Crystallography Open Database
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Searching space group like 'A e a 2'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1011124 | CIF | B5 H8 K O12 | A e a 2 | 11.08; 11.14; 8.97 90; 90; 90 | 1107.2 | Zachariasen, W. H. The crystal structure of potassium acid dihydronium pentaborate KH~2~(H~3~O)~2~B~5~O~10~, (potassium pentaborate tetrahydrate) Zeitschrift für Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie, 1938, 98, 266-274 |
1539126 | CIF | F5 H4 Na2 Nb O4 | A e a 2 | 10.361; 10.263; 6.89 90; 90; 90 | 732.648 | Stomberg, R. The crystal structure of sodium pentafluoroperoxoniobate (V) dihydrate, Na2 (Nb F5 (O2)) (H2 O)2 Acta Chemica Scandinavica, Series A: (28,1974-), 1981, 35, 489-495 |
1541172 | CIF | Br3 H Hg O2 Pb2 | A e a 2 | 14.652; 14.6491; 7.782 90; 90; 90 | 1670.32 | Riebe, H.J.; Keller, H.L. Darstellung und Kristallstruktur von Hg Pb2 O (O H) Br3 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1989, 574, 191-198 |
1548079 | CIF | C68 H90 O12 P4 Zn11 | A e a 2 | 27.6082; 23.0173; 24.3319 90; 90; 90 | 15462.1 | Sebastian D. Pike; Edward R. White; Milo S. P. Shaffer; Charlotte K. Williams Simple phosphinate ligands access zinc clusters identified in the synthesis of zinc oxide nanoparticles Nature Communications, 2016, 7, 13008 |
1552047 | CIF | C88 H56 Fe2 N9 | A e a 2 | 17.3865; 25.0127; 15.0576 90; 90; 90 | 6548.3 | Evgeny V. Kudrik; Pavel Afanasiev; Leonardo X. Alvarez; Patrick Dubourdeaux; Martin Clemancey; Jean-Marc Latour; Genevieve Blondin; Denis Bouchu; Florian Albrieux; Sergey E. Nefedov; Alexander B. Sorokin An N-bridged high-valent diiron-oxo species on a porphyrin platform that can oxidize methane Nature Chemistry, 2012, 4, 1024-1029 |
1553642 | CIF | C18 H19 N3 | A e a 2 | 12.2491; 35.949; 13.088 90; 90; 90 | 5763.2 | Zhang, Yun; Xue, Yibin; Li, Gang; Yuan, Haosen; Luo, Tuoping Enantioselective synthesis of <i>Iboga</i> alkaloids and vinblastine <i>via</i> rearrangements of quaternary ammoniums. Chemical science, 2016, 7, 5530-5536 |
1554492 | CIF | C70 H56 Ag5 Cl2 N6 P4 | A e a 2 | 27.38; 26.9; 24.03 90; 90; 90 | 17699 | Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives Organic Chemistry Frontiers, 2019, 6, 426 |
1556254 | CIF | C16 H30 O3 Si2 | A e a 2 | 30.9982; 11.381; 11.1291 90; 90; 90 | 3926.24 | Bender, Tobias; Loits, Darran; White, Jonathan M.; Rizzacasa, Mark A. Synthesis of the C1-C18 fragment of rhizopodin: late-state introduction of the oxazole. Organic letters, 2014, 16, 1450-1453 |
1556859 | CIF | C15 H16 N2 O2 | A e a 2 | 11.4176; 13.5604; 16.3722 90; 90; 90 | 2534.9 | Wen, Jin; Turowski, Michał; Dron, Paul I.; Chalupský, Jakub; Grotjahn, Robin; Maier, Toni M.; Fatur, Steven M.; Havlas, Zdeněk; Johnson, Justin C.; Kaupp, Martin; Michl, Josef Electronic States of 2,3-Diamino-1,4-naphthoquinone and Its N-Alkylated Derivatives The Journal of Physical Chemistry C, 2019 |
1558646 | CIF | C45.5 H56 Al F3 N2 | A e a 2 | 25.104; 18.4374; 17.7897 90; 90; 90 | 8234 | 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 |
1559826 | CIF | C104 H100 Ag2 B2 N8 | A e a 2 | 8.9095; 41.3302; 26.6661 90; 90; 90 | 9819.3 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1560680 | CIF | Ga S9 Sb Y4 | A e a 2 | 13.48; 13.79; 13.99 90; 90; 90 | 2600.6 | Wang, Yue; Zou, Xiaochuan; Feng, Xia; Shi, Yongfang; Wu, Liming Quaternary non-centrosymmetric sulfide Y 4 GaSbS 9 : Syntheses, structures, optical properties and theoretical studies Journal of Solid State Chemistry, 2017, 245, 110-114 |
1561546 | CIF | Ce4 Ga S9 Sb | A e a 2 | 13.8834; 14.3004; 14.4102 90; 90; 90 | 2861 | Zhao, Hua-Jun Centrosymmetry vs noncentrosymmetry in La2Ga0.33SbS5 and Ce4GaSbS9 based on the interesting size effects of lanthanides: Syntheses, crystal structures, and optical properties Journal of Solid State Chemistry, 2016, 237, 99-104 |
1561617 | CIF | C20 H19 Cd1.5 N4 O10 S | A e a 2 | 14.373; 38.22; 9.0099 90; 90; 90 | 4949.5 | Ren, Yixia; Chai, Hongmei; Tang, Long; Hou, Xiangyang; Wang, Jijiang Structural diversity and fluorescence properties of three 2-sulfoterephthalate CdII/ZnII coordination polymers employing 1,4-bisbenzimidazole Journal of Solid State Chemistry, 2016, 234, 103-109 |
1561713 | CIF | C32 H27 N O5 Zn | A e a 2 | 15.6909; 43.795; 7.7177 90; 90; 90 | 5303.5 | Li, Liang; Wang, Zihao; Chen, Qiang; Zhou, Xinhui; yang, Tao; Zhao, Qiang; Huang, Wei Coordination polymers assembled from semirigid fluorene-based ligand: A couple of enantiomers Journal of Solid State Chemistry, 2015, 231, 47-52 |
1563936 | CIF | C32 H22 N4 O4 Zn | A e a 2 | 15.9969; 21.6823; 7.5937 90; 90; 90 | 2633.9 | Bejan, Dana; Bahrin, Lucian Gabriel; Shova, Sergiu; Sardaru, Monica; Clima, Lilia; Nicolescu, Alina; Marangoci, Narcisa; Lozan, Vasile; Janiak, Christoph Spontaneous resolution of non-centrosymmetric coordination polymers of zinc(II) with achiral imidazole-biphenyl-carboxylate ligands Inorganica Chimica Acta, 2018, 482, 275-283 |
1563988 | CIF | C40 H30 Cd N2 O4 | A e a 2 | 10.9938; 25.635; 11.8497 90; 90; 90 | 3339.6 | Marandi, Farzin; Moeini, Keyvan; Alizadeh, Fereshteh; Mardani, Zahra; Quah, Ching Kheng; Loh, Wan-Sin; Woollins, J. Derek Treatment of cadmium(II) and zinc(II) with N2-donor linkages in presence of β-diketone ligand; supported by structural, spectral, theoretical and docking studies Inorganica Chimica Acta, 2018, 482, 717-725 |
1564008 | CIF | C36 H27 N12 O12 Zn2 | A e a 2 | 14.82; 32.601; 19.2529 90; 90; 90 | 9302 | Li, Ling; Deng, Zhao-Yang; Xie, Xin; Zou, Ji-Yong; You, Sheng-Yong; Chen, Kai-Hong; Le, Jin-Feng A luminescent zinc(II) coordination polymer as a highly selective and sensitive chemosensor for Fe(III) cation and Cr(VI) anions detection in aqueous solution Inorganica Chimica Acta, 2020, 513, 119940 |
1564544 | CIF | C4 H4 B K O12 | A e a 2 | 11.0579; 11.1695; 9.0504 90; 90; 90 | 1117.83 | TOMBUL, Mustafa; TÜRKMENOGLU, Elmas; SAHIN, Onur Unprecedented Formation of Potassium Borate Based Carbonate from Chloral Hydrate, Potassium Carbonate and Boric Acid X-ray Structure Analysis Online, 2021, 37, 45-47 |
1565426 | CIF | C16 H22 B9 N O | A e a 2 | 12.6535; 21.2265; 15.7104 90; 90; 90 | 4219.6 | Cao, Hou-Ji; Wei, Xing; Sun, Fangxiang; Zhang, Xiaolei; Lu, Changsheng; Yan, Hong Metal-catalyzed B–H acylmethylation of pyridylcarboranes: access to carborane-fused indoliziniums and quinoliziniums Chemical Science, 2021 |
1565797 | CIF | C42 H39 Cu N2 O11 | A e a 2 | 11.1083; 39.2626; 8.5567 90; 90; 90 | 3731.9 | Azmi, Nurul I.; Zhan, Shun-Ze; Li, Jing-Hong; Razali, Mohd. R. Metal complexes based on substituted aliphatic acid derived from a Diels-Alder adduct: Synthesis and potential ratiometric luminescent temperature sensor of d10 complex Inorganica Chimica Acta, 2019, 498, 119167 |
1566057 | CIF | C20 H12 Co N Na O7 | A e a 2 | 27.1599; 26.0222; 6.0047 90; 90; 90 | 4243.9 | 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 |
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 |
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 |
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 |
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