Crystallography Open Database
Search results
Result: there are 119 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 1 2/a 1'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1000191 | CIF | Ag0.5 Cr0.5 P S3 | P 1 2/a 1 | 5.892; 10.632; 6.745 90; 105.88; 90 | 406.4 | Colombet, P; Leblanc, A; Danot, M; Rouxel, J Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~ Nouveau Journal de Chimie, 1983, 7, 333-338 |
1000192 | CIF | Ag0.5 Cr0.5 P S3 | P 1 2/a 1 | 5.892; 10.632; 6.745 90; 105.88; 90 | 406.4 | Colombet, P; Leblanc, A; Danot, M; Rouxel, J Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~ Nouveau Journal de Chimie, 1983, 7, 333-338 |
1007013 | CIF | Al H5 N O10 P3 | P 1 2/a 1 | 11.643; 4.918; 8.705 90; 119.27; 90 | 434.8 | Averbuch-Pouchot, M T; Durif, A; Guitel, J C Structure cristalline d'un tripolyphosphate acide d'aluminium-ammonium: Al (N H~4~) H P~3~ O~10~ Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1436-1438 |
1516248 | CIF | C39 H59 Au2 Br O2 P2 | P 1 2/a 1 | 17.211; 12.442; 22.955 90; 105.75; 90 | 4731 | Wing-Wah Yam, Vivian; Cheung, Kai-Leung; Yip, Sung-Kong; Zhu, Nianyong Synthesis, characterisation, electrochemistry and luminescence studies of 9-anthrylgold(I) complexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 149-153 |
1524100 | CIF | In Nb O4 | P 1 2/a 1 | 5.144; 5.7709; 4.8355 90; 91.13; 90 | 143.516 | Brixner, L.H.; Chen, H.-Y. On the structural and luminescent properties of the In Ta(1-x) Nb(x) O4 system Materials Research Bulletin, 1980, 15, 607-612 |
1524297 | CIF | Al Li O10 Si4 | P 1 2/a 1 | 11.754; 5.1395; 7.6296 90; 113.04; 90 | 424.136 | Effenberger, H. Petalit, Li Al Si4 O10: Verfeinerung der Kristallstruktur, Diskussion der Raumgruppe und Infrarot-Messung TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-), 1980, 27, 129-142 |
1524917 | CIF | Al1.1 B8 Ca5.24 Fe0.9 H8 La2.62 O48 Si8 Y2.62 | P 1 2/a 1 | 18.99; 4.715; 10.3 90; 111.4; 90 | 858.657 | Mellini, M.; Merlino, S. Hellandite: a new type of silicoborate chain American Mineralogist, 1977, 62, 89-99 |
1528201 | CIF | Co4 H38 N12 O30 S5 | P 1 2/a 1 | 14.122; 9.858; 18.81 90; 139.4; 90 | 1704.14 | Wieghardt, K.; Maas, G. Die Molekuel- und Kristallstruktur von Di-mue-sulfato-mue-hydroxo-bis(triammincobalt(III))-sul at 8-Hydrat Zeitschrift fuer Anorganische und Allgemeine Chemie, 1971, 385, 289-296 |
1530793 | CIF | Mg2 Na3 O16 P5 | P 1 2/a 1 | 18.617; 6.844; 5.174 90; 90.15; 90 | 659.242 | Smolin, Yu.I.; Shepelev, Yu.F.; Domanskii, A.I.; Majling, J. A new type of phosphate radical P5 O16 in the Na3 Mg2 P5 O16 crystal Kristallografiya, 1978, 23, 1264-1266 |
1530904 | CIF | Lu O4 Ta | P 1 2/a 1 | 5.24; 5.424; 5.062 90; 96.08; 90 | 143.062 | Trunov, V.K.; Kinzhibalo, L.N.; Efremov, V.A.; Krongauz, V.G. On the m' - structure of 'orthotantalates' of the rare earth elements Doklady Akademii Nauk SSSR, 1981, 260, 103-106 |
1530905 | CIF | Er O4 Ta | P 1 2/a 1 | 5.29; 5.443; 5.103 90; 96.44; 90 | 146.006 | Trunov, V.K.; Kinzhibalo, L.N.; Efremov, V.A.; Krongauz, V.G. On the m' - structure of 'orthotantalates' of the rare earth elements Doklady Akademii Nauk SSSR, 1981, 260, 103-106 |
1530906 | CIF | Dy O4 Ta | P 1 2/a 1 | 5.319; 5.472; 5.131 90; 96.58; 90 | 148.357 | Trunov, V.K.; Krongauz, V.G.; Kinzhibalo, L.N.; Efremov, V.A. On the m' - structure of the 'orthotantalates' of the rare-earth elements Doklady Akademii Nauk SSSR, 1981, 260, 103-106 |
1530907 | CIF | Gd O4 Ta | P 1 2/a 1 | 5.356; 5.506; 5.168 90; 96.69; 90 | 151.367 | Trunov, V.K.; Krongauz, V.G.; Efremov, V.A.; Kinzhibalo, L.N. On the m' - structure of the 'orthotantalates' of the rare-earth elements Doklady Akademii Nauk SSSR, 1981, 260, 103-106 |
1530908 | CIF | O4 Ta Y | P 1 2/a 1 | 5.302; 5.454; 5.115 90; 96.46; 90 | 146.972 | Trunov, V.K.; Efremov, V.A.; Kinzhibalo, L.N.; Krongauz, V.G. On the m' - structure of the 'orthotantalates' of the rare-earth elements Doklady Akademii Nauk SSSR, 1981, 260, 103-106 |
1531309 | CIF | Al0.5 B3.99 Be1.18 Ca4.37 Ce1.46 F0.53 Fe0.38 H0.43 Li0.02 Mg0.03 O23.47 Si3.98 Th0.17 Ti0.07 | P 1 2/a 1 | 19.032; 4.746; 10.248 90; 110.97; 90 | 864.351 | della Ventura, G.; Bonazzi, P.; Oberti, R.; Ottolini, L. Ciprianiite and Mottanaite-(Ce), two new minerals of the Hellandite group from Latium (Italy) American Mineralogist, 2002, 87, 739-744 |
1531310 | CIF | Al0.48 B4 Be0.82 Ca4.6 Ce0.74 F0.49 Fe0.4 H0.54 Li0.04 Mg0.05 O23.51 Si4 Th0.66 Ti0.1 | P 1 2/a 1 | 19.059; 4.729; 10.291 90; 111.33; 90 | 863.993 | della Ventura, G.; Bonazzi, P.; Oberti, R.; Ottolini, L. Ciprianiite and Mottanaite-(Ce), two new minerals of the Hellandite group from Latium (Italy) American Mineralogist, 2002, 87, 739-744 |
1534277 | CIF | Mo8.5 O29 W1.5 | P 1 2/a 1 | 17; 4; 17.5 90; 111; 90 | 1110.96 | Blomberg, B.; Magneli, A.; Kihlborg, L. The crystal structures of (Mo, W)10 O29 And (Mo, W)11 O32 Arkiv foer Kemi, 1953, 6, 133-138 |
1534278 | CIF | Mo9.35 O32 W1.65 | P 1 2/a 1 | 16.6; 4; 18.7 90; 74; 90 | 1193.58 | Blomberg, B.; Kihlborg, L.; Magneli, A. The crystal structures of (Mo, W)10 O29 And (Mo, W)11 O32 Arkiv foer Kemi, 1953, 6, 133-138 |
1534890 | CIF | Mo9 O26 | P 1 2/a 1 | 16.75; 4.03; 14.45 90; 96; 90 | 970.068 | Magneli, A. The crystal structures of Mo9 O26 (beta'-molybdenum oxide ) and Mo8 O23 (beta-molybdenum oxide) Acta Chemica Scandinavica (1-27,1973-42,1988), 1948, 2, 501-517 |
1535553 | CIF | O4 Ta Y | P 1 2/a 1 | 5.298; 5.451; 5.111 90; 96.45; 90 | 146.668 | Brixner, L.H.; Chen, H.-Y. On the structural and luminescent properties of the M' Ln Ta O4 Rare Earth tantalates Journal of the Electrochemical Society, 1983, 130, 2435-2443 |
1536725 | CIF | Mo6.48 O25 W2.52 | P 1 2/a 1 | 50.64; 5.439; 6.701 90; 32.64; 90 | 995.475 | Portemer, F.; Figlarz, M.; Kihlborg, L.; Sundberg, M.R. Homologues of Mo4 O11 (mon) in the Mo-W-O system prepared by soft chemistry Journal of Solid State Chemistry, 1993, 103, 403-414 |
1542093 | CIF | C3 Cr K3 N3 O4 | P 1 2/a 1 | 11.526; 7.628; 12.108 90; 111.12; 90 | 993.032 | Stomberg, R. The crystal structure of potassiumdiperoxotricyanochromate(IV), K3 (Cr (O2)2 (C N)3) Arkiv foer Kemi, 1965, 23, 401-430 |
1544614 | CIF | E1.19 Nb0.39 O4 R Ta0.58 Ti0.02 Y0.81 | P 1 2/a 1 | 5.292; 5.452; 5.1149 90; 95.89; 90 | 146.8 | Hori, H.; Kobayashi, T.; Miyawaki, R.; Matsubara, S.; Yokoyama, K.; Shimizu, M. Iwashiroite-(Y), YTaO3, a new mineral from Suishoyama, Kawamata town, Fukushima Prefecture, Japan Journal of Mineralogical and Petrological Sciences, 2006, 101, 170-177 |
1550016 | CIF | Al O4 P | P 1 2/a 1 | 8.7802; 4.9087; 10.9191 90; 90.33; 90 | 470.599 | Kanzaki, M. Temperature-induced phase transition of AlPO4-moganite studies by in-situ Raman spectroscopy : alpha phase model optimized by DFT Journal of Mineralogical and Petrological Sciences, 2018, 113, 126-134 |
2001554 | CIF Paper | C14 H13 N O2 | P 1 2/a 1 | 12.248; 8.637; 10.934 90; 92.25; 90 | 1155.8 | Yeap, G.-Y.; Teo, S.-B.; Fun, H.-K.; Teoh, S.-G. Structure of 4-[(3-methoxyphenylimino)methyl]phenol Acta Crystallographica Section C, 1993, 49, 1396-1398 |
2002235 | CIF | Fe Nb O4 | P 1 2/a 1 | 4.992; 5.607; 4.637 90; 90.06; 90 | 129.8 | Harder, M; Mueller-Buschbaum, Hk Fe Nb O4. Untersuchungen an Einkristallen mit Wolframit-und Al Nb O4- Struktur Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 456, 99-105 |
2004068 | CIF Paper | C17 H29 N O4 S3 | P 1 2/a 1 | 10.664; 9.829; 20.058 90; 105.315; 90 | 2027.7 | Ng, S. W. Bis(dicyclohexylammonium) Trithiocarbodiglycolate Trithiocarbodiglycolic Acid Acta Crystallographica Section C, 1995, 51, 2150-2152 |
2007716 | CIF Paper | C10 H16 O3 S | P 1 2/a 1 | 10.5933; 8.8517; 11.3495 90; 91.606; 90 | 1063.81 | Muir, Kenneth W.; Rodger, Colin S.; Morris, David G.; Ryder, Karl S. A Sultone Derived from Racemic Camphene Acta Crystallographica Section C, 1998, 54, 1546-1548 |
2009664 | CIF Paper | C22 H34 | P 1 2/a 1 | 14.742; 9.078; 15.162 90; 118.9; 90 | 1776.4 | Spek, Anthony L.; Timmermans, Petrus J. J. A.; Mackor, Adri <i>trans</i>-<i>transoid</i>-<i>trans</i>-<i>transoid</i>-<i>trans</i>-Tetracyclo[16.4.0.0^2,9^.0^10,17^]docosa-5,13-diene Acta Crystallographica Section C, 1994, 50, 744-746 |
2012773 | CIF HKL Paper | C14 H10 Cd O6 | P 1 2/a 1 | 7.307; 6.453; 14.423 90; 101.83; 90 | 665.6 | Hu, Mao-Lin; Gao, Peng; Ng, Seik Weng Aqua(4,4'-oxydibenzoato-κ<i>O</i>)cadmium(II) Acta Crystallographica Section C, 2002, 58, m323-m324 |
2101832 | CIF HKL Paper | C21 H28 N2 O2 | P 1 2/a 1 | 11.385; 6.5565; 13.076 90; 96.24; 90 | 970.3 | Ferguson, George Crystal Engineering Using Bisphenols. Chains, Ladders and Sheets Formed by the Adducts of 1,4-Diazabicyclo[2.2.2]octane with Bisphenols: Structures of Adducts with 4,4'-Isopropylidenediphenol (1/1), 4,4'-Oxodiphenol (1/1) and 4,4'-Thiodiphenol (1/1 and 2/1) Acta Crystallographica Section B, 1997, 53, 513-520 |
2107345 | CIF | Li1.16 Mg38.63 O124 Sc3.1 Si40.07 | P 1 2/a 1 | 9.429; 8.748; 27.038 90; 93.25; 90 | 2226.64 | Takeuchi, Y.; Ito, J.; Kudoh, Y. New Series of Superstructures Based on Clinopyroxene. I. The Structure of the 'Enstatite-IV' Series, (Mg(x-12)/3 Sc4) (Li4/3 Si(x-4)/3) Ox, with x = 100, 112 or 124 Acta Crystallographica B (39,1983-), 1984, 40, 115-125 |
2107346 | CIF | Li1.33 Mg28.4 O100 Sc4.62 Si32 | P 1 2/a 1 | 9.429; 8.741; 21.808 90; 91.2; 90 | 1797 | Takeuchi, Y.; Kudoh, Y.; Ito, J. New Series of Superstructures Based on Clinopyroxene. I. The Structure of the 'Enstatite-IV' Series, (Mg(x-12)/3 Sc4) (Li4/3 Si(x-4)/3) Ox, with x = 100, 112 or 124 Acta Crystallographica B (39,1983-), 1984, 40, 115-125 |
2108790 | CIF HKL | C3 H17 Al N2 O14 S2 | P 1 2/a 1 | 12.0026; 6.7859; 9.1005 90; 88.835; 90 | 741.07 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
2205301 | CIF HKL Paper | C16 H10 N4 O2 | P 1 2/a 1 | 16.097; 3.7144; 21.725 90; 110.758; 90 | 1214.6 | Imoda, Tomohiko; Hirota, Tsuyoshi; Takahashi, Hiroo; Mizuguchi, Jin 3,6-Di-2-pyridylpyrrolo[3,4-<i>c</i>]pyrrole-1,4(2<i>H</i>,5<i>H</i>)-dione Acta Crystallographica Section E, 2005, 61, o616-o618 |
2206159 | CIF HKL Paper | C16 H12 Br N4 O3.5 | P 1 2/a 1 | 16.547; 6.053; 16.924 90; 111.93; 90 | 1572.4 | Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng 5-Bromo-1<i>H</i>-indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate Acta Crystallographica Section E, 2005, 61, o2308-o2309 |
2311064 | CIF | Mo5.5 O32 W5.5 | P 1 2/a 1 | 16.59999; 4; 18.7 90; 74; 90 | 1193.58 | Magneli, A. Structures of the Re O3 - type with Recurrent Dislocations of Atoms: 'Homologous Series' of Molybdenum and Tungsten Oxides Acta Crystallographica (1,1948-23,1967), 1953, 6, 495-500 |
2311067 | CIF | Mo5 O29 W5 | P 1 2/a 1 | 17; 4; 17.5 90; 111; 90 | 1110.96 | Magneli, A. Structures of the Re O3 - type with recurrent dislocations of atoms: 'homologous series' of molybdenum and tungsten oxides Acta Crystallographica (1,1948-23,1967), 1953, 6, 495-500 |
3000295 | CIF | Ag Cr P2 S6 | P 1 2/a 1 | 5.88318; 10.6214; 6.745 90; 106.043; 90 | 405.07 | Selter, Sebastian; Shemerliuk, Yuliia; Buechner, Bernd; Aswartham, Saicharan Crystal Growth of the Quasi-2D Quarternary Compound Ag Cr P2 S6 by Chemical Vapor Transport Crystals, 2021, 11, 500 |
4023793 | CIF | C24 H18 Ag F6 N6 P | P 1 2/a 1 | 12.484; 7.148; 27.263 90; 96.14; 90 | 2418.8 | Yajun Ma; Siping Wei; Jingbo Lan; Jingzhi Wang; Rugang Xie; Jingsong You Pyrido[1,2-a][1,2,4]triazol-3-ylidenes as a New Family of Stable Annulated N-Heterocyclic Carbenes: Synthesis, Reactivity, and Their Application in Coordination Chemistry and Organocatalysis Journal of Organic Chemistry, 2008, 73, 8256-8264 |
4030742 | CIF | C4 H4 Ce Li O10 | P 1 2/a 1 | 9.39; 7.678; 12.992 90; 104.12; 90 | 908.38 | Romero, S.; Mosset, A.; Trombe, J.-C. Synthesis, characterization and structure of two new families of mixed oxalates; [M(Ln(H2O)n](C2O4).H2O with M = Li, Ln = La...Gd, n=1 or M = Na, Ln = Ce...Nd, n = 2 European Journal of Solid State and Inorganic Chemistry, 1995, 32, 1053-1063 |
4030743 | CIF | C4 H6 Ce Na O11 | P 1 2/a 1 | 10.066; 7.614; 13.139 90; 102.12; 90 | 984.56 | Romero, S.; Mosset, A.; Trombe, J.-C. Synthesis, characterization and structure of two new families of mixed oxalates; [M(Ln(H2O)n](C2O4).H2O with M = Li, Ln = La...Gd, n=1 or M = Na, Ln = Ce...Nd, n = 2 European Journal of Solid State and Inorganic Chemistry, 1995, 32, 1053-1063 |
4068875 | CIF | C27 H36 N2 O2 Si W | P 1 2/a 1 | 17.6549; 8.69; 17.7595 90; 104.716; 90 | 2635.3 | Suzuki, Eiji; Komuro, Takashi; Okazaki, Masaaki; Tobita, Hiromi Synthesis and Characterization of DMAP-Stabilized Aryl(silylene) Complexes and (Arylsilyl)(DMAP) Complexes of Tungsten: Mechanistic Study on the Interconversion between These Complexes via 1,2-Aryl Migration Organometallics, 2009, 28, 1791 |
4070456 | CIF | C16 H24 Cl2 N3 P Pd S | P 1 2/a 1 | 13.41; 13.946; 23.514 90; 102.98; 90 | 4285.1 | Schuster, Elaine M.; Botoshansky, Mark; Gandelman, Mark Versatile, Selective, and Switchable Coordination Modes of Pincer Click Ligands Organometallics, 2009, 28, 7001 |
4073211 | CIF | C10 H10 F V | P 1 2/a 1 | 9.7874; 6.3569; 14.2795 90; 105.868; 90 | 854.58 | Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D. SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes# Organometallics, 2007, 26, 2872 |
4076530 | CIF | C19 H31 B Cl N4 O Si | P 1 2/a 1 | 12.7787; 10.0476; 18.6854 90; 108.326; 90 | 2277.44 | Cade, Ian A.; Hill, Anthony F. 1,1-Bis(N-methylimidazole)-2-(trimethylsilyl)-1-boracyclohexa-1,4-diene Chloride: A Stable Intermediate or Tangent en Route to 1-(N-Methylimidazole)borabenzene? Organometallics, 2012, 31, 2112 |
4111482 | CIF | C68 H83 N4 O4.5 S2 Zn2 | P 1 2/a 1 | 24.4623; 12.9181; 24.3219 90; 118.462; 90 | 6756.9 | Bun Yeoul Lee; Heon Yong Kwon; Su Yeon Lee; Sung Jae Na; Song-i Han; Hoseop Yun; Hyosun Lee; Young-Whan Park Bimetallic Anilido-Aldimine Zinc Complexes for Epoxide/CO2 Copolymerization Journal of the American Chemical Society, 2005, 127, 3031-3037 |
4111985 | CIF | C36 H40 | P 1 2/a 1 | 18.161; 7.3428; 22.132 90; 113.698; 90 | 2702.5 | Matthijs K. J. ter Wiel; Richard A. van Delden; Auke Meetsma; Ben L. Feringa Light-Driven Molecular Motors: Stepwise Thermal Helix Inversion during Unidirectional Rotation of Sterically Overcrowded Biphenanthrylidenes Journal of the American Chemical Society, 2005, 127, 14208-14222 |
4112209 | CIF | C20 H29 N O2 | P 1 2/a 1 | 10.8715; 4.8081; 34.691 90; 91.415; 90 | 1812.79 | Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society, 2004, 126, 1764-1771 |
4112210 | CIF | C21 H31 N O2 | P 1 2/a 1 | 10.8779; 4.7946; 36.692 90; 94.818; 90 | 1906.9 | Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society, 2004, 126, 1764-1771 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!