Crystallography Open Database
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Searching space group like 'P c a b'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1001356 | CIF | K Nb O6 U | P c a b | 7.579; 11.321; 15.259 90; 90; 90 | 1309.3 | Gasperin, M Synthese et structure de trois niobouranates d'ions monovalents: Tl Nb~2~ U~2~ O~11.5~, K Nb U O~6~, et Rb Nb U O~6~ Journal of Solid State Chemistry, 1987, 67, 219-224 |
1011183 | CIF | O2 Te | P c a b | 5.5; 11.75; 5.59 90; 90; 90 | 361.3 | Ito, T; Sawada, H The crystal structure of tellurite (Te O2) Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1940, 102, 13-25 |
1100943 | CIF | C27 H19 Cl2 N5 O5 Ru | P c a b | 11.191; 14.194; 33.151 90; 90; 90 | 5265.9 | Nripen Chanda; Debamita Paul; Sanjib Kar; Shaikh M. Mobin; Anindya Datta; Vedavati G. Puranik; K. Krishnamurthy Rao; Goutam Kumar Lahiri Effect of 2-(2-Pyridyl)azole-Based Ancillary Ligands (L1-4) on the Electrophilicity of the Nitrosyl Function in [RuII(trpy)(L1-4)(NO)]3+ [trpy = 2,2':6',2''-Terpyridine]. Synthesis, Structures, and Spectroscopic, Electrochemical, and Kinetic Aspects Inorganic Chemistry, 2005, 44, 3499-3511 |
1100944 | CIF | C27 H20 Cl N6 O7.5 Ru | P c a b | 11.196; 14.428; 34.039 90; 90; 90 | 5498.5 | Nripen Chanda; Debamita Paul; Sanjib Kar; Shaikh M. Mobin; Anindya Datta; Vedavati G. Puranik; K. Krishnamurthy Rao; Goutam Kumar Lahiri Effect of 2-(2-Pyridyl)azole-Based Ancillary Ligands (L1-4) on the Electrophilicity of the Nitrosyl Function in [RuII(trpy)(L1-4)(NO)]3+ [trpy = 2,2':6',2''-Terpyridine]. Synthesis, Structures, and Spectroscopic, Electrochemical, and Kinetic Aspects Inorganic Chemistry, 2005, 44, 3499-3511 |
1503197 | CIF | C17 H19 N O5 | P c a b | 8.2353; 13.2297; 28.508 90; 90; 90 | 3106 | Miege, Frédéric; Meyer, Christophe; Cossy, Janine Synthesis of 3-oxa- and 3-azabicyclo[4.1.0]heptanes by gold-catalyzed cycloisomerization of cyclopropenes. Organic letters, 2010, 12, 4144-4147 |
1504632 | CIF | C23 H16 Cl2 O | P c a b | 8.1975; 16.851; 26.2443 90; 90; 90 | 3625.28 | Lee, Gon-Ann; Chen, Ko Chou The general synthesis and trapping of 3-substituted 1-chlorocyclopropenes. Organic letters, 2008, 10, 1843-1845 |
1506007 | CIF | C14 H22 N4 O3 | P c a b | 7.046; 15.999; 26.916 90; 90; 90 | 3034 | Korendovych, Ivan V.; Cho, Mimi; Butler, Phillip L.; Staples, Richard J.; Rybak-Akimova, Elena V Anion binding to monotopic and ditopic macrocyclic amides. Organic letters, 2006, 8, 3171-3174 |
1507807 | CIF | C17 H12 N2 O3 | P c a b | 11.145; 14.533; 16.506 90; 90; 90 | 2673.5 | Chen, Minghua; Gan, Lishe; Lin, Sheng; Wang, Xiaoliang; Li, Li; Li, Yuhuan; Zhu, Chenggen; Wang, Yanan; Jiang, Bingya; Jiang, Jiandong; Yang, Yongchun; Shi, Jiangong Alkaloids from the Root of Isatis indigotica. Journal of natural products, 2012, 75, 1167-1176 |
1508301 | CIF | C32 H28 N2 O4 S2 | P c a b | 9.7758; 22.9743; 24.7453 90; 90; 90 | 5557.6 | Mo, Juntae; Eom, Dahan; Lee, Euichul; Lee, Phil Ho Hybrid system of metal/Brønsted acid relay catalysis for the intramolecular double hydroarylation and cationic cyclization of diyne diethers and diamines. Organic letters, 2012, 14, 3684-3687 |
1510366 | CIF | Au2 Bi4 O9 | P c a b | 5.889; 8.847; 34.674 90; 90; 90 | 1806.52 | Geb, J.; Jansen, M. Bi2 Au O5 and Bi4 Au2 O9, two novel ternary oxoaurates Journal of Solid State Chemistry, 1996, 122, 364-370 |
1514883 | CIF | C71 H116 N4 O6 Y2 | P c a b | 21.045; 24.936; 30.425 90; 90; 90 | 15966 | Fang, Jian; Tschan, Mathieu J.-L.; Roisnel, Thierry; Trivelli, Xavier; Gauvin, Régis M.; Thomas, Christophe M.; Maron, Laurent Yttrium catalysts for syndioselective β-butyrolactone polymerization: on the origin of ligand-induced stereoselectivity Polymer Chemistry, 2013, 4, 360 |
1527517 | CIF | C4 H10 Ca N4 Ni O5 | P c a b | 17.185; 18.859; 6.774 90; 90; 90 | 2195.4 | Holt, E.; Watson, K.J. The crystal structure of calcium tetracyanonickelate(II) pentahydrate Acta Chemica Scandinavica (1-27,1973-42,1988), 1969, 23, 14-28 |
1534268 | CIF | As H3 O5 Sr | P c a b | 7.398; 14.286; 8.437 90; 90; 90 | 891.688 | Binas, H. Die Struktur des Sr-Haidingerits Sr H As O4 (H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1966, 347, 140-144 |
1534909 | CIF | H6 Li Mo N O5 | P c a b | 7.865; 10.883; 12.956 90; 90; 90 | 1108.97 | Makitova, D.D.; Tkachev, V.V.; Atovmyan, L.O. Crystal structure of monohydrate lithiumammonium molybdate LiNH4MoO4*H2O Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1990, 16, 793-795 |
1537599 | CIF | Cu5 H2 O14 Si4 | P c a b | 9.88; 19.82; 5.39 90; 90; 90 | 1055.48 | le Bihan, M.T. Contribution a l'etude des silicates de cuivre. Differenciation de la shattuckite et de la plancheite. Structure atomique de la shattuckite Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977), 1967, 90, 3-7 |
1538448 | CIF | H3 N O3 S | P c a b | 8.066; 8.115; 9.255 90; 90; 90 | 605.791 | Osaki, Kenji; Tadokoro, Hiroyuki; Nitta, Isamu Structure of Sulphamic Acid Molecule from a Three-dimensional Fourier Analysis Bulletin of the Chemical Society of Japan, 1955, 28, 524-528 |
1544678 | CIF | Cu5 H2 O14 Si4 | P c a b | 9.88; 19.82; 5.4 90; 90; 90 | 1057 | Kawahara, A. The crystal structure of shattuckite Mineralogical Journal, 1976, 8, 193-199 |
1548192 | CIF | C229.5 H354 Cr14 Cu F28 N4 Ni2 O70.5 | P c a b | 28.9075; 29.7016; 78.032 90; 90; 90 | 66998.2 | Antonio Fernandez; Jesus Ferrando-Soria; Eufemio Moreno Pineda; Floriana Tuna; Inigo J. Vitorica-Yrezabal; Christiane Knappke; Jakub Ujma; Christopher A. Muryn; Grigore A. Timco; Perdita E. Barran; Arzhang Ardavan; Richard E.P. Winpenny Making hybrid [n]-rotaxanes as supramolecular arrays of molecular electron spin qubits Nature Communications, 2016, 7, 10240 |
1548348 | CIF | C8 H9 N O2 | P c a b | 7.232; 11.76; 17.16 90; 90; 90 | 1459.43 | Palatinus, Lukáš; Brázda, Petr; Boullay, Philippe; Perez, Olivier; Klementová, Mariana; Petit, Sebastien; Eigner, Václav; Zaarour, Moussa; Mintova, Svetlana Hydrogen positions in single nanocrystals revealed by electron diffraction Science, 2017, 355, 166-169 |
1555929 | CIF | C17 H16 N4 O3 S | P c a b | 8.75; 15.7853; 24.961 90; 90; 90 | 3447.6 | Siva Kumari, A. Leela; Siva Reddy, Alla; Swamy, K. C. Kumara Transition Metal-Free Cascade Cyclization of Epoxy-Ynamides: To Go for 1,3-Oxazines or 1,4-Oxazines? Organic letters, 2016, 18, 5752-5755 |
1556316 | CIF | C17 H17 N O5 | P c a b | 8.8191; 17.5507; 20.7531 90; 90; 90 | 3212.2 | Ananthakrishnan, Rajakumar; Gazi, Sarifuddin [Ru(bpy)3]2+ aided photocatalytic synthesis of 2-arylpyridines via Hantzsch reaction under visible irradiation and oxygen atmosphere Catalysis Science & Technology, 2012, 2, 1463 |
1557422 | CIF | C13 H16 Cl N3 Pt | P c a b | 8.5675; 15.971; 18.875 90; 90; 90 | 2582.7 | Kvam, Per-Inge; Engebretsen, Thoralf; Maartmann-Moe, Knut; Songstad, Jon Crystal Structures of Bu4N[Pt(ppy)Cl2], Et4N[Pt(tpy)Cl2] and [Pt(ppy)en]Cl (ppy = N,C'-Chelated 2-Phenylpyridinate, tpy = N,C'-Chelated 2-(2'-Thienyl)pyridinate, en = N,N'-Chelated 1,2-Diaminoethane). Acta Chemica Scandinavica, 1996, 50, 107-113 |
1559445 | CIF | C14 H14 N4 | P c a b | 7.47; 11.446; 30.862 90; 90; 90 | 2638.8 | Aksnes, Dagfinn W.; Brekke, Trond; Maartmann-Moe, Knut Structure, Conformation, and Dynamics of 1,1,2,2-Tetracyano-3,3-dimethyl-4-(2',2'-dimethylethenyl)cyclobutane as Detected by X-Ray and Multinuclear NMR Analyses Acta Chemica Scandinavica, 1991, 45, 138-144 |
1559478 | CIF | C18 H21 N O4 | P c a b | 12.1827; 14.8081; 18.6214 90; 90; 90 | 3359.35 | Kranjc, Krištof; Juranovič, Amadej; Kočevar, Marijan; Perdih, Franc Supramolecular Diversity of Oxabicyclo[2.2.2]octenes Formed between Substituted 2H-Pyran-2-ones and Vinyl-Moiety-Containing Dienophiles Symmetry, 2020, 12, 1714 |
1559481 | CIF | C19 H21 N O5 | P c a b | 13.6258; 15.0585; 17.0887 90; 90; 90 | 3506.33 | Kranjc, Krištof; Juranovič, Amadej; Kočevar, Marijan; Perdih, Franc Supramolecular Diversity of Oxabicyclo[2.2.2]octenes Formed between Substituted 2H-Pyran-2-ones and Vinyl-Moiety-Containing Dienophiles Symmetry, 2020, 12, 1714 |
1559483 | CIF | C17 H19 N O6 | P c a b | 13.2171; 14.2221; 17.1809 90; 90; 90 | 3229.58 | Kranjc, Krištof; Juranovič, Amadej; Kočevar, Marijan; Perdih, Franc Supramolecular Diversity of Oxabicyclo[2.2.2]octenes Formed between Substituted 2H-Pyran-2-ones and Vinyl-Moiety-Containing Dienophiles Symmetry, 2020, 12, 1714 |
1561021 | CIF HKL | C40 H47 Ba2 Cu2 I2 Li2 N8 O16.5 | P c a b | 16.363; 27.061; 26.853 90; 90; 90 | 11890 | Xiong, Gang; Wang, Bin-bin; He, Yongke; you, Lixin; Ren, Baoyi; Sun, Yaguang Syntheses, structures, and luminescence of a series of novel trimetallic coordination polymers constructed by Cu-I clusters and alkaline-carboxyl- alkaline-earth building units Journal of Solid State Chemistry, 2018, 265, 393-401 |
1561505 | CIF | C8 H12 N2 S2 Zn2 | P c a b | 6.6018; 24.829; 6.217 90; 90; 90 | 1019.1 | Luberda-Durnaś, K.; Guillén, A. González; Łasocha, W. Synthesis optimisation and characterisation of the organic-inorganic layered materials ZnS(m-xylylenediamine)1/2 and ZnS(p-xylylenediamine)1/2 Journal of Solid State Chemistry, 2016, 238, 162-169 |
1564507 | CIF | C26 H22 N8 O2 Zn | P c a b | 10.3365; 12.0055; 39.117 90; 90; 90 | 4854.2 | Santiago, Pedro H.O.; Santiago, Mariana B.; Martins, Carlos H.G.; Gatto, Claudia C. Copper(II) and zinc(II) complexes with Hydrazone: Synthesis, crystal structure, Hirshfeld surface and antibacterial activity Inorganica Chimica Acta, 2020, 508, 119632 |
2000410 | CIF Paper | C20 H22 Cl2 O6 | P c a b | 6.5779; 15.565; 19.217 90; 90; 90 | 1967.5 | Ferguson, G.; Ruhl, B. L.; McKervey, M. A.; Browne, C. M. Bis(5-chloro-2-hydroxy-1,3-xylyl)-18-crown-4 Acta Crystallographica Section C, 1992, 48, 2262-2264 |
2000755 | CIF Paper | C6 H4 N4 O2 | P c a b | 13.602; 14.477; 6.969 90; 90; 90 | 1372.3 | Yamaguchi, K.; Takahashi, H.; Kaihoh, T.; Itoh, T.; Okada, M.; Nagata, K.; Matsumura, G.; Ohsawa, A. Structure of benzo-1,2,3,4-tetrazine 1,3-dioxide Acta Crystallographica Section C, 1992, 48, 1237-1239 |
2001234 | CIF Paper | C14 H19 N O | P c a b | 10.974; 11.892; 19.952 90; 90; 90 | 2603.8 | De Ridder, D. J. A.; Schenk, H.; Döpp, D. Structure of 6-<i>tert</i>-butyl-3,3-dimethyl-3<i>H</i>-indolium-1-oxide Acta Crystallographica Section C, 1993, 49, 1971-1973 |
2001290 | CIF Paper | C10 H29 Cl2 Cu N5 O9 | P c a b | 14.506; 14.823; 19.243 90; 90; 90 | 4137.7 | Lu, T.-H.; Tahirov, T. H.; Bin, C.-K.; Hsiao, C.-D.; Liu, Y.-L.; Lee, J.-C.; Chung, C.-S. Structure of (2,5,8,11,14-pentaazapentadecane)copper(II) diperchlorate monohydrate Acta Crystallographica Section C, 1993, 49, 1747-1749 |
2001538 | CIF Paper | C11 H24 Cl2 Cr N5 S | P c a b | 11.7; 10.878; 12.892 90; 90; 90 | 1640.8 | Bouckaert, J.; Maes, D.; Lisgarten, J. N.; Chattopadhyay, T. K.; Palmer, R. A.; Mazid, M. A.; Gazi, D. M. Structures of chromium(III) cyclam complexes. 5. Structure of <i>trans</i>-dichloro(1,4,8,11-tetraazacyclotetradecane)chromium(III) isothiocyanate Acta Crystallographica Section C, 1993, 49, 1361-1363 |
2001826 | CIF Paper | C22 H22 O | P c a b | 7.7305; 16.723; 26.668 90; 90; 90 | 3447.6 | Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Liles, D. C.; Zakaria, C. M. Structures of tribenzylmethanol and 1,2,3-triphenyl-2-propanol Acta Crystallographica Section C, 1993, 49, 820-824 |
2001927 | CIF Paper | C7 H12 N2 O2 | P c a b | 8.69; 12.134; 16.267 90; 90; 90 | 1715.3 | Streltsova, N. R.; Bel'sky, V. K.; Voloshin, Y. Z. Structures of three alicyclic α-dioximes with a ring size of six to eight Acta Crystallographica Section C, 1993, 49, 635-639 |
2003045 | CIF HKL Paper | C23 H27 Cl O2 | P c a b | 17.466; 20.537; 11.749 90; 90; 90 | 4214.4 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones Acta Crystallographica Section B, 1998, 54, 895-906 |
2003713 | CIF Paper | C23 H27 N O5 S | P c a b | 9.973; 17.101; 25.496 90; 90; 90 | 4348.3 | Peeters, O. M.; Blaton, N. M.; De Ranter, C. J. 4-(9,10-Dihydro-4<i>H</i>-benzo[4,5]cyclohepta[1,2-<i>b</i>]thien-4-ylidene)-1-methylpiperidinium Hydrogen Malate Acta Crystallographica Section C, 1995, 51, 1435-1438 |
2003720 | CIF HKL Paper | C17 H19 N5 | P c a b | 9.8098; 16.5788; 19.1759 90; 90; 90 | 3118.7 | Dupont, L.; Liégeois, J.-F.; Rogister, F.; Delarge, J. 11-(4-Methylpiperazin-1-yl)-5<i>H</i>-pyrido[4,3-<i>b</i>][1,5]benzodiazepine Acta Crystallographica Section C, 1995, 51, 1379-1381 |
2003783 | CIF Paper | C22 H24 N2 O2 | P c a b | 12.962; 13.4604; 22.2464 90; 90; 90 | 3881.4 | Blake, A. J.; Harding, M.; Sharp, J. T. 4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds Acta Crystallographica Section C, 1995, 51, 1621-1627 |
2003963 | CIF Paper | C48 H48 Cu2 N4 O10 | P c a b | 10.881; 19.772; 21.563 90; 90; 90 | 4639 | Hökelek, T.; Necefouglu, H.; Balcı, M. Tetrakis(μ-benzoato-<i>O</i>:<i>O</i>')bis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>')dicopper(II) Acta Crystallographica Section C, 1995, 51, 2020-2023 |
2004447 | CIF Paper | C12 H20 O4 | P c a b | 18.992; 10.595; 11.875 90; 90; 90 | 2389.5 | Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P. Structural Aspects of the Nucleophilic Attack of Ketone Enolate on Dehydrodihydropyran Acta Crystallographica Section C, 1996, 52, 237-244 |
2004671 | CIF Paper | C8 H9 N3 O4 | P c a b | 7.133; 13.206; 20.355 90; 90; 90 | 1917.4 | Low, J. N.; Doidge-Harrison, S. M. S. V.; Cobo, J. <i>N</i>,<i>N</i>-Dimethyl-2,4-dinitroaniline Acta Crystallographica Section C, 1996, 52, 964-966 |
2004883 | CIF Paper | C10 H31 Br2 Cr N4 O3 | P c a b | 12.049; 17.018; 17.071 90; 90; 90 | 3500.4 | Palmer, R. A.; Potter, B. S.; Tanriverdi, S.; Lisgarten, J. N.; Flint, C. D.; Gazi, D. M. Structures of Chromium(III) Cyclam Complexes. 6. <i>trans</i>-Aquahydroxy(1,4,8,11-tetraazacyclotetradecane)chromium(III) Dibromide Hydrate Acta Crystallographica Section C, 1996, 52, 1177-1180 |
2006002 | CIF Paper | C10 H20 N2 O8 | P c a b | 7.921; 11.786; 14.714 90; 90; 90 | 1374 | Babu, A. M.; Weakley, T. J. R.; Murthy, M. R. N. Extended Conformation of Putrescine Occurring on a Center of Symmetry in its 1:2 Complex with Malonic Acid Acta Crystallographica Section C, 1997, 53, 365-367 |
2006525 | CIF Paper | C16 H24 Cd Cl4 N2 | P c a b | 38.846; 7.434; 7.367 90; 90; 90 | 2127.5 | Monika Groh; Spengler, Roland; Burzlaff, Hans; Zouari, Fatma; Ben Salah, Abdelhamid (C~6~H~5~CH~2~CH~2~NH~3~)~2~[CdCl~4~] Acta Crystallographica Section C, 1997, 53, 1199-1201 |
2006897 | CIF Paper | C10 H24 Cl2 N4 O4 Zn | P c a b | 13.716; 14.969; 15.925 90; 90; 90 | 3269.6 | Lu, Tian-Huey; Panneerselvam, Kaliyamoorthy; Tung, Shu-Fang; Chi, Ta-Yung; Chung, Chung-Sun Chloro(1,4,7,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')zinc(II) Perchlorate Acta Crystallographica Section C, 1997, 53, 1780-1782 |
2006986 | CIF Paper | C16 H41 Cl3 N2 O3 W2 | P c a b | 13.705; 32.939; 11.6224 90; 90; 90 | 5246.7 | Malcolm H. Chisholm; Kirsten Folting; De-Dong Wu A Dinuclear Tungsten(III) Complex Containing a Tungsten‒Tungsten Triple Bond with an Asymmetric Arrangement of Ligands: [W~2~Cl~3~(OCMe~3~)~3~(NHMe~2~)~2~] Acta Crystallographica Section C, 1998, 54, 225-227 |
2009491 | CIF Paper | C26 H19 Cl2 Co N3 | P c a b | 14.81; 15.61; 19.757 90; 90; 90 | 4568 | Viossat, B.; Nguyen-Huy, Dung; Lehuede, J.; Vierfond, J.M. Dichloro(2,5-diphényl-3,4-di-2-pyridyl-1<i>H</i>-pyrrole-<i>N</i>,<i>N</i>')cobalt(II) Acta Crystallographica Section C, 1994, 50, 211-214 |
2009505 | CIF Paper | C18 H15 N O3 S | P c a b | 8.952; 21.979; 15.709 90; 90; 90 | 3090.8 | Hökelek, T.; Patir, S.; Gülce, A.; Okay, G. Structural investigations of 1,2,3,4-tetrahydrocarbazole derivatives. I. 2,3-Dihydro-9-(phenylsulfonyl)carbazole-4(1<i>H</i>)-one and 1,2,3,4-tetrahydrocarbazole-1-spiro-2'-[1,3]dithiolane Acta Crystallographica Section C, 1994, 50, 450-453 |
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