; 4.47; 11 90; 90; 90 | 179.471 | Smith, P. M.; Leadbetter, A. J.; Apling, A. J. The structures of orthorhombic and vitrous arsenic Locality: synthetic Note: known as arsenolamprite Philosophical Magazine, 1975, 31, 57-64 |
| 9008217 | CIF | Ge2 H2 O10 P2 | B m a m | 12.253; 7.014; 7.161 90; 90; 90 | 615.435 | Mayer, H.; Vollenkle, H. Die kristallstruktur und fehlordnung von Ge(OH)PO4 Zeitschrift fur Kristallographie, 1972, 136, 387-401 |
| 1563122 | CIF | Ba2 O22 Ti13 | B m e b | 11.67058; 14.1202; 10.06121 90; 90; 90 | 1658 | Kataoka, Kunimitsu; Kijima, Norihito; Hayakawa, Hiroshi; Iyo, Akira; Ohshima, Ken-ichi; Akimoto, Junji Synthesis, structure and physical properties of reduced barium titanate Ba2Ti13O22 Journal of Solid State Chemistry, 2011, 184, 3117-3120 |
| 9008562 | CIF | Ga | B m e b | 4.5107; 4.5167; 7.6448 90; 90; 90 | 155.751 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 7-83 |
| 9008572 | CIF | P | B m e b | 3.31; 4.38; 10.5 90; 90; 90 | 152.227 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Sample known as black phosphorus Crystal Structures, 1963, 1, 7-83 |
| 9008573 | CIF | As | B m e b | 3.63; 4.45; 10.96 90; 90; 90 | 177.042 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
| 9008593 | CIF | Cl2 | B m e b | 6.24; 8.26; 4.48 90; 90; 90 | 230.91 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Sample at T = 113 K Crystal Structures, 1963, 1, 7-83 |
| 9008594 | CIF | Br2 | B m e b | 6.67; 8.72; 4.48 90; 90; 90 | 260.568 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Sample at T = 123 K Crystal Structures, 1963, 1, 7-83 |
| 9008595 | CIF | I2 | B m e b | 7.27007; 9.79344; 4.79004 90; 90; 90 | 341.046 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 7-83 |
| 1563426 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6573; 3.9551; 5.6717 90; 90; 90 | 126.905 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563427 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6569; 3.9621; 5.6678 90; 90; 90 | 127.034 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563428 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6566; 3.9637; 5.6675 90; 90; 90 | 127.071 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563429 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6562; 3.9665; 5.6653 90; 90; 90 | 127.103 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563430 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6558; 3.9667; 5.6649 90; 90; 90 | 127.091 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563431 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6561; 3.9667; 5.6654 90; 90; 90 | 127.109 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563453 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6547; 3.9543; 5.6759 90; 90; 90 | 126.915 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563454 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6541; 3.9622; 5.6713 90; 90; 90 | 127.052 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563455 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6539; 3.9639; 5.6705 90; 90; 90 | 127.084 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563456 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6534; 3.9656; 5.6698 90; 90; 90 | 127.112 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563457 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6531; 3.9662; 5.6693 90; 90; 90 | 127.113 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563458 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6531; 3.9667; 5.6682 90; 90; 90 | 127.105 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563459 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6531; 3.9673; 5.6686 90; 90; 90 | 127.133 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563460 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6531; 3.9678; 5.6681 90; 90; 90 | 127.138 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563461 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.6532; 3.9679; 5.6677 90; 90; 90 | 127.134 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 1563462 | CIF | K0.5 Na0.5 Nb O3 | B m m 2 | 5.653; 3.9682; 5.6679 90; 90; 90 | 127.144 | Ishizawa, Nobuo; Wang, Jun; Sakakura, Terutoshi; Inagaki, Yumi; Kakimoto, Ken-ichi Structural evolution of Na0.5K0.5NbO3 at high temperatures Journal of Solid State Chemistry, 2010, 183, 2731-2738 |
| 2310011 | CIF | K Nb O3 | B m m 2 | 5.697; 3.971; 5.72 90; 90; 90 | 129.402 | Katz, L.; Megaw, H. D. The structure of potassium niobate at room temperature: the solution of a pseudosymmetric structure by Fourier methods Acta Crystallographica, 1967, 22, 639 |
| 4131706 | CIF | C3 H18 I7 N5 Pb2 | B m m 2 | 6.3729; 12.5435; 31.376 90; 90; 90 | 2508.1 | Soe, Chan Myae Myae; Stoumpos, Constantinos C.; Kepenekian, Mikaël; Traoré, Boubacar; Tsai, Hsinhan; Nie, Wanyi; Wang, Binghao; Katan, Claudine; Seshadri, Ram; Mohite, Aditya D.; Even, Jacky; Marks, Tobin J.; Kanatzidis, Mercouri G. New Type of 2D Perovskites with Alternating Cations in the Interlayer Space, (C(NH<sub>2</sub>)<sub>3</sub>)(CH<sub>3</sub>NH<sub>3</sub>)<sub>n</sub>Pb<sub>n</sub>I<sub>3n+1</sub>: Structure, Properties, and Photovoltaic Performance. Journal of the American Chemical Society, 2017, 139, 16297-16309 |
| 2103827 | CIF Paper | C15 H28 N4 O4 | B m m b | 9.4157; 26.124; 7.2034 90; 90; 90 | 1771.9 | Bonin, Michel; Welberry, T. Richard; Hostettler, Marc; Gardon, Manuel; Birkedal, Henrik; Chapuis, Gervais; Möckli, Pedro; Ogle, Craig A.; Schenk, Kurt J. Urotropin azelate: a rather unwilling co-crystal Acta Crystallographica Section B, 2003, 59, 72-86 |
| 2103906 | CIF HKL Paper | C17 H32 N4 O4 | B m m b | 9.3593; 29.257; 7.2982 90; 90; 90 | 1998.4 | Pinheiro, Carlos Basílio; Gardon, Manuel; Chapuis, Gervais Structural changes of hexamethylenetetramine and undecanedioic acid co-crystal (HMT-C11) as a function of the temperature Acta Crystallographica Section B, 2003, 59, 416-427 |
| 2103931 | CIF HKL Paper | C13 H24 N4 O4 | B m m b | 9.3962; 22.981; 7.3338 90; 90; 90 | 1583.6 | Gardon, Manuel; Pinheiro, Carlos B.; Chapuis, Gervais Structural phases of hexamethylenetetramine‒pimelic acid (1/1): a unified description based on a stacking model Acta Crystallographica Section B, 2003, 59, 527-536 |
| 2310333 | CIF | F H | B m m b | 3.42; 4.32; 5.41 90; 90; 90 | 79.93 | Atoji, M.; Lipscomb, W.N. The crystal structure of hydrogen fluoride Acta Crystallographica (1,1948-23,1967), 1954, 7, 173-175 |
| 4031209 | CIF | C9 As2 Fe3 O9 | B m m b | 10.82; 10.96; 13.29 90; 90; 90 | 1576.02 | Delbaere, L.T.J.; Kruczynski, L.J.; McBride, D.W. X-Ray Structure Determination of a New Metal Cluster Complex: Di-mue3-arsino-tris(tricarbonyliron) (3 Fe - Fe) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1973, 1973, 307-310 |
| 4344137 | CIF | Cl2 O4 Pb3 Te | B m m b | 5.576; 5.559; 12.4929 90; 90; 90 | 387.242 | Porter, Y.; Halasyamani, P.S. Syntheses, structures and characterization of new lead(II) - tellurium(IV) - oxide halides : Pb3 Te2 O6 X2 and Pb3 Te O4 X2 (X = Cl or Br) Inorganic Chemistry, 2003, 42, 205-209 |
| 7245134 | CIF | C7 H8 Cs Fe N7 O | B m m b | 8.286; 9.0586; 18.0168 90; 90; 90 | 1352.33 | Li, Qi-Yao; Li, Mao-Fan; Chen, Xiao-Xian; Gong, Ya-Ping; Liu, De-Xuan; Xu, Wei-Jian; Zhang, Wei-Xiong Near-room-temperature dielectric switch and thermal expansion anomaly in a new hybrid crystal: (Me2NH2)[CsFe(CN)5(NO)] CrystEngComm, 2022 |
| 8104274 | CIF | H Na O | B m m b | 3.3994; 3.3994; 11.377 90; 90; 90 | 131.472 | Stehr, H. Neubestimmung der Kristallstrukturen des dimorphen Natriumhydroxids, NaOH, bei verschiedenen Temperaturen mit Röntgenstrahl- und Neutronenbeugung Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1967, 125, 332-359 |
| 9005039 | CIF | O26 P2 Pb2 U3 | B m m b | 16.031; 17.264; 13.605 90; 90; 90 | 3765.31 | Piret, P.; Piret-Meunier J; Deliens, M. Composition chimique et structure cristalline de la dewindtite Pb3[H(UO2)3O2(PO4)2]2.12H2O European Journal of Mineralogy, 1990, 2, 399-405 |
| 9005067 | CIF | Ca H26.34 O46 P4 U7 | B m m b | 15.835; 17.324; 13.724 90; 90; 90 | 3764.84 | Piret, P.; Piret-Meunier J Composition chimique et structure cristalline de la phosphuranylite Ca(UO2)[(UO2)3(OH)2(PO4)2]2.12H2O European Journal of Mineralogy, 1991, 3, 69-77 |
| 9007551 | CIF | Ni5.629 S4.86 | B m m b | 3.274; 16.157; 11.359 90; 90; 90 | 600.869 | Fleet, M. E. The crystal structure of alpha-Ni7S6 Acta Crystallographica, Section B, 1972, 28, 1237-1241 |
| 9008154 | CIF | Ge Li4 O4 | B m m b | 7.76; 6.05; 7.36 90; 90; 90 | 345.537 | Vollenkle, H.; Wittmann, A. Die kristallstruktur von Li4GeO4 Zeitschrift fur Kristallographie, 1969, 128, 66-71 |
| 9012425 | CIF | Bi Cl O2 Pb | B m m b | 5.627; 5.575; 12.425 90; 90; 90 | 389.779 | Gillberg, M. Perite, a new oxyhalide mineral from Langban, Sweden Arkiv for Mineralogi och Geologi, 1960, 2, 565-570 |
| 9016150 | CIF | Cl O2 Pb1.5 Te0.5 | B m m b | 5.5649; 5.5565; 12.475 90; 90; 90 | 385.744 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Marty, J.; Thorne, B. Lead-tellurium oxysalts from Otto Mountain near Baker, California: VI. Telluroperite, Pb3Te4+O4Cl2, the Te analog of perite and nadorite American Mineralogist, 2010, 95, 1569-1573 |
| 9017207 | CIF | Ca O4 S | B m m b | 6.992; 6.999; 6.24 90; 90; 90 | 305.367 | Hartman, P. On the unit cell dimensions and bond lengths of anhydrite Note: this is a re-indexed structure of Hawthorne and Ferguson (1975) European Journal of Mineralogy, 1989, 1, 721-722 |
| 9017279 | CIF | Ca O4 S | B m m b | 7.03276; 7.02381; 6.32712 90; 90; 90 | 312.539 | Xu, H.; Guo, X.; Bai, J. Thermal behavior of polyhalite: a high-temperature synchrotron XRD study Note: T = 648 K Physics and Chemistry of Minerals, 2017, 44, 125-135 |
| 9017297 | CIF | Ca O4 S | B m m b | 6.992; 6.999; 6.24 90; 90; 90 | 305.367 | Morikawa, H.; Tomita, T.; Minato, I.; Iwai, S. Anhydrite: a refinement Acta Crystallographica, Section B, 1975, 31, 2164-2165 |
| 2104270 | CIF HKL Paper | Pb S | Bmmm(0\b0)s00 | 13.737; 1.7496; 4.1448 90; 90; 90 | 99.617 | Elcoro, Luis; Perez-Mato, J. M.; Friese, Karen; Petříček, Václav; Balić-Žunić, Tonči; Olsen, Lars Arnskov Modular crystals as modulated structures: the case of the lillianite homologous series Acta Crystallographica Section B, 2008, 64, 684-701 |
| 1000376 | CIF | F24 Fe3 Pb8 | C -1 | 20.118; 5.597; 9.44 89.75; 105.79; 89.38 | 1022.7 | Pierrard, A; de Kozak, A; Gredin, P; Renaudin, J The crystal structure of Pb8 Fe(II) Fe(III)2 F24: an ordered fluorite- like compound Zeitschrift fuer Anorganische und Allgemeine Chemie, 1995, 621, 1053-1057 |
| 1008743 | CIF | Ca5 Ge3 O11 | C -1 | 10.855; 8.715; 10.998 90.6; 96.49; 90.17 | 1033.7 | Barbier, J; Levy, D Crystal structures of Ca5 Ge3 O11 and wollastonite-type Ga Ge O3 Zeitschrift fuer Kristallographie (149,1979-), 1997, 212, 519-528 |
| 1008757 | CIF | Al1.52 Ca0.52 Na0.48 O8 Si2.48 | C -1 | 8.176; 12.841; 14.207 93.53; 116.27; 89.77 | 1334.5 | Klein, S; Korekawa, M Die gemittelte Struktur des Labradorits Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-), 1976, 1976, 66-69 |
| 1508971 | CIF | C9 Ca9 O27 | C -1 | 12.17; 7.12; 25.32 90; 99.22; 90 | 2165.64 | Mugnaioli, E.; Andrusenko, I.; Schüler, T.; Loges, N.; Panthöfer, M.; Dinnebier, R. E.; Tremel, W.; Kolb, U. Ab Initio Structure Determination of Vaterite by Automated Electron Diffraction Angewandte Chemie International Edition, 2012, 51, 7041-7045 |
| 1509238 | CIF | Ag Al O8 Si3 | C -1 | 8.221; 12.968; 7.16 91.83; 116.8; 90.1 | 680.876 | Sternitzke, M.; Mueller, G.; Deubener, J. Feldspars M Al Si3 O8 (M=H,Li,Ag) synthesized by low-temperature ion exchange American Mineralogist, 1991, 76, 1620-1627 |
| 1517501 | CIF | C19 H24 Cl N O | C -1 | 26.96214; 12.68483; 21.88641 90.4219; 104.544; 89.797 | 7245.32 | Lang, Simon B.; Locascio, Theresa M.; Tunge, Jon A. Activation of alcohols with carbon dioxide: intermolecular allylation of weakly acidic pronucleophiles. Organic letters, 2014, 16, 4308-4311 |
| 1520928 | CIF | Li O12 P3 Zr2 | C -1 | 15.0718; 8.8556; 9.1234 89.661; 123.912; 90.429 | 1010.53 | Catti, M.; Stramare, S.; Ibberson, R. Lithium location in NASICON-type Li(+) conductors by neutron diffraction. I. Triclinic alpha'-Li Zr2 (P O4)3 Solid State Ionics, 1999, 123, 173-180 |
| 1521703 | CIF | Al K0.95 O8 Si3 | C -1 | 8.544; 12.998; 7.181 90; 116.16; 90 | 715.796 | Organova, N.I.; Zakharov, N.D.; Rozhdestvenskaya, I.V.; Ivanova, T.I.; Marsii, I.M.; Borisovskii, S.B.; Nasdekin, V.V. Structures of the K- and Na-components of two-phase feldspar from Primor'e Kristallografiya, 1999, 44, 829-834 |
| 1521764 | CIF | F24 Fe3 Pb8 | C -1 | 20.133; 5.6006; 9.4344 89.625; 105.583; 89.509 | 1024.61 | Pierrard, A.; Gredin, P.; Dupont, N.; de Kozak, A.; Bouree-Vigneron, F.; Rosenman, I.; Andre, G. Magnetic structure and properties of Pb8 Fe(II) Fe(III)2 F24 : a 1-D ferrimagnetic chain compound exhibiting a spin-flop transition Journal of Alloys Compd., 1999, 291, 44-51 |
| 1521883 | CIF | Al6.52 Ca3.54 H51.76 N2.24 Na0.78 O93.4 Si29.48 | C -1 | 17.668; 17.881; 7.413 90.26; 116.48; 89.61 | 2096.18 | Sani, A.; Ciambelli, P.; Vezzalini, G.; Rapacciuolo, M.T. Crystal structure of hydrated and partially (N H4)-exchanged heulandite Microporous and Mesoporous Materials, 1999, 31, 263-270 |
| 1522171 | CIF | La5 Mn O16 Re3 | C -1 | 7.9885; 8.0322; 10.2413 90.2; 95.16; 89.92 | 654.468 | Wiebe, C.R.; Gourrier, A.; Langet, T.; Britten, J.F.; Greedan, J.E. Synthesis, structure, and magnetic behavior of La5 Re3 Mn O16: a new perovskite-like material Journal of Solid State Chemistry, 2000, 151, 31-39 |
| 1524339 | CIF | Al0.13 Be4 Ca2 Fe0.42 H16 Mn4.12 O34 P6 | C -1 | 15.921; 11.965; 6.741 91.07; 94.35; 89.99 | 1280.2 | Fanfani, L.; Zanazzi, P.F.; Zanzari, A.R. The crystal structure of a triclinic roscherite Tschermaks Mineralogische und Petrographische Mitteilungen (-1978), 1977, 24, 169-178 |
| 1527004 | CIF | Al K O8 Si3 | C -1 | 8.615; 13.03; 7.2 89.99; 116.01; 89.98 | 726.366 | Yamnova, N.A.; Khomyakov, A.P.; Zlykhenskaya, I.V. Refinement of the crystal structure of sanidine-like feldspar Kristallografiya, 2000, 45, 824-829 |
| 1529639 | CIF | Al K O8 Si3 | C -1 | 8.5732; 12.9668; 7.2227 90.658; 115.917; 87.626 | 721.535 | Blasi, A.; Brajkovic, A.; Martin, R.F.; Foord, E.E.; de Pol Blasi, C.; Zanazzi, P.F. Structure refinement and genetic aspects of a microcline overgrowth on amazonite from Pikes Peak batholith Colorado,U.S.A. Bulletin de Mineralogie (101,1978-), 1984, 107, 411-422 |
| 1529935 | CIF | Mg0.49 Mn0.51 O3 Si | C -1 | 9.585; 10.3589; 17.247 112.335; 102.797; 83.097 | 1543.41 | Finger, L.W.; Hazen, R.M. Refined occupancy factors for synthetic Mn-Mg pyroxmangite and rhodonite Carnegie Institution of Washington: Yearbook, 1978, 77, 850-853 |
| 1529936 | CIF | Mg0.38 Mn0.62 O3 Si | C -1 | 9.649; 10.389; 12.108 108.65; 102.32; 82.95 | 1121.58 | Finger, L.W.; Hazen, R.M. Refined occupancy factors for synthetic Mn-Mg pyroxmangite and rhodonite Carnegie Institution of Washington: Yearbook, 1978, 77, 850-853 |
| 1530328 | CIF | Al4 O22 Si8 | C -1 | 5.2; 9.15; 9.45 92; 98.83; 89.03 | 444.001 | MacKenzie, K.J.D.; Brown, I.W.M.; Meinhold, R.H.; Bowden, M.E. Thermal reactions of pyrophyllite studied by high-resolution solid-state 27Al and 29Si nuclear magnetic resonance spectroscopy Journal of the American Ceramic Society, 1985, 68, 266-272 |
| 1530405 | CIF | Al K0.5 Na0.5 O8 Si3 | C -1 | 8.529; 12.945; 7.189 90.36; 115.99; 88.8 | 713.294 | Mergoil-Daniel, J.; Chevalier, R. Les feldspars potassiques partiellement ordonnes: Structure cristallographique et signification geologique Bulletin de Mineralogie (101,1978-), 1984, 107, 401-410 |
| 1530587 | CIF | Mg0.032 Mn0.97 O3 Si | C -1 | 9.754; 10.617; 17.506 111.99; 102.56; 82.97 | 1639.09 | Pinckney, L.R.; Burnham, C.W. High-temperature crystal structure of pyroxomangite American Mineralogist, 1988, 73, 809-817 |
| 1531148 | CIF | La5 Mg O16 Re3 | C -1 | 7.9359; 7.9963; 10.1683 90.196; 94.878; 89.966 | 642.917 | Chi Lisheng; Green, A.E.C.; Wiebe, C.R.; Hammond, R.; Greedan, J.E. Synthesis, structure and magnetic properties of the pillared perovskites La5 Re3 M O16 (M = Mg, Fe, Co, Ni) Journal of Solid State Chemistry, 2003, 170, 165-175 |
| 1531151 | CIF | Fe La5 O16 Re3 | C -1 | 7.9553; 7.996; 10.1895 90.27; 95.082; 90.001 | 645.605 | Chi Lisheng; Greedan, J.E.; Green, A.E.C.; Wiebe, C.R.; Hammond, R. Synthesis, structure and magnetic properties of the pillared perovskites La5 Re3 M O16 (M = Mg, Fe, Co, Ni) Journal of Solid State Chemistry, 2003, 170, 165-175 |
| 1531154 | CIF | Co La5 O16 Re3 | C -1 | 7.9694; 8.0071; 10.182 90.248; 94.98; 89.983 | 647.273 | Chi Lisheng; Green, A.E.C.; Hammond, R.; Wiebe, C.R.; Greedan, J.E. Synthesis, structure and magnetic properties of the pillared perovskites La5 Re3 M O16 (M = Mg, Fe, Co, Ni) Journal of Solid State Chemistry, 2003, 170, 165-175 |
| 1531156 | CIF | La5 Ni O16 Re3 | C -1 | 7.9383; 7.9983; 10.1732 90.287; 94.864; 89.968 | 643.592 | Chi Lisheng; Green, A.E.C.; Greedan, J.E.; Wiebe, C.R.; Hammond, R. Synthesis, structure and magnetic properties of the pillared perovskites La5 Re3 M O16 (M = Mg, Fe, Co, Ni) Journal of Solid State Chemistry, 2003, 170, 165-175 |
| 1531389 | CIF | La5 Mn O16 Re3 | C -1 | 7.966; 8.0084; 10.2095 90.185; 95.193; 89.933 | 648.637 | Green, A.E.C.; Wiebe, C.R.; Greedan, J.E. Magnetism and the magnetic structure of the pillared perovskite, La5 Re3 Mn O16 Solid State Sciences, 2002, 4, 305-310 |
| 1531396 | CIF | Al F0.77 H0.23 Li O4.23 P | C -1 | 6.678; 7.717; 6.931 90.59; 117.65; 91.08 | 316.263 | Groat, L.A.; Chakoumakos, B.C.; Brouwer, D.H.; Hoffman, C.M.; Schultz, A.J.; Fyfe, C.A.; Morell, H. The amblygonite (Li Al P O4 F) - montebrasite (Li Al P O4 (O H)) solid solution: a combined powder and single-crystal neutron diffraction and solid-state (6)Li MAS, CP MAS and REDOR NMR study American Mineralogist, 2003, 88, 195-210 |
| 1532985 | CIF | Al Ca2 F8 H O Pb | C -1 | 7.722; 7.516; 12.206 98.86; 96.91; 90 | 694.757 | Kampf, A.R.; Merlino, S.; Pasero, M. Order-disorder approach to calcioaravaipaite, (Pb Ca2 Al (F, O H)9) : the crystal structure of the triclinic MDO polytype American Mineralogist, 2003, 88, 430-435 |
| 1537181 | CIF | Ni O11 P4 | C -1 | 12.753; 12.957; 10.581 89.42; 116.96; 90.2 | 1558.32 | Funke, M.; Blum, M.; Glaum, R.; ElBali, B. Darstellung, Kristallstruktur und spektroskopische Charakterisierung von Ni P4 O11 und Ca Ni P2 O7 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 1040-1047 |
| 1540180 | CIF | Al0.92 Ca4.34 F0.96 H2.96 K0.68 Na3.93 O39.96 Si15.36 | C -1 | 9.65; 16.706; 13.153 93.42; 114.92; 90 | 1918.85 | Joswig, W.; Drits, V.A.; Sokolova, G.V. Refinement of structure of fedorite Kristallografiya, 1988, 33, 1284-1286 |
| 1540818 | CIF | C2 Ca | C -1 | 8.42; 11.84; 3.94 93.4; 92.5; 89.9 | 391.725 | Vannerberg, N. The crystal structure of calcium carbide II and IV Acta Chemica Scandinavica (1-27,1973-42,1988), 1962, 16, 1212-1220 |
| 1541658 | CIF | H4 K4 O18 S4 Th | C -1 | 10.096; 16.752; 9.762 95.15; 95.22; 91 | 1637 | Arutyunyan, E.G.; Porai-Koshits, M.A.; Molodkin, A.K. Structure of crystals of K4 (Th (S O4)4 (H2 O)2) Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 1966, 7, 733-737 |
| 1544902 | CIF | Al6.33 Ca1.16 H20.1 K1.68 Mg0.25 Na1.8 O92.1 Si29.81 | C -1 | 17.698; 17.511; 7.392 90.21; 116.76; 90.19 | 2045 | Kudoh, Y.; Takeuchi, Y. Thermal stability of clinoptilolite: the crystal structure at 350C Mineralogical Journal, 1983, 11, 392-406 |
| 1556998 | CIF | Al Ca0.01 K0.01 Na1.01 O8 Si2.98 | C -1 | 8.133; 12.81; 7.171 94.1; 116.59; 87.79 | 666.4 | Balic-Zunic, T.; Piazolo, S.; Katerinopoulou, A.; Schmith, J.H. Full analysis of feldspar texture and crystal structure by combining X-ray and electron techniques : albite sample 16 American Mineralogist, 2013, 98, 41-52 |
| 1556999 | CIF | Al0.99 Fe0.01 K0.01 Na1.02 O8 Si2.99 | C -1 | 8.166; 12.845; 7.188 94.24; 116.59; 87.715 | 672.4 | Balic-Zunic, T.; Piazolo, S.; Katerinopoulou, A.; Schmith, J.H. Full analysis of feldspar texture and crystal structure by combining X-ray and electron techniques : albite sample 45 American Mineralogist, 2013, 98, 41-52 |
| 1557000 | CIF | Al K0.86 Na0.17 O8 Si2.99 | C -1 | 8.598; 12.97; 7.2 90.029; 116.137; 89.498 | 720.8 | Balic-Zunic, T.; Piazolo, S.; Katerinopoulou, A.; Schmith, J.H. Full analysis of feldspar texture and crystal structure by combining X-ray and electron techniques : K-feldspar sample 16 American Mineralogist, 2013, 98, 41-52 |
| 1557001 | CIF | Al0.99 K Na0.04 O8 Si3 | C -1 | 8.585; 12.979; 7.2282 90.512; 115.914; 87.711 | 723.8 | Balic-Zunic, T.; Piazolo, S.; Katerinopoulou, A.; Schmith, J.H. Full analysis of feldspar texture and crystal structure by combining X-ray and electron techniques : K-feldspar sample 45 American Mineralogist, 2013, 98, 41-52 |
| 1557942 | CIF | Al2 Ca O8 Si2 | C -1 | 8.152; 12.917; 7.126 93.26; 116.37; 88.72 | 671.2 | Wadoski-Romeijn, E.; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure American Mineralogist, 2013, 98, 1988-1997 |
| 1559961 | CIF | C7 H4 N Na O4.875 S | C -1 | 18.5729; 7.0819; 29.0233 89.9808; 93.511; 89.9763 | 3810.31 | Rekis, Toms; Schaller, Achim M.; Kotla, Surya Rohith; Schönleber, Andreas; Noohinejad, Leila; Tolkiehn, Martin; Paulmann, Carsten; van Smaalen, Sander Single-crystal-to-single-crystal phase transitions of commensurately modulated sodium saccharinate 1.875-hydrate IUCrJ, 2021, 8, 139-147 |
| 2000489 | CIF Paper | H13 N3 O8 Se2 | C -1 | 15.81; 6.052; 10.482 90.79; 102.31; 89.13 | 979.7 | Pietraszko, A.; Łukaszewicz, K.; Augustyniak, M. A. Structure of phase III of (NH~4~)~3~H(SeO~4~)~2~ Acta Crystallographica Section C, 1992, 48, 2069-2071 |
| 2002939 | CIF Paper | C8 H2 Br2 O3 | C -1 | 12.923; 9.209; 7.628 105.08; 99.2; 81.29 | 859.5 | Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z. Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide Acta Crystallographica Section B, 1999, 55, 530-542 |
| 2012680 | CIF HKL Paper | C3 H6 As N | C -1 | 10.738; 6.253; 7.875 98.3; 108.39; 90.68 | 495.6 | Britton, Doyle; Young Jr, Victor G.; Schlemper, Elmer O. Intermolecular interactions in cyanodimethylarsine and cyanodimethylstibine Acta Crystallographica Section C, 2002, 58, m307-m309 |
| 2014635 | CIF HKL Paper | C13 H9 N O | C -1 | 12.936; 33.696; 10.604 90.35; 120.67; 89.6 | 3975.5 | Britton, Doyle 4'-Hydroxybiphenyl-4-carbonitrile Acta Crystallographica Section C, 2005, 61, o35-o37 |
| 2100160 | CIF Paper | C12 H24 Cl Mn N6 O6 | C -1 | 30.5936; 18.8967; 12.8288 90.18; 111.561; 90.083 | 6897.5 | A. David Rae; Susanne Mossin; Henning O. Sørensen Structure refinement of a twinned pseudo-symmetric crystal of [Mn(C~10~H~24~N~4~)(NCO)~2~]^+^·ClO_4^- Acta Crystallographica Section B, 2005, 61, 407-417 |
| 2100612 | CIF Paper | Cu0.299 Pb0.951 S3.357 Sb0.406 Sn0.851 | C -1 | 3.6733; 6.312; 11.9039 92.484; 90.687; 89.941 | 275.72 | M. Evain; V. Petricek; Y. Moëlo; C. Maurel First (3+2)-dimensional superspace approach to the structure of levyclaudite-(Sb), a member of the cylindrite-type minerals Acta Crystallographica Section B, 2006, 62, 775-789 |
| 2100627 | CIF Paper | H8 O16 P4 Tl4 | C -1 | 28.483; 9.016; 6.502 90.09; 92.21; 90.49 | 1668.4 | Oh, I.H.; Merz, M.; Mattauch, S.; Heger, G. Structural phase transition and hydrogen ordering of TlH~2~PO~4~ at low temperature Acta Crystallographica, Section B, 2006, 62, 719-728 |
| 2104244 | CIF HKL Paper | C10 H24 N2 Ni O13 | C -1 | 14.719; 28.041; 10.704 90.2; 125.99; 89.87 | 3574.6 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ Acta Crystallographica Section B, 2008, 64, 738-749 |
| 2104245 | CIF HKL Paper | C10 H24 Cu N2 O13 | C -1 | 14.769; 27.924; 10.642 89.91; 125.88; 90.06 | 3556.1 | Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ Acta Crystallographica Section B, 2008, 64, 738-749 |
| 2105062 | CIF Paper | C24 H48 B2 F8 Fe N24 | C -1 | 16.1235; 16.045; 16.3134 83.583; 96.87; 95.663 | 4148.2 | Kusz, Joachim; Zubko, Maciej; Neder, Reinhard B.; Gütlich, Phillipp Structural phase transition to disorder low-temperature phase in [Fe(ptz)~6~](BF~4~)~2~ spin-crossover compounds Acta Crystallographica Section B, 2012, 68, 40-56 |
| 2105063 | CIF Paper | C24 H48 B2 F8 Fe N24 | C -1 | 16.3473; 16.3475; 16.3475 81.815; 98.175; 98.18 | 4246.89 | Kusz, Joachim; Zubko, Maciej; Neder, Reinhard B.; Gütlich, Phillipp Structural phase transition to disorder low-temperature phase in [Fe(ptz)~6~](BF~4~)~2~ spin-crossover compounds Acta Crystallographica Section B, 2012, 68, 40-56 |
| 2107372 | CIF | Al Na O8 Si3 | C -1 | 8.138; 12.789; 7.156 94.33; 116.57; 87.65 | 664.194 | Ribbe, P.H.; Megaw, H.D.; Ferguson, R.B.; Taylor, W.H.; Traill, R.J. The albite structures Acta Crystallographica B (24,1968-38,1982), 1969, 25, 1503-1518 |
| 2242212 | CIF HKL Paper | C H O3 Rb | C -1 | 14.945; 5.8212; 3.9699 89.343; 104.096; 92.748 | 334.59 | Larvor, Carla; Stöger, Berthold The phase transition of rubidium hydrogen carbonate, RbHCO~3~ Acta Crystallographica Section E, 2017, 73, 975-979 |
| 2300034 | CIF | Fe2 O7 P2 | C -1 | 6.643; 8.447; 4.495 90.43; 103.8; 92.49 | 244.7 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2310531 | CIF | Al K O8 Si3 | C -1 | 8.56; 12.964; 7.215 90.65; 115.83; 87.7 | 720.071 | Brown, B.E.; Bailey, Y.W. The structure of maximum microcline Acta Crystallographica (1,1948-23,1967), 1964, 17, 1391-1400 |
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