Crystallography Open Database
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Searching space group like 'P c a 21'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1008257 | CIF | C H4 F3 N2 O Sb | P c a 21 | 8.846; 8.378; 7.241 90; 90; 90 | 536.6 | Bourgault, M; Fourcade, R; Ducourant, B; Mascherpa, G Structure cristalline de (N H~2~)~2~ C O, Sb F~3~ Revue de Chimie Minerale, 1979, 16, 151-156 |
1009039 | CIF | Co H3 O4 P | P c a 21 | 8.984; 7.918; 10.139 90; 90; 90 | 721.2 | Sapina, F; Gomez-Romero, P; Marcos, M D; Amoros, P; Ibanez, R; Beltran, D; Navarro, R; Rillo, C; Lera, F Two new cobalt(II) compounds exhibiting weak ferromagnetism: magnetic susceptibility study of Co H P O3 . H2 O and Co Cl (H2 P O2) . (H2 O) and crystal structure of Co H P O3 . H2 O European Journal of Solid State Inorganic Chemistry, 1989, 26, 603-617 |
1010203 | CIF | F2 I K O2 | P c a 21 | 8.38; 5.97; 8.41 90; 90; 90 | 420.7 | Helmholz, L; Rogers, M T The Crystal Structure of Potassium Fluoroiodate, K I O~2~ F~2~ Journal of the American Chemical Society, 1940, 62, 1537-1542 |
1011295 | CIF | C H2 Na2 O4 | P c a 21 | 10.721; 5.243; 6.44 90; 90; 90 | 362 | Harper, J P Crystal structure of sodium carbonate monohydrate, Na2 C O3 H2 O Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 95, 266-273 |
1100195 | CIF | C24 H60 Cl4 Li2 Mo2 O17 | P c a 21 | 20.449; 12.7631; 16.5388 90; 90; 90 | 4316.5 | K.Harms; M.Marsch Private Communication, 2000 |
1100393 | CIF | C25 H35 Cl7 N3 P3 Ti2 | P c a 21 | 12.21; 14.075; 21.393 90; 90; 90 | 3676.51 | Rübenstahl, T.; Weller, F.; Harms, K.; Dehnicke, K.; Fenske, D.; Baum, G. Phosphaniminato-Komplexe des Titans. Synthese und Kristallstrukturen von CpTiCl2(NPMe~3~), [TiCl~3~(NPMe~3~)]~2~, [Ti~2~Cl~5~(NPMe~2~Ph)~3~] und [Ti~3~Cl~6~(NPMe~3~)~5~][BPh~4~] Zeitschrift fuer Anorganische und Allgemeine Chemie, 1994, 620, 1741-1749 |
1100446 | CIF | C12 H30 Cl2 N2 P2 S | P c a 21 | 12.99; 11.579; 12.653 90; 90; 90 | 1903.15 | Kunkel, F.; Harms, K.; Kang, H.-C.; Massa, W.; Dehnicke, K. Phosphaniminato-Komplexe des Schwefels. Kristallstrukturen von [S(NPEt~3~)~3~]Cl, [S(NPEt~3~)~2~]Cl~2~ und [Me~3~SiOSO~2~NPPh~3~] Zeitschrift fuer Anorganische und Allgemeine Chemie, 1997, 623, 962-966 |
1100454 | CIF | C9 H29 Cl2 N Sn3 | P c a 21 | 13.732; 7.622; 19.515 90; 90; 90 | 2042.54 | Hillwig, R.; Harms, K.; Dehnicke, K.; Müller, U. Elementorganisch substituierte Ammonium-Salze. Die Kristallstrukturen von [HN(SnMe~3~)~3~]I, [H~2~N(SnMe~3~)~2~][SnMe~3~Cl~2~] und [N(AsMe~3~)~2~]Br Zeitschrift fuer Anorganische und Allgemeine Chemie, 1997, 623, 676-682 |
1100803 | CIF | C13 H23 Cl N2 O Pd | P c a 21 | 18.2636; 9.3501; 9.2895 90; 90; 90 | 1586.34 | Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Bautista, Delia; Jones, Peter G. Reactivity of [Pd{CH~2~C(O)Me}Cl]~n~ toward Isocyanides Organometallics, 2005, 24, 2516-2527 |
1501673 | CIF | C16 H30 N4 O8 S8 | P c a 21 | 11.432; 24.09; 10.121 90; 90; 90 | 2787 | Shi, Zheng; Lu, Zhe-Jun; Zhu, Qin-Yu; Huo, Li-Bin; Han, Qiong-Hua; Bian, Guo-Qing; Dai, Jie Diamino-diamido tetrathiafulvalene for the sensing of anions and cations: a view in electrochemistry and structure. The journal of physical chemistry. B, 2011, 115, 3020-3026 |
1501901 | CIF | C42 H42 B N | P c a 21 | 23.245; 11.539; 12.288 90; 90; 90 | 3295.9 | Hudson, Zachary M.; Liu, Xiang-Yang; Wang, Suning Switchable Three-State Fluorescence of a Nonconjugated Donor‒Acceptor Triarylborane Organic Letters, 2011, 13, 300-303 |
1502604 | CIF | C22 H23 N O4 S | P c a 21 | 15.819; 11.095; 11.877 90; 90; 90 | 2085 | Zheng, Huaiji; Huo, Xing; Zhao, Changgui; Jing, Peng; Yang, Juan; Fang, Bowen; She, Xuegong Au-catalyzed piperidine synthesis via tandem acyloxy migration/intramolecular [3 + 2] cycloaddition of enynyl esters. Organic letters, 2011, 13, 6448-6451 |
1502701 | CIF | C3 H5 O2 Tl | P c a 21 | 7.302; 10.636; 21.028 90; 90; 90 | 1633.1 | Martínez Casado, F J; Ramos Riesco, M.; da Silva, I.; Labrador, A.; Redondo, M. I.; García Pérez, M V; López-Andrés, S; Rodríguez Cheda, J A Thermal and structural study of the crystal phases and mesophases in the lithium and thallium(i) propanoates and pentanoates binary systems: formation of mixed salts and stabilization of the ionic liquid crystal phase. The journal of physical chemistry. B, 2010, 114, 10075-10085 |
1502961 | CIF | C14 H20 Br2 Se2 Si2 | P c a 21 | 28.649; 7.6936; 18.557 90; 90; 90 | 4090.2 | Getmanenko, Yulia A.; Tongwa, Paul; Timofeeva, Tatiana V.; Marder, Seth R. Base-catalyzed halogen dance reaction and oxidative coupling sequence as a convenient method for the preparation of dihalo-bisheteroarenes. Organic letters, 2010, 12, 2136-2139 |
1503035 | CIF | C24 H40 O3 Si | P c a 21 | 20.0329; 6.5664; 17.1418 90; 90; 90 | 2254.9 | Lazarski, Kiel E.; Hu, Dennis X.; Stern, Charlotte L.; Thomson, Regan J. A synthesis of the carbocyclic core of maoecrystal V. Organic letters, 2010, 12, 3010-3013 |
1503059 | CIF | C26 H37 N O5 | P c a 21 | 16.5169; 5.7641; 50.954 90; 90; 90 | 4851.1 | Burke, Jason P.; Sabat, Michal; Iovan, Diana A.; Myers, William H.; Chruma, Jason J. Exploring the original proposed biosynthesis of (+)-symbioimine: remote exocyclic stereocontrol in a type I IMDA reaction. Organic letters, 2010, 12, 3192-3195 |
1503137 | CIF | C13 H14 O4 | P c a 21 | 11.0204; 8.2388; 12.1197 90; 90; 90 | 1100.41 | Cordes, Jens; Harms, Klaus; Koert, Ulrich Synthesis of the isoquinocycline-pyrrolopyrrole substructure. Organic letters, 2010, 12, 3808-3811 |
1503343 | CIF | C10 H8 F3 N O4 | P c a 21 | 18.015; 8.9617; 6.7552 90; 90; 90 | 1090.6 | Kole, Goutam Kumar; Tan, Geok Kheng; Vittal, Jagadese J. Anion-controlled stereoselective synthesis of cyclobutane derivatives by solid-state [2 + 2] cycloaddition reaction of the salts of trans-3-(4-pyridyl) acrylic acid. Organic letters, 2010, 12, 128-131 |
1503493 | CIF | C21 H21 N O4 | P c a 21 | 11.8807; 19.0098; 8.062 90; 90; 90 | 1820.8 | Hong, Bor-Cherng; Dange, Nitin S.; Ding, Chun-Feng; Liao, Ju-Hsiou Organocatalytic Michael-Knoevenagel-hetero-Diels-Alder reactions: an efficient asymmetric one-pot strategy to isochromene pyrimidinedione derivatives. Organic letters, 2012, 14, 448-451 |
1503561 | CIF | C13 H14 N2 O2 | P c a 21 | 16.7103; 11.6052; 12.5938 90; 90; 90 | 2442.3 | Mahanta, Sanjeev P.; Kumar, B. Sathish; Baskaran, Sambath; Sivasankar, Chinnappan; Panda, Pradeepta K. Colorimetric sensing of fluoride ion by new expanded calix[4]pyrrole through anion-π interaction. Organic letters, 2012, 14, 548-551 |
1503649 | CIF | C22 H17 N O S | P c a 21 | 28.2746; 7.6602; 7.6661 90; 90; 90 | 1660.39 | Wang, Xiang-Shan; Li, Qing; Wu, Jian-Rong; Tu, Shu-Jiang Efficient Method for the Synthesis of Pyranoquinoline, Thiopyranoquinoline, Thienoquinoline, and Naphtho[2,7]naphthyridine Derivatives Catalyzed by Iodine Journal of Combinatorial Chemistry, 2009, 11, 433 |
1503662 | CIF | C14 H13 N O3 S2 | P c a 21 | 13.516; 9.108; 22.558 90; 90; 90 | 2777 | Agrawal, Arpita; de Oliveira, César Augusto F; Cheng, Yuhui; Jacobsen, Jennifer A.; McCammon, J. Andrew; Cohen, Seth M. Thioamide hydroxypyrothiones supersede amide hydroxypyrothiones in potency against anthrax lethal factor. Journal of medicinal chemistry, 2009, 52, 1063-1074 |
1503897 | CIF | C11 H18 N4 O2 | P c a 21 | 9.7231; 9.0749; 13.0834 90; 90; 90 | 1154.43 | Kelly, Ann Rowley; Wei, Jingqiang; Kesavan, Sarathy; Marié, Jean-Charles; Windmon, Nicole; Young, Damian W.; Marcaurelle, Lisa A. Accessing skeletal diversity using catalyst control: formation of n and n + 1 macrocyclic triazole rings. Organic letters, 2009, 11, 2257-2260 |
1503906 | CIF | C28 H30 O4 | P c a 21 | 24.138; 8.8059; 10.177 90; 90; 90 | 2163.2 | Mitasev, Branko; Porco, Jr, John A Manganese(III)-mediated transformations of phloroglucinols: a formal oxidative [4 + 2] cycloaddition leading to bicyclo[2.2.2]octadiones. Organic letters, 2009, 11, 2285-2288 |
1503974 | CIF | C20 H22 O5 | P c a 21 | 12.306; 12.827; 10.576 90; 90; 90 | 1669.4 | Majetich, George; Grove, Jeremy L. Total synthesis of (+)-19-deoxyicetexone, (-)-icetexone, and (+)-5-epi-icetexone. Organic letters, 2009, 11, 2904-2907 |
1504040 | CIF | C14 H11 I | P c a 21 | 26.395; 12.0508; 7.482 90; 90; 90 | 2379.9 | Pawluć, Piotr; Hreczycho, Grzegorz; Szudkowska, Justyna; Kubicki, Maciej; Marciniec, Bogdan New one-pot synthesis of (E)-beta-aryl vinyl halides from styrenes. Organic letters, 2009, 11, 3390-3393 |
1504479 | CIF | C24 H27 N O4 | P c a 21 | 11.147; 18.976; 9.467 90; 90; 90 | 2002.5 | Taniguchi, Tsuyoshi; Tanabe, Genzo; Muraoka, Osamu; Ishibashi, Hiroyuki Total synthesis of (+/-)-stemonamide and (+/-)-isostemonamide using a radical cascade. Organic letters, 2008, 10, 197-199 |
1505089 | CIF | C7 H13 I N2 O | P c a 21 | 15.2411; 8.2598; 32.681 90; 90; 90 | 4114.2 | Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B, 2007, 111, 10095-10108 |
1505271 | CIF | C48 H60 O8 S4 | P c a 21 | 18.5095; 11.1086; 22.85 90; 90; 90 | 4698.3 | Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination. Organic letters, 2007, 9, 493-496 |
1506234 | CIF | C13 H16 O2 | P c a 21 | 11.2356; 5.4389; 19.1892 90; 90; 90 | 1172.64 | Jervis, Peter J.; Kariuki, Benson M.; Cox, Liam R. Stereoselective synthesis of 2,4,5-trisubstituted tetrahydropyrans using an intramolecular allylation strategy. Organic letters, 2006, 8, 4649-4652 |
1506335 | CIF | C7 H15 Cu N O6 | P c a 21 | 19.837; 7.084; 14.896 90; 90; 90 | 2093.3 | Skorik, Yury A.; Gomes, Carlos A. R.; Podberezskaya, Nina V.; Romanenko, Galina V.; Pinto, Luiz F.; Yatluk, Yury G. Complexation Models ofN-(2-Carboxyethyl)chitosans with Copper(II) Ions Biomacromolecules, 2005, 6, 189 |
1506370 | CIF | C37 H49 N6 O9 | P c a 21 | 14.77; 20.689; 12.699 90; 90; 90 | 3881 | Maekawa, Kensuke; Shiomi, Daisuke; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji Exchange interaction in covalently bonded biradical-monoradical composite molecules. The journal of physical chemistry. B, 2005, 109, 3303-3309 |
1506496 | CIF | C26 H16 N4 O12 | P c a 21 | 12.3501; 18.786; 10.827 90; 90; 90 | 2512 | Katz, Jeffrey L.; Feldman, Michael B.; Conry, Rebecca R. Synthesis of functionalized oxacalix[4]arenes. Organic letters, 2005, 7, 91-94 |
1506524 | CIF | C20 H15 N3 O | P c a 21 | 15.686; 12.04; 7.8796 90; 90; 90 | 1488.1 | Davis, Riju; Tamaoki, Nobuyuki Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene. Organic letters, 2005, 7, 1461-1464 |
1506666 | CIF | C7 H7 F2 I | P c a 21 | 17.946; 11.4823; 7.3257 90; 90; 90 | 1509.54 | Ye, Chengfeng; Twamley, Brendan; Shreeve, Jean'ne M. Straightforward syntheses of hypervalent iodine(III) reagents mediated by Selectfluor. Organic letters, 2005, 7, 3961-3964 |
1506681 | CIF | C88 H76 Cl12 N6 O6 | P c a 21 | 33.749; 12.982; 19.167 90; 90; 90 | 8398 | Tominaga, Masahide; Masu, Hyuma; Katagiri, Kosuke; Kato, Takako; Azumaya, Isao Triple helicate constructed by covalent bondings: crystal structure and effective synthesis based on propeller-like substructures. Organic letters, 2005, 7, 3785-3787 |
1506741 | CIF | C18 H26 Cl2 N2 O2 | P c a 21 | 14.174; 11.5857; 12.0325 90; 90; 90 | 1975.9 | Lim, Yeon-Hee; Li, Tindy; Chen, Peiling; Schreiber, Patrick; Kuznetsova, Larissa; Carroll, Patrick J.; Lauher, Joseph W.; Sieburth, Scott McN Asymmetry by electrophilic rearrangement of symmetric 2-pyridone photodimers. Organic letters, 2005, 7, 5413-5415 |
1506809 | CIF | C18 H19 N4 O2 | P c a 21 | 13.515; 11.858; 10.593 90; 90; 90 | 1697.6 | Nagashima, Hideaki; Inoue, Hidenari; Yoshioka, Naoki An Ideal One-Dimensional Antiferromagnetic Spin System Observed in Hydrogen-Bonded Naphth[2,3-d]imidazol-2-yl Nitronyl Nitroxide Crystal: The Role of the Hydrogen Bond. The journal of physical chemistry. B, 2004, 108, 6144-6151 |
1507057 | CIF | C7 H8 O S2 | P c a 21 | 11.134; 6.498; 10.429 90; 90; 90 | 754.52 | Ishii, Akihiko; Kashiura, Satoshi; Oshida, Hideaki; Nakayama, Juzo First isolation of eclipsed vic-disulfoxide: 7,8-dithiabicyclo[4.2.1]nona-2,4-diene 7-exo,8-exo-dioxide. Organic letters, 2004, 6, 2623-2626 |
1507058 | CIF | C7 H8 O2 S2 | P c a 21 | 19.794; 6.216; 12.889 90; 90; 90 | 1585.9 | Ishii, Akihiko; Kashiura, Satoshi; Oshida, Hideaki; Nakayama, Juzo First isolation of eclipsed vic-disulfoxide: 7,8-dithiabicyclo[4.2.1]nona-2,4-diene 7-exo,8-exo-dioxide. Organic letters, 2004, 6, 2623-2626 |
1507788 | CIF | C10 H15 N3 O5 Pt | P c a 21 | 9.4898; 15.218; 8.9436 90; 90; 90 | 1291.6 | Wilson, Justin J.; Lippard, Stephen J. In Vitro Anticancer Activity of cis-Diammineplatinum(II) Complexes with β-Diketonate Leaving Group Ligands. Journal of medicinal chemistry, 2012, 55, 5326-5336 |
1507848 | CIF | C17 H15 Br O4 | P c a 21 | 10.86; 17.451; 8.049 90; 90; 90 | 1525.4 | Parnes, Regev; Kshirsagar, Umesh A.; Werbeloff, Aviya; Regev, Clil; Pappo, Doron Ligand-controlled iron-catalyzed coupling of α-substituted β-ketoesters with phenols. Organic letters, 2012, 14, 3324-3327 |
1507879 | CIF | C27 H21 N S3 | P c a 21 | 15.2379; 14.5654; 19.8667 90; 90; 90 | 4409.3 | Sathyamoorthi, Shyam; Mague, Joel T.; Pascal, Jr, Robert A An in-triphenylaminophane. Organic letters, 2012, 14, 3427-3429 |
1508023 | CIF | C81 H84 F24 N17 O P4 V2 | P c a 21 | 23.4395; 21.7426; 17.4435 90; 90; 90 | 8889.8 | Bechlars, Bettina; D'Alessandro, Deanna M; Jenkins, David M.; Iavarone, Anthony T.; Glover, Starla D.; Kubiak, Clifford P.; Long, Jeffrey R. High-spin ground states via electron delocalization in mixed-valence imidazolate-bridged divanadium complexes. Nature chemistry, 2010, 2, 362-368 |
1508241 | CIF | C76 H107 B O4 U2 | P c a 21 | 24.882; 10.719; 25.2792 90; 90; 90 | 6742.22 | Arnold, Polly L.; Mansell, Stephen M.; Maron, Laurent; McKay, David Spontaneous reduction and C-H borylation of arenes mediated by uranium(III) disproportionation. Nature chemistry, 2012, 4, 668-674 |
1508330 | CIF | C14 H18 O4 | P c a 21 | 15.563; 5.224; 32.605 90; 90; 90 | 2651 | Han, Xun; Floreancig, Paul E. Synthesis of bridged inside-outside bicyclic ethers through oxidative transannular cyclization reactions. Organic letters, 2012, 14, 3808-3811 |
1508341 | CIF | C22 H27 N7 O7 | P c a 21 | 20.6019; 7.0886; 32.075 90; 90; 90 | 4684.2 | Dyablo, Olga V.; Shmoilova, Elena A.; Pozharskii, Alexander F.; Ozeryanskii, Valery A.; Burov, Oleg N.; Starikova, Zoya A. 4,5-Bis(dimethylamino)quinolines: Proton Sponge versus Azine Behavior. Organic letters, 2012, 14, 4134-4137 |
1508519 | CIF | C25 H26 Fe N2 O2 | P c a 21 | 19.7267; 5.7377; 36.268 90; 90; 90 | 4105 | Patra, Malay; Ingram, Katrin; Pierroz, Vanessa; Ferrari, Stefano; Spingler, Bernhard; Keiser, Jennifer; Gasser, Gilles Ferrocenyl derivatives of the anthelmintic praziquantel: design, synthesis, and biological evaluation. Journal of medicinal chemistry, 2012, 55, 8790-8798 |
1508637 | CIF | C18 H17 I O3 | P c a 21 | 14.2621; 16.5312; 6.638 90; 90; 90 | 1565.04 | Petrone, David A.; Malik, Hasnain A.; Clemenceau, Antonin; Lautens, Mark Functionalized chromans and isochromans via a diastereoselective Pd(0)-catalyzed carboiodination. Organic letters, 2012, 14, 4806-4809 |
1508667 | CIF | C92.25 H46 | P c a 21 | 15.7767; 14.3048; 24.0147 90; 90; 90 | 5419.7 | Yanney, Michael; Fronczek, Frank R.; Sygula, Andrzej Corannulene subunit acts as a diene in a cycloaddition reaction: synthesis of C80H32 corannulyne tetramer. Organic letters, 2012, 14, 4942-4945 |
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