Crystallography Open Database
Search results
Result: there are 50 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching space group like 'P 2 2 21'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1509714 | CIF | Ag2 Se | P 2 2 21 | 7.05; 7.85; 4.33 90; 90; 90 | 239.633 | Imamov, R.M.; Pinsker, Z.G.; Ching-Liang, C.; Lapidus, E.L. Determination of the crystal structure of the low-temperature phase alpha-Ag2 Se Kristallografiya, 1965, 10, 275-283 |
| 1511708 | CIF | B9 Cs O14 | P 2 2 21 | 8.732; 8.767; 15.736 90; 90; 90 | 1204.65 | Nowogrocki, G.; Penin, N.; Touboul, M. Refinement of alpha-(Cs B9 O14) crystal structure Journal of Solid State Chemistry, 2003, 175, 348-352 |
| 1520103 | CIF | C34.5 H24 Cu N5.5 O5.62 | P 2 2 21 | 9.077; 13.831; 32.773 90; 90; 90 | 4114.5 | Hua, Carol; Turner, Peter; D'Alessandro, Deanna M Facile redox state manipulation in Cu(i) frameworks by utilisation of the redox-active tris(4-(pyridin-4-yl)phenyl)amine ligand. Dalton transactions (Cambridge, England : 2003), 2015, 44, 15297-15303 |
| 1520104 | CIF | C33 H24 Cu N5 O3 | P 2 2 21 | 9.077; 13.831; 32.773 90; 90; 90 | 4114.5 | Hua, Carol; Turner, Peter; D'Alessandro, Deanna M Facile redox state manipulation in Cu(i) frameworks by utilisation of the redox-active tris(4-(pyridin-4-yl)phenyl)amine ligand. Dalton transactions (Cambridge, England : 2003), 2015, 44, 15297-15303 |
| 1524363 | CIF | D0.19 Fe H0.69 Ti | P 2 2 21 | 2.976; 4.514; 4.378 90; 90; 90 | 58.813 | Fischer, R.; Haelg, W.; Schlapbach, L.; Andresen, A.F.; Stucki, F. Deuterium storage in Fe Ti. Measurement of desorption isotherms and structural studies by means of neutron diffraction Materials Research Bulletin, 1978, 13, 931-946 |
| 1524787 | CIF | Ba2 Cu4 O12 Pb2 Y2 | P 2 2 21 | 5.4654; 5.4973; 16.1729 90; 90; 90 | 485.914 | Fu, W.T.; Zandbergen, H.W.; de Jongh, L.J.; Haije, W.G. Preparation and crystal structure of Pb2Ba2YCu3O8+delta Physica C (Amsterdam), 1989, 159, 210-214 |
| 1524788 | CIF | Cs0.137778 O4 W1.11111 | P 2 2 21 | 34.85; 7.33; 7.758 90; 90; 90 | 1981.79 | Hussain, A. The Crystal Structure of a Cesium Intergrowth Tungstem Bronze Chemica Scripta, 1977, 11, 224-227 |
| 1524789 | CIF | Cs0.137778 O4 W1.11111 | P 2 2 21 | 34.85; 7.33; 3.879 90; 90; 90 | 990.892 | Hussain, A. The crystal structure of a cesium intergrowth tungsten bronze Chemica Scripta, 1977, 11, 224-227 |
| 1525209 | CIF | D1.37 Fe Ti | P 2 2 21 | 3.088; 4.515; 4.391 90; 90; 90 | 61.221 | Schefer, J.; Andresen, A.F.; Fischer, P.; Haelg, W.; Schlapbach, L.; Stucki, F. Structural phase transitions of Fe Ti - deuterides Materials Research Bulletin, 1979, 14, 1281-1294 |
| 1525962 | CIF | C2 B N | P 2 2 21 | 3.5536; 3.5986; 3.5528 90; 90; 90 | 45.433 | Mattesini, M.; Matar, S.F. Search for ultra-hard materials : theoretical characterisation of novel orthorhombic B C2 N crystals International Journal of Inorganic Materials, 2001, 3, 943-957 |
| 1530996 | CIF | F N O6 V | P 2 2 21 | 9.87; 9.844; 8.182 90; 90; 90 | 794.965 | Westermann, K.; Leimkuehler, M.; Mattes, R. Zur Struktur der Triperoxofluorovanadate(V) A(I)2(V(O2)3F) (A = NH4(+), K(+), Cs(+)) Journal of the Less-Common Metals, 1988, 137, 181-186 |
| 1532792 | CIF | B18 Cs2 O28 | P 2 2 21 | 8.80577; 8.75298; 15.79161 90; 90; 90 | 1217.17 | Wright, A.C.; Sinclair, R.N.; Stone, C.E.; Knight, K.S.; Vedishcheva, N.M.; Polyakova, I.G.; Shakhmatkin, B.A. Structure of crystalline cesium enneaborate Physics and Chemistry of Glasses, 2003, 44, 197-202 |
| 1539584 | CIF | Bi0.76 Mn0.876 | P 2 2 21 | 4.334; 7.505; 5.959 90; 90; 90 | 193.826 | Andresen, A.F.; Engebretsen, J.E.; Refsnes, J. Neutron diffraction investigations on quenched Mn Bi and Mn Bi.9 Sb.1 Acta Chemica Scandinavica (1-27,1973-42,1988), 1972, 26, 175-190 |
| 1540917 | CIF | Nd Si1.82 | P 2 2 21 | 8.3628; 13.5975; 8.3186 90; 90; 90 | 945.934 | Schobinger-Papamantellos, P.; Buschow, K.H.J.; Fischer, P. Neutron diffraction study of magnetic ordering in the system Nd Six (1.67 <= x <= 2.00) Journal of Magnetism and Magnetic Materials, 1991, 97, 53-68 |
| 2020562 | CIF HKL | C16 H23 N9 O4 S2 | P 2 2 21 | 6.8086; 8.1414; 18.6651 90; 90; 90 | 1034.64 | Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael 6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom Acta Crystallographica Section C, 2016, 72 |
| 2021006 | CIF HKL | C18 H26.16 N2 O9.08 | P 2 2 21 | 16.4332; 12.3817; 21.3581 90; 90; 90 | 4345.8 | Veselovsky, Vladimir V.; Lozanova, Antonina V.; Isaeva, Vera I.; Lobova, Anna A.; Fitch, Andrew N.; Chernyshev, Vladimir V. Optically active derivatives of terephthalic acid: four crystal structures from two powder patterns Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2222023 | CIF HKL Paper | C7 H11 Br3 N2 | P 2 2 21 | 4.1688; 8.8349; 14.7255 90; 90; 90 | 542.35 | Ng, Seik Weng 4-(Dimethylamino)pyridinium tribromide: whole molecule disorder of cation and anion Acta Crystallographica Section E, 2009, 65, o1276 |
| 4028919 | CIF | C20 H22 N2 O3 | P 2 2 21 | 12.405; 6.9058; 11.003 90; 90; 90 | 942.6 | Piotrkowska, Barbara; Myślińska, Małgorzata; Gdaniec, Maria; Herman, Aleksander; Połoński, Tadeusz Conformational Properties, Chiroptical Spectra, and Molecular Self-Assembly of 2,3-Piperazinodiones and Their Dithiono Analogues The Journal of Organic Chemistry, 2008, 73, 2852-2861 |
| 4031420 | CIF | F10 In3 Rb | P 2 2 21 | 7.747; 6.655; 8.024 90; 90; 90 | 413.688 | Champarnaud-Mesjard, J.C.; Mercurio-Lavaud, D.; Frit, B. Structure cristalline du fluoroindate de rubidium Rb In3 F10 Journal of Inorganic and Nuclear Chemistry, 1977, 39, 947-951 |
| 4107930 | CIF | C22 H32 Co N6 O3 | P 2 2 21 | 13.2529; 13.253; 13.995 90; 90; 90 | 2458.1 | Hye Jin Choi; Mircea Dincă; Jeffrey R. Long Broadly Hysteretic H2Adsorption in the Microporous Metal-Organic Framework Co(1,4-benzenedipyrazolate) Journal of the American Chemical Society, 2008, 130, 7848-7850 |
| 4118978 | CIF | C35 H25 B Br2 N | P 2 2 21 | 9.696; 12.111; 23.872 90; 90; 90 | 2803.2 | Takuji Hatakeyama; Sigma Hashimoto; Tsuyoshi Oba; Masaharu Nakamura Azaboradibenzo[6]helicene: Carrier Inversion Induced by Helical Homochirality Journal of the American Chemical Society, 2012, 134, 19600-19603 |
| 4122425 | CIF | C160 H208 Au20 S16 | P 2 2 21 | 27.62; 29.0891; 27.3169 90; 90; 90 | 21947.5 | Zeng, Chenjie; Liu, Chong; Chen, Yuxiang; Rosi, Nathaniel L.; Jin, Rongchao Gold-Thiolate Ring as a Protecting Motif in the Au20(SR)16 Nanocluster and Implications. Journal of the American Chemical Society, 2014, 136, 11922 |
| 4134735 | CIF | C65 H49.5 F24 N4.5 P4 | P 2 2 21 | 11.9331; 14.1803; 42.533 90; 90; 90 | 7197.2 | Garci, Amine; Beldjoudi, Yassine; Kodaimati, Mohamad S.; Hornick, Jessica E.; Nguyen, Minh T.; Cetin, M. Mustafa; Stern, Charlotte L.; Roy, Indranil; Weiss, Emily A.; Stoddart, J. Fraser Mechanical-Bond-Induced Exciplex Fluorescence in an Anthracene-Based Homo[2]catenane. Journal of the American Chemical Society, 2020, 142, 7956-7967 |
| 4324634 | CIF | C93 H99 N9 Ni3 O9 | P 2 2 21 | 27.486; 11.0171; 26.229 90; 90; 90 | 7943 | Yuanbiao Huang; Tianfu Liu; Jingxiang Lin; Jian Lü; Zujin Lin; Rong Cao Homochiral Nickel Coordination Polymers Based on Salen(Ni) Metalloligands: Synthesis, Structure, and Catalytic Alkene Epoxidation Inorganic Chemistry, 2011, 50, 2191-2198 |
| 4324635 | CIF | C93 H99 N9 Ni3 O9 | P 2 2 21 | 27.514; 11.0404; 26.236 90; 90; 90 | 7969.6 | Yuanbiao Huang; Tianfu Liu; Jingxiang Lin; Jian Lü; Zujin Lin; Rong Cao Homochiral Nickel Coordination Polymers Based on Salen(Ni) Metalloligands: Synthesis, Structure, and Catalytic Alkene Epoxidation Inorganic Chemistry, 2011, 50, 2191-2198 |
| 4329649 | CIF | C111 H120 Au8 F18 O7 P7 | P 2 2 21 | 13.8514; 16.7051; 29.317 90; 90; 90 | 6783.6 | Igor O. Koshevoy; Yuh-Chia Chang; Antti J. Karttunen; Stanislav I. Selivanov; Janne Jänis; Matti Haukka; Tapani Pakkanen; Sergey P. Tunik; Pi-Tai Chou Intensely Luminescent Homoleptic Alkynyl Decanuclear Gold(I) Clusters and Their Cationic Octanuclear Phosphine Derivatives Inorganic Chemistry, 2012, 51, 7392-7403 |
| 4334183 | CIF | C68 H57 In2 N11 O34 | P 2 2 21 | 12.7321; 13.5133; 25.484 90; 90; 90 | 4384.6 | Zu-Jin Lin; Yuan-Biao Huang; Tian-Fu Liu; Xiang-Ying Li; Rong Cao Construction of a Polyhedral Metal-Organic Framework via a Flexible Octacarboxylate Ligand for Gas Adsorption and Separation Inorganic Chemistry, 2013, 52, 3127-3132 |
| 4345989 | CIF | Cu31 Te24 | P 2 2 21 | 7.544; 22.622; 29.797 90; 90; 90 | 5085 | Mugnaioli, Enrico; Gemmi, Mauro; Tu, Renyong; David, Jeremy; Bertoni, Giovanni; Gaspari, Roberto; De Trizio, Luca; Manna, Liberato Ab Initio Structure Determination of Cu2–xTe Plasmonic Nanocrystals by Precession-Assisted Electron Diffraction Tomography and HAADF-STEM Imaging Inorganic Chemistry, 2018, 57, 10241-10248 |
| 4500802 | CIF | C59 H52 N16 O12 Zn2 | P 2 2 21 | 7.9114; 14.2572; 29.557 90; 90; 90 | 3333.9 | Yao, Xiao-Qiang; Zhang, Ming-Dao; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen Two Porous Zinc Coordination Polymers with (10,3) Topological Features Based on a N-Centered Tripodal Ligand and the Conversion of a (10,3)-d Subnet to a (10,3)-a Subnet Crystal Growth & Design, 2011, 11, 3039 |
| 4504326 | CIF | C14 H15 N4 O2 Zn | P 2 2 21 | 8.8594; 11.698; 14.955 90; 90; 90 | 1549.9 | He, Jun; Zhang, Jing-Xiang; Tan, Gui-Ping; Yin, Ye-Gao; Zhang, Dan; Hu, Mei-Hong Second Ligand-Directed Assembly of Photoluminescent Zn(II) Coordination Frameworks Crystal Growth & Design, 2007, 7, 1508 |
| 4513970 | CIF | C84 H84 Cd2 N4 O16 V2 | P 2 2 21 | 34.388; 34.853; 13.3846 90; 90; 90 | 16041.8 | Zhu, Chengfeng; Xia, Qingchun; Chen, Xu; Liu, Yan; Du, Xia; Cui, Yong Chiral Metal‒Organic Framework as a Platform for Cooperative Catalysis in Asymmetric Cyanosilylation of Aldehydes ACS Catalysis, 2016, 6, 7590 |
| 4513971 | CIF | C84 H84 Cd2 Cu N4 O16 V | P 2 2 21 | 33.9506; 35.3214; 13.4377 90; 90; 90 | 16114.3 | Zhu, Chengfeng; Xia, Qingchun; Chen, Xu; Liu, Yan; Du, Xia; Cui, Yong Chiral Metal‒Organic Framework as a Platform for Cooperative Catalysis in Asymmetric Cyanosilylation of Aldehydes ACS Catalysis, 2016, 6, 7590 |
| 4515423 | CIF | C64 H48 Cd2 N14 O10 S3 | P 2 2 21 | 9.513; 15.181; 25.601 90; 90; 90 | 3697 | Desai, Aamod V.; Joarder, Biplab; Roy, Arkendu; Samanta, Partha; Babarao, Ravichandar; Ghosh, Sujit K. Multifunctional Behavior of Sulfonate-Based Hydrolytically Stable Microporous Metal-Organic Frameworks. ACS applied materials & interfaces, 2018, 10, 39049-39055 |
| 4515424 | CIF | C64 H48 Cd2 N15 O10 S3 | P 2 2 21 | 9.5251; 15.1178; 25.8099 90; 90; 90 | 3716.6 | Desai, Aamod V.; Joarder, Biplab; Roy, Arkendu; Samanta, Partha; Babarao, Ravichandar; Ghosh, Sujit K. Multifunctional Behavior of Sulfonate-Based Hydrolytically Stable Microporous Metal-Organic Frameworks. ACS applied materials & interfaces, 2018, 10, 39049-39055 |
| 7028215 | CIF | C3 H9 F6 N3 O2 V2 | P 2 2 21 | 3.861; 6.664; 19.84 90; 90; 90 | 510.5 | Aidoudi, Farida H.; Black, Cameron; Arachchige, Kasun S Athukorala; Slawin, Alexandra M. Z.; Morris, Russell E.; Lightfoot, Philip Structural diversity in hybrid vanadium(IV) oxyfluorides based on a common building block. Dalton transactions (Cambridge, England : 2003), 2014, 43, 568-575 |
| 7028216 | CIF | C3 H5 F6 K N2 O2 V2 | P 2 2 21 | 3.8572; 6.4795; 20.051 90; 90; 90 | 501.13 | Aidoudi, Farida H.; Black, Cameron; Arachchige, Kasun S Athukorala; Slawin, Alexandra M. Z.; Morris, Russell E.; Lightfoot, Philip Structural diversity in hybrid vanadium(IV) oxyfluorides based on a common building block. Dalton transactions (Cambridge, England : 2003), 2014, 43, 568-575 |
| 7103062 | CIF | C50 H56 N2 O16 Zn4 | P 2 2 21 | 7.4577; 14.967; 22.633 90; 90; 90 | 2526.3 | Zhang, Jian; Bu, Xianhui A new enantiopure unsaturated dicarboxylate as a 4-connected unit in a flexible homochiral PtS-type framework. Chemical communications (Cambridge, England), 2008, 1756-1758 |
| 7112915 | CIF | C44 H34 Ag B F4 N4 O4 | P 2 2 21 | 8.2318; 13.8544; 41.7301 90; 90; 90 | 4759.2 | He, Yabing; Bian, Zheng; Kang, Chuanqing; Gao, Lianxun Stereoselective and hierarchical self-assembly from nanotubular homochiral helical coordination polymers to supramolecular gels. Chemical communications (Cambridge, England), 2010, 46, 5695-5697 |
| 7112916 | CIF | C44 H34 Ag B F4 N4 O4 | P 2 2 21 | 8.214; 13.8169; 41.563 90; 90; 90 | 4717.1 | He, Yabing; Bian, Zheng; Kang, Chuanqing; Gao, Lianxun Stereoselective and hierarchical self-assembly from nanotubular homochiral helical coordination polymers to supramolecular gels. Chemical communications (Cambridge, England), 2010, 46, 5695-5697 |
| 7118465 | CIF | C104 H100 Cd2 N8 O13.63 V2 | P 2 2 21 | 17.046; 24.0462; 28.8442 90; 90; 90 | 11823 | Bhunia, Asamanjoy; Dey, Subarna; Moreno, José María; Diaz, Urbano; Concepcion, Patricia; Van Hecke, Kristof; Janiak, Christoph; Van Der Voort, Pascal A homochiral vanadium-salen based cadmium bpdc MOF with permanent porosity as an asymmetric catalyst in solvent-free cyanosilylation. Chemical communications (Cambridge, England), 2016, 52, 1401-1404 |
| 7120815 | CIF | C136 H150 Cd2 Fe2 N12 O18.48 V2 | P 2 2 21 | 24.1093; 34.2098; 23.7848 90; 90; 90 | 19617.1 | Li, Zijian; Liu, Yan; Xia, Qingchun; Cui, Yong Chiral binary metal-organic frameworks for asymmetric sequential reactions Chem. Commun., 2017 |
| 7126739 | CIF | Be4 Cs4 Li O24 P7 | P 2 2 21 | 13.0892; 13.0889; 13.2528 90; 90; 90 | 2270.51 | Chen, Yi-Gang; Yang, Chunyu; Wang, Fang; Guo, Yao; Jiang, Xingxing; Zhang, Xian-Ming M<sub>4</sub>LiBe<sub>4</sub>P<sub>7</sub>O<sub>24</sub> and M<sub>4</sub>Li(Li<sub>3</sub>P)P<sub>7</sub>O<sub>24</sub> (M = Cs, Rb): deep-ultraviolet nonlinear-optical phosphates with a tetrahedra-substituted paracelsian-like framework. Chemical communications (Cambridge, England), 2020, 56, 8639-8642 |
| 7126740 | CIF | Be4 Li O24 P7 Rb4 | P 2 2 21 | 12.8805; 12.9118; 12.9447 90; 90; 90 | 2152.84 | Chen, Yi-Gang; Yang, Chunyu; Wang, Fang; Guo, Yao; Jiang, Xingxing; Zhang, Xian-Ming M<sub>4</sub>LiBe<sub>4</sub>P<sub>7</sub>O<sub>24</sub> and M<sub>4</sub>Li(Li<sub>3</sub>P)P<sub>7</sub>O<sub>24</sub> (M = Cs, Rb): deep-ultraviolet nonlinear-optical phosphates with a tetrahedra-substituted paracelsian-like framework. Chemical communications (Cambridge, England), 2020, 56, 8639-8642 |
| 7128141 | CIF | C150 H204 Au17 B Cd2 P4 S12 | P 2 2 21 | 19.544; 18.626; 26.122 90; 90; 90 | 9509 | Li, Tianrong; Li, Qinzhen; Yang, Sha; Xu, Liyun; Chai, Jinsong; Li, Peng; Zhu, Manzhou Surface engineering of linearly fused Au<sub>13</sub> units using diphosphine and Cd doping. Chemical communications (Cambridge, England), 2021, 57, 4682-4685 |
| 7232449 | CIF | C61 H60 N16 O14 Zn2 | P 2 2 21 | 8.2598; 13.977; 30.125 90; 90; 90 | 3477.8 | Yao, Xiao-Qiang; Xiao, Guo-Bin; Xie, Hua; Qin, Dong-Dong; Ma, Heng-Chang; Liu, Jia-Cheng; Yan, Pen-Ji Two triphenylamine-based luminescent metal‒organic frameworks as a dual-functional sensor for the detection of nitroaromatic compounds and ofloxacin antibiotic CrystEngComm, 2019, 21, 2559 |
| 7235746 | CIF | C68 H40 Cd3 O18 | P 2 2 21 | 28.677; 15.8555; 21.4018 90; 90; 90 | 9731.1 | Karra, Jagadeswara R.; Jasuja, Himanshu; Huang, You-Gui; Walton, Krista S. Structural stability of BTTB-based metal‒organic frameworks under humid conditions Journal of Materials Chemistry A, 2015, 3, 1624 |
| 7237732 | CIF | C91.5 H83.5 Cl2 In3 N5.5 O27.5 | P 2 2 21 | 9.339; 15.6217; 33.6709 90; 90; 90 | 4912.3 | Wu, Zhao-Feng; Tan, Bin; Velasco, Ever; Wang, Hao; Shen, Nan-Nan; Gao, Yu-Jie; Zhang, Xu; Zhu, Kun; Zhang, Guo-Yu; Liu, Yan-Yao; Hei, Xiu-Ze; Huang, Xiao-Ying; Li, Jing Fluorescent In based MOFs showing “turn on” luminescence towards thiols and acting as a ratiometric fluorescence thermometer Journal of Materials Chemistry C, 2019, 7, 3049 |
| 7239503 | CIF | C41 H40 In2 N2 O22 | P 2 2 21 | 12.262; 13.572; 24.934 90; 90; 90 | 4150 | Xue, Yun-Shan; He, Yabing; Zhou, Lian; Chen, Fei-Jian; Xu, Yan; Du, Hong-Bin; You, Xiao-Zeng; Chen, Banglin A photoluminescent microporous metal organic anionic framework for nitroaromatic explosive sensing Journal of Materials Chemistry A, 2013, 1, 4525 |
| 7245270 | CIF | C30 H38 N8 O9 | P 2 2 21 | 6.9489; 9.7256; 23.026 90; 90; 90 | 1556.1 | Angevine, Devin J.; Camacho, Kristine Joy; Rzayev, Javid; Benedict, Jason B. Transforming liquid nicotine into a stable solid through crystallization with orotic acid CrystEngComm, 2022 |
| 9016173 | CIF | Na Nb O3 | P 2 2 21 | 5.504; 5.568; 15.52 90; 90; 90 | 475.63 | Vousden, P. The structure of ferroelectric sodium niobate at room temperature Note: this is a possible polymorph of lueshite Acta Crystallographica, 1951, 4, 545-551 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!