Crystallography Open Database
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Searching space group like 'I 4/m c m'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2107224 | CIF | Cl5 Co Cs3 | I 4/m c m | 9.123; 9.123; 14.499 90; 90; 90 | 1206.74 | Figgis, B.N.; Kucharski, E.S.; Reynolds, P.A. Electron density distribution in Cs3 Co Cl5 Acta Crystallographica B (39,1983-), 1989, 45, 232-240 |
| 2207460 | CIF HKL Paper | Mn Sn2 | I 4/m c m | 6.6438; 6.6438; 5.4206 90; 90; 90 | 239.27 | Yongkwan Dong; Francis J. DiSalvo Reinvestigation of MnSn~2~ Acta Crystallographica Section E, 2005, 61, i282-i284 |
| 2210462 | CIF HKL Paper | C14 H8 O4 | I 4/m c m | 13.64; 13.64; 6.678 90; 90; 90 | 1242.4 | dRuyck, Jérôme de; Preat, Julien; Perpète, Eric A.; Jacquemin, Denis; Wouters, Johan 2,6-Dihydroxyanthraquinone: an isomer of the well known alizarin dye Acta Crystallographica Section E, 2006, 62, o4503-o4505 |
| 2213127 | CIF HKL Paper | Cl5 Cs3 Zn | I 4/m c m | 9.2421; 9.2421; 14.4928 90; 90; 90 | 1237.9 | Fejfarova, Karla; Ouarsal, Rachid; El Bali, Brahim; Dušek, Michal; Lachkar, Mohammed Tricaesium tetrachloridozincate(II) chloride Acta Crystallographica Section E, 2007, 63, i136-i137 |
| 2218078 | CIF HKL Paper | C24 H48 Cd4 N4 O24 | I 4/m c m | 16.7103; 16.7103; 7.3533 90; 90; 90 | 2053.29 | Fun, Hoong-Kun; Chantrapromma, Suchada; Marandi, Farzin μ-Pyrazine-bis[tetraaquacadmium(II)] μ-pyrazine-bis[tetraacetatocadmium(II)] Acta Crystallographica Section E, 2008, 64, m736-m737 |
| 2225931 | CIF HKL Paper | In3.84 La21 Ru10.16 | I 4/m c m | 12.1298; 12.1298; 25.982 90; 90; 90 | 3822.78 | Tursina, Anna I.; Cherviakov, Sergei G.; Noël, Henri; Chernyshev, Vladimir V.; Seropegin, Yuri D. Lanthanum ruthenium indide, La~21~Ru~9+<i>x~</i>In~5-<i>x~</i> (<i>x</i> = 1.2) Acta Crystallographica Section E, 2010, 66, i40 |
| 2232444 | CIF HKL Paper | La5 Sn Zn2 | I 4/m c m | 8.3277; 8.3277; 14.334 90; 90; 90 | 994.1 | Oshchapovsky, Igor; Pavlyuk, Volodymyr; Dmytriv, Grygoriy; Chumak, Igor; Ehrenberg, Helmut La~5~Zn~2~Sn Acta Crystallographica Section E, 2011, 67, i65 |
| 2239099 | CIF HKL | La5 Pb2.606 Zn0.394 | I 4/m c m | 12.763; 12.763; 6.368 90; 90; 90 | 1037.3 | Oshchapovsky, Igor; Pavlyuk, Volodymyr; Dmytriv, Grygoriy; Harbrecht, Bernd Pentalanthanum zinc diplumbide, La~5~Zn~1{-~<i>x</i>}Pb~2+<i>x~</i> (<i>x</i> ≃0.6) Acta Crystallographica Section E, 2014, 70, i2-i3 |
| 2243970 | CIF HKL Paper | Pb2 Rh0.95 | I 4/m c m | 6.7068; 6.7068; 5.8623 90; 90; 90 | 263.69 | Mochiku, Takashi; Matsushita, Yoshitaka; Subotić, Nikola; Kashiwagi, Takanari; Kadowaki, Kazuo Redetermination of the crystal structure of RhPb~2~ from single-crystal X-ray diffraction data, revealing a rhodium deficiency Acta Crystallographica Section E, 2021, 77, 1327-1329 |
| 2310165 | CIF | Ni U6 | I 4/m c m | 10.37; 10.37; 5.21 90; 90; 90 | 560.267 | Baenziger, N.C.; Wilson, A.S.; Snow, A.I.; Rundle, R.E. Compounds of uranium with the transition metals of the first long period Acta Crystallographica (1,1948-23,1967), 1950, 3, 34-40 |
| 2310191 | CIF | Pd Th2 | I 4/m c m | 7.33; 7.33; 5.93 90; 90; 90 | 318.612 | Ferro, R.; Capelli, R. The phase C16 type in the thorium-palladium alloy system Acta Crystallographica (1,1948-23,1967), 1964, 17, 64-65 |
| 2310220 | CIF | Ni Zr2 | I 4/m c m | 6.477; 6.477; 5.241 90; 90; 90 | 219.868 | Kirkpatrick, M.E.; Smith, J.F.; Bailey, D.M. The structures of Ni Zr2, Ni Zr and their hafnium analogs Acta Crystallographica (1,1948-23,1967), 1962, 15, 252-255 |
| 2310304 | CIF | Ce Co3 Pu4 | I 4/m c m | 10.73; 10.73; 5.383 90; 90; 90 | 619.76 | Larson, A.C.; Roof, R.B.jr.; Cromer, D.T. The crystal structure of phase C in the ternary system Ce-Pu-Co Acta Crystallographica (1,1948-23,1967), 1964, 17, 1382-1386 |
| 2310495 | CIF | K N3 | I 4/m c m | 6.1188; 6.1188; 7.1015 90; 90; 90 | 265.878 | Stevens, E.D. Experimental charge density distribution in potassium azide by diffraction methods Acta Crystallographica A (24,1968-38,1982), 1977, 33, 580-584 |
| 2310551 | CIF | Pu5 Si3 | I 4/m c m | 11.409; 11.409; 5.448 90; 90; 90 | 709.14 | Cromer, D.T.; Larson, A.C.; Roof, R.B.jr. The Crystal Structure of Pu5 Si3 Acta Crystallographica (1,1948-23,1967), 1964, 17, 947-950 |
| 2310578 | CIF | Cl5 Co Cs3 | I 4/m c m | 9.219; 9.219; 14.554 90; 90; 90 | 1236.94 | Figgis, B.N.; Gerloch, M.; Mason, R. A least-squares refinement of the crystal structure of tricesium pentachlorocobalt(II), Cs3 Co Cl5 Acta Crystallographica (1,1948-23,1967), 1964, 17, 506-507 |
| 2310667 | CIF | Br F4 K | I 4/m c m | 6.174; 6.174; 11.103 90; 90; 90 | 423.227 | Siegel, S. The crystal structure of K Br F4 Acta Crystallographica (1,1948-23,1967), 1956, 9, 493-495 |
| 2310687 | CIF | O3 Sr Ti | I 4/m c m | 5.511; 5.511; 7.796 90; 90; 90 | 236.773 | Tsuda, K.; Tanaka, M. Refinement of crystal structure parameters using convergent-beam electron diffraction: the low-temperature phase of SrTiO~3~ Acta Crystallographica Section A, 1995, 51, 7-19 |
| 2310931 | CIF | Si Zr2 | I 4/m c m | 6.612; 6.612; 5.2943 90; 90; 90 | 231.459 | Pietrokowsky, P. The intermediate phase Zr2 Si Acta Crystallographica (1,1948-23,1967), 1954, 7, 435-438 |
| 2311002 | CIF | Th2 Zn | I 4/m c m | 7.6; 7.6; 5.64 90; 90; 90 | 325.766 | Baenziger, N.C.; Snow, A.I.; Rundle, R.E. Structures of the compounds Th2 Cu, Th Cu2, Th2 Zn and Th Hg3 Acta Crystallographica (1,1948-23,1967), 1956, 9, 93-94 |
| 2312361 | CIF HKL Paper | Al2.83 Ru Si2.17 | I 4/m c m | 6.20079; 6.20079; 9.6937 90; 90; 90 | 372.721 | Kitahara, Koichi; Takakura, Hiroyuki; Iwasaki, Yutaka; Kimura, Kaoru Crystal structures of five compounds in the aluminium-ruthenium-silicon system. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 946-951 |
| 3000563 | On hold until 2025-02-16 | C4 Ca0.25 Dy0.5 Fe1.5 K0.5 Mg0.5 O35 Si8 Y3.5 | I 4/m c m | 17.53637; 17.53637; 9.55702 90; 90; 90 | 2939.02 | Daisuke Nishio-Hamane; Koichi Momma; Norimasa Shimobayashi; Masayuki Ohnishi; Toshinori Kobayashi Miyawakiite-(Y), Y4Fe2(Si8O20)(CO3)4(H2O)3, a new mineral from Suishoyama, Kawamata Town, Fukushima Prefecture, Japan To be published |
| 4000883 | CIF | Al0.6 Ca1.2 Ce0.0225 F0.5775 O4.4225 Si0.4 Sr1.7775 | I 4/m c m | 6.66027; 6.66027; 10.82919 90; 90; 90 | 480.374 | Setlur, Anant A.; Radkov, Emil V.; Henderson, Claire S.; Her, Jae-Hyuk; Srivastava, Alok M.; Karkada, Nagaveni; Kishore, M. Satya; Kumar, N. Prasanth; Aesram, Danny; Deshpande, Anirudha; Kolodin, Boris; Grigorov, Ljudmil S.; Happek, Uwe Energy-Efficient, High-Color-Rendering LED Lamps Using Oxyfluoride and Fluoride Phosphors Chemistry of Materials, 2010, 22, 4076 |
| 4001729 | CIF | Ag5 Cl Te2 | I 4/m c m | 9.7783; 9.7783; 7.8658 90; 90; 90 | 752.09 | Nilges, T.; Doert, T.; Pfitzner, A.; Boettcher, P.; Nilsen, S. Structure-property relations and diffusion pathways of the silver ion conductor Ag5 Te2 Cl Chemistry of Materials (1,1989-), 2004, 16, 806-812 |
| 4002213 | CIF | Hf5 Ru0.46 Sb2.54 | I 4/m c m | 10.8754; 10.8754; 5.6042 90; 90; 90 | 662.83 | Xie, Weiwei; Luo, Huixia; Seibel, Elizabeth M.; Nielsen, Morten B.; Cava, Robert J. Superconductivity in Hf5Sb3‒xRux: Are Ru and Sb a Critical Charge-Transfer Pair for Superconductivity? Chemistry of Materials, 2015, 27, 4511 |
| 4002355 | CIF | Fe0.9 Sb5.1 Zr10 | I 4/m c m | 11.066; 11.066; 5.535 90; 90; 90 | 677.796 | Kwon Young-Uk; Sevov, S.C.; Corbett, J.D. Substituted W5 Si3- and Zr6 Al2 Co-phases formed in the zirconium-antimony and zirconium-tin systems with iron group metals Chemistry of Materials (1,1989-), 1990, 2, 550-556 |
| 4002426 | CIF | La0.567 Li0.3 O3 Ti | I 4/m c m | 5.48027; 5.48027; 7.75591 90; 90; 90 | 232.936 | Sommariva, M.; Catti, M. Neutron diffraction study of quenched Li0.3 La0.567 Ti O3 lithium ion conducting perovskite Chemistry of Materials (1,1989-), 2006, 18, 2411-2417 |
| 4002464 | CIF | N O2 Sr Ta | I 4/m c m | 5.69411; 5.69411; 8.0658 90; 90; 90 | 261.517 | Clarke, S.J.; Hardstone, K.A.; Rosseinsky, M.J.; Michie, C.W. High-temperature synthesis and structures of perovskite and n = 1 Ruddlesden-Popper tantalum oxynitrides Chemistry of Materials (1,1989-), 2002, 14, 2664-2669 |
| 4002916 | CIF | Bi2 Mn | I 4/m c m | 6.83148; 6.83148; 5.6572 90; 90; 90 | 264.017 | Walsh, James P. S.; Clarke, Samantha M.; Puggioni, Danilo; Tamerius, Alexandra D.; Meng, Yue; Rondinelli, James M.; Jacobsen, Steven D.; Freedman, Danna E. MnBi2: A Metastable High-Pressure Phase in the Mn‒Bi System Chemistry of Materials, 2019, 31, 3083 |
| 4003353 | CIF | C4.25 H6 N0.75 O1.5 Zn0.25 | I 4/m c m | 15.0812; 15.0812; 19.2621 90; 90; 90 | 4381 | Lee, Hui-Chun; Hwang, Jongkook; Schilde, Uwe; Antonietti, Markus; Matyjaszewski, Krzysztof; Schmidt, Bernhard V. K. J. Toward Ultimate Control of Radical Polymerization: Functionalized Metal‒Organic Frameworks as a Robust Environment for Metal-Catalyzed Polymerizations Chemistry of Materials, 2018, 30, 2983 |
| 4003606 | CIF | C132 H108 Cl6 O40 Zr12 | I 4/m c m | 36.739; 36.739; 73.888 90; 90; 90 | 99731 | Gosselin, Eric J.; Decker, Gerald E.; McNichols, Brett W.; Baumann, James E.; Yap, Glenn P. A.; Sellinger, Alan; Bloch, Eric D. Ligand-Based Phase Control in Porous Zirconium Coordination Cages Chemistry of Materials, 2020 |
| 4027806 | CIF | Ag F4 K | I 4/m c m | 5.847; 5.847; 11.553 90; 90; 90 | 394.967 | Hoppe, R.; Bachmann, B.; Mueller, B.G.; Milicev, S.; Zemva, B.; Lutar, K. Potassium tetrafluoroargentate(III): preparation, crystal structureand vibrational spectra European Journal of Solid State Inorganic Chemistry, 1991, 28, 1335-1346 |
| 4030434 | CIF | F12 H I2 K | I 4/m c m | 9.706; 9.706; 10.548 90; 90; 90 | 993.7 | Mahjoub, A.R.; Leopold, D.; Seppelt, K. Iodine pentafluoride-hydrogen fluoride co-crystallisates, directed weak interactions European Journal of Solid State and Inorganic Chemistry, 1992, 29, 635-647 |
| 4030528 | CIF | Cd Cu F4 | I 4/m c m | 5.328; 5.328; 10.32 90; 90; 90 | 292.96 | Gredin, P.; de Kozak, A.; Chassaing, J.; Quarton, M. The binary system CuF2-CdF2. Structural, spectroscopic and magnetic studies on CdCuF4 European Journal of Solid State and Inorganic Chemistry, 1993, 30, 789-800 |
| 4030702 | CIF | F3 K Mn | I 4/m c m | 5.817; 5.817; 8.256 90; 90; 90 | 279.36 | Asbrink, S; Waskowska, A High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa European Journal of Solid State Inorganic Chemistry, 1994, 31, 747-755 |
| 4030703 | CIF | F3 K Mn | I 4/m c m | 5.784; 5.784; 8.236 90; 90; 90 | 275.53 | Asbrink, S; Waskowska, A High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa European Journal of Solid State Inorganic Chemistry, 1994, 31, 747-755 |
| 4030704 | CIF | F3 K Mn | I 4/m c m | 5.742; 5.742; 8.223 90; 90; 90 | 271.12 | Asbrink, S; Waskowska, A High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa European Journal of Solid State Inorganic Chemistry, 1994, 31, 747-755 |
| 4105033 | CIF | As F10 H3 O Xe2 | I 4/m c m | 8.715; 8.715; 12.989 90; 90; 90 | 986.5 | Michael Gerken; Matthew D. Moran; Hélène P. A. Mercier; Bernard E. Pointner; Gary J. Schrobilgen; Berthold Hoge; Karl O. Christe; Jerry A. Boatz On the XeF+/H2O System: Synthesis and Characterization of the Xenon(II) Oxide Fluoride Cation, FXeOXeFXeF+ Journal of the American Chemical Society, 2009, 131, 13474-13489 |
| 4107485 | CIF | C26 H20 Fe N6 O4 S2 | I 4/m c m | 14.796; 14.796; 17.399 90; 90; 90 | 3809 | Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Peter D. Southon; John D. Cashion; Jean-François Létard; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert Single-Crystal to Single-Crystal Structural Transformation and Photomagnetic Properties of a Porous Iron(II) Spin-Crossover Framework Journal of the American Chemical Society, 2008, 130, 2869-2876 |
| 4110908 | CIF | Au4 In2 K | I 4/m c m | 8.6675; 8.6675; 8.3684 90; 90; 90 | 628.68 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4110909 | CIF | Au4 In2 Rb | I 4/m c m | 8.8349; 8.8349; 8.2736 90; 90; 90 | 645.8 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4110910 | CIF | Au4 In2 K0.65 Rb0.35 | I 4/m c m | 8.7852; 8.7852; 8.3259 90; 90; 90 | 642.59 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4110911 | CIF | Au4 In2 K0.87 Rb0.13 | I 4/m c m | 8.7032; 8.7032; 8.337 90; 90; 90 | 631.49 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4111268 | CIF | C34 H24 N6 Zn | I 4/m c m | 12.384; 12.384; 22.765 90; 90; 90 | 3491.3 | Satoru Shimomura; Ryotaro Matsuda; Takashi Tsujino; Takashi Kawamura; Susumu Kitagawa TCNQ Dianion-Based Coordination Polymer Whose Open Framework Shows Charge-Transfer Type Guest Inclusion Journal of the American Chemical Society, 2006, 128, 16416-16417 |
| 4124105 | CIF | Cr F3 K | I 4/m c m | 6.0523; 6.0523; 8.02196 90; 90; 90 | 293.847 | Margadonna, S.; Karotsis, G. Cooperative Jahn-Teller distortion, phase transitions, and weak ferromagnetism in the K Cr F3 perovskite Journal of the American Chemical Society, 2006, 128, 16435-16437 |
| 4124388 | CIF | C H6 I3 N Pb | I 4/m c m | 8.8392; 8.8392; 12.6948 90; 90; 90 | 991.86 | Yamada, Yasuhiro; Yamada, Takumi; Phuong, Le Quang; Maruyama, Naoki; Nishimura, Hidetaka; Wakamiya, Atsushi; Murata, Yasujiro; Kanemitsu, Yoshihiko Dynamic Optical Properties of CH3NH3PbI3 Single Crystals As Revealed by One- and Two-Photon Excited Photoluminescence Measurements. Journal of the American Chemical Society, 2015, 150814091520002 |
| 4130624 | CIF | C8.84 H8 F5 N4 Nb Ni O2.68 | I 4/m c m | 9.903; 9.903; 15.72 90; 90; 90 | 1541.7 | Bhatt, Prashant M.; Belmabkhout, Youssef; Cadiau, Amandine; Adil, Karim; Shekhah, Osama; Shkurenko, Aleksander; Barbour, Leonard J.; Eddaoudi, Mohamed A Fine-Tuned Fluorinated MOF Addresses the Needs for Trace CO2 Removal and Air Capture Using Physisorption. Journal of the American Chemical Society, 2016, 138, 9301-9307 |
| 4130625 | CIF | C8 H12 F5 N4 Nb Ni O3 | I 4/m c m | 9.943; 9.943; 15.764 90; 90; 90 | 1558.5 | Bhatt, Prashant M.; Belmabkhout, Youssef; Cadiau, Amandine; Adil, Karim; Shekhah, Osama; Shkurenko, Aleksander; Barbour, Leonard J.; Eddaoudi, Mohamed A Fine-Tuned Fluorinated MOF Addresses the Needs for Trace CO2 Removal and Air Capture Using Physisorption. Journal of the American Chemical Society, 2016, 138, 9301-9307 |
| 4135458 | CIF | Bi2 Mo | I 4/m c m | 6.4155; 6.4155; 5.488 90; 90; 90 | 225.88 | Altman, Alison B.; Tamerius, Alexandra D.; Koocher, Nathan Z.; Meng, Yue; Pickard, Chris J.; Walsh, James P. S.; Rondinelli, James M.; Jacobsen, Steven D.; Freedman, Danna E. Computationally Directed Discovery of MoBi2 Journal of the American Chemical Society, 2020 |
| 4302867 | CIF | Cl5 Cs Pb2 | I 4/m c m | 8.107; 8.107; 14.698 90; 90; 90 | 966 | Min Kyung Kim; Vinna Jo; Kang Min Ok New Variant of Highly Symmetric Layered Perovskite with Coordinated NO3- Ligand: Hydrothermal Synthesis, Structure, and Characterization of Cs2PbCl2(NO3)2 Inorganic Chemistry, 2009, 48, 7368-7372 |
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