Crystallography Open Database
Search results
Result: there are 14989 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
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'Dalton Transactions'
COD ID  |
Links | Formula |
Space group |
Cell parameters | Cell volume  |
Bibliography |
|---|---|---|---|---|---|---|
| 7701846 | CIF | Cr Cs Li Se2 | I 4/m m m | 4.4185; 4.4185; 13.8002 90; 90; 90 | 269.42 | Sun, Xiaoning; Song, Yangpeng; Deng, Jun; Jin, Shifeng; Chen, Xiaolong New layered chromium chalcogenides CsLiCrSe2, RbLiCrS2 and CsLiCrS2: structure and properties Dalton Transactions, 2019 |
| 7708346 | CIF | C10 F4 N2 Sn | P -1 | 6.3696; 7.2222; 7.2263 117.933; 91.612; 109.045 | 271.02 | King, Rhus P.; Woodward, Madeleine; Grigg, Julian; McRobbie, Graeme; Levason, William; Reid, Gillian Tin(IV) fluoride complexes with neutral phosphine coordination and comparisons with hard N- and O-donor ligands Dalton Transactions, 2021 |
| 7709962 | CIF | C2 H6 O2 S Zn | P -1 | 4.5135; 7.7984; 7.84 89.141; 80.887; 84.09 | 271.02 | Tulewicz, Adam; Szejko, Vadim; Justyniak, Iwona; Wolska, Małgorzata; Lewinski, Janusz Exploring the reactivity of homoleptic organozincs towards SO2: Synthesis and structure of a homologous series of organozinc sulfinates Dalton Transactions, 2022 |
| 7002603 | CIF | C H3 Fe O7 P | P -1 | 5.0365; 7.64; 7.6678 97.292; 101.847; 106.38 | 271.62 | Lethbridge, Zoe A. D.; Clarkson, Guy J.; Turner, Scott S.; Walton, Richard I. Polymorphism and variable structural dimensionality in the iron(III) phosphate oxalate system: a new polymorph of 3D [Fe2(HPO4)2(C2O4)(H2O)2]·2H2O and the layered material [Fe2(HPO4)2(C2O4)(H2O)2] Dalton Transactions, 2009, 9176 |
| 7044585 | CIF | Ba2 F2 S2 | C 1 2/m 1 | 6.1014; 6.2138; 7.3925 90; 103.813; 90 | 272.17 | Driss, Dalel; Cadars, Sylvian; Deniard, Philippe; Mévellec, Jean-Yves; Corraze, Benoit; Janod, Etienne; Cario, Laurent Crystal structure and chemical bonding in the mixed anion compound BaSF Dalton Trans., 2017 |
| 7001313 | CIF | N8 O6 P6 Sr3 | P -3 | 7.29667; 7.29667; 6.02603 90; 90; 120 | 277.851 | Sedlmaier, Stefan J.; Schmedt auf der Günne, Jörn; Schnick, Wolfgang Sr3P6O6N8—a highly condensed layered phosphate Dalton Transactions, 2009, 4081-4084 |
| 7708871 | CIF | Ca2 H2 Ni O12 Se4 | P -1 | 5.2858; 7.0398; 8.418 110.413; 105.027; 91.786 | 280.962 | Huang, Xing; Zhao, Zhiying; Wang, Yanqi; Zhang, Mengsi; He, Zhangzhen Synthesis, structure and magnetic properties of two new spin-chain compounds Ca2Ni(HSeO3)2(SeO3)2 and Na2Cu(SeO3)2·2H2O Dalton Transactions, 2021 |
| 7714041 | CIF | O4 Sb Yb | P 1 21/c 1 | 7.5046; 5.2713; 7.3682 90; 98.778; 90 | 288.06 | Garg, Alka Bansal; Lopez, Sinhue; Botella Vives, Pablo; Gomis, Oscar; Bandiello, Enrico; Osman, Hussien; Popescu, Catalin; Errandonea, Daniel Exploring the crystal structure and properties of ytterbium orthoantimonate under high pressure Dalton Transactions, 2023 |
| 7701402 | CIF | H O8 S2 Tb | P 1 21 1 | 6.6503; 6.5941; 6.8024 90; 104.64; 90 | 288.62 | Netzsch, Philip; Bariss, Harijs; Bayarjargal, Lkhamsuren; Höppe, Henning A. Tb(HSO4)(SO4) ‒ a green emitting hydrogensulfate sulfate with second harmonic generation response Dalton Transactions, 2019 |
| 7714179 | CIF | Cd2 Cl2 O3 Te | P -1 | 6.4234; 6.5461; 7.9973 68.07; 68.594; 82.66 | 290.407 | Wang, Linan; Bai, Chen; Kong, Yingying; Iqbal, Maqsood; Chu, Yu; Li, Junjie Synthesis, structure and characterizations of Cd2TeO3Cl2 with unprecedented [Cd2O6Cl4] octahedral dimers Dalton Transactions, 2023 |
| 7036921 | CIF HKL | Ba1.2 Ca0.8 La Nb O6 | C 1 2/m 1 | 10.263; 5.93291; 5.93977 90; 125.275; 90 | 295.26 | Jicheng Zhu; Zhiguo Xia; Yuanyuan Zhang; Maxim S. Molokeev; Quanlin Liu Structural phase transitions and photoluminescence properties of Eu3+ doped Ca(2-x)BaxLaNbO6 phosphors Dalton Transactions, 2015, 44, 18536-18543 |
| 7713919 | CIF | B2 O17 P3 Pu | P 3 | 7.8764; 7.8764; 5.5355 90; 90; 120 | 297.4 | Sigmon, Ginger; DiBlasi, Nicole Ann; Hixon, Amy The Crystal Chemistry of Plutonium(IV) Borophosphate Dalton Transactions, 2023 |
| 7036922 | CIF HKL | Ba1.6 Ca0.4 La Nb O6 | C 1 2/m 1 | 10.3628; 5.9652; 5.9606 90; 125.34; 90 | 300.57 | Jicheng Zhu; Zhiguo Xia; Yuanyuan Zhang; Maxim S. Molokeev; Quanlin Liu Structural phase transitions and photoluminescence properties of Eu3+ doped Ca(2-x)BaxLaNbO6 phosphors Dalton Transactions, 2015, 44, 18536-18543 |
| 7002493 | CIF | C4 H6 O2 S2 | P -1 | 5.2908; 5.7842; 10.625 86.325; 89.818; 70.457 | 305.74 | Siemeling, Ulrich; Bruhn, Clemens; Bretthauer, Frauke; Borg, Marta; Träger, Frank; Vogel, Florian; Azzam, Waleed; Badin, Mihaela; Strunskus, Thomas; Wöll, Christof Photoresponsive SAMs on gold fabricated from azobenzene-functionalised asparagusic acid derivatives Dalton Transactions, 2009, 8593-8604 |
| 7000625 | CIF | C2 H6 Cd O7 | P -1 | 5.998; 6.592; 8.459 74.674; 74.278; 81.171 | 309.3 | Das, Madhab C.; Ghosh, Sujit K.; Sañudo, E. Carolina; Bharadwaj, Parimal K. Coordination polymers with pyridine-2,4,6-tricarboxylic acid and alkaline-earth/lanthanide/transition metals: synthesis and X-ray structures Dalton Transactions, 2009, 1644-1658 |
| 7001879 | CIF | C14 H12 N2 O4 | P -1 | 3.8591; 8.1105; 10.6066 73.344; 84.983; 77.881 | 310.83 | Constable, Edwin C.; Redondo, Ana Hernandez; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia Copper(i) complexes of 6,6′-disubstituted 2,2′-bipyridine dicarboxylic acids: new complexes for incorporation into copper-based dye sensitized solar cells (DSCs) Dalton Transactions, 2009, 6634-6644 |
| 7036923 | CIF HKL | Ba2 La Nb O6 | C 1 2/m 1 | 10.4771; 6.0588; 6.03093 90; 125.386; 90 | 312.11 | Jicheng Zhu; Zhiguo Xia; Yuanyuan Zhang; Maxim S. Molokeev; Quanlin Liu Structural phase transitions and photoluminescence properties of Eu3+ doped Ca(2-x)BaxLaNbO6 phosphors Dalton Transactions, 2015, 44, 18536-18543 |
| 7043829 | CIF | Cu P2 Th | I m m m | 4.0259; 5.5982; 13.863 90; 90; 90 | 312.44 | JIN, GENG BANG; Malliakas, Christos D.; Lin, Jian Thorium Copper Phosphides: More Diverse Metal‒Phosphorus and Phosphorus‒Phosphorus Interactions than U analogues Dalton Trans., 2017 |
| 7012958 | CIF | C4 H8 S Te | P 1 21/n 1 | 7.02; 5.6344; 8.009 90; 93.635; 90 | 316.15 | Hesford, Matthew J.; Levason, William; Matthews, Melissa L.; Orchard, Simon D.; Reid, Gillian Synthesis, characterisation and coordinating properties of the small ring S2Te-donor macrocycles [9]aneS2Te, [11]aneS2Te and [12]aneS2Te Dalton Transactions, 2003, 2434 |
| 7013246 | CIF | C2 H10 Cl N2 O2 P | P 1 21 1 | 4.978; 7.61; 8.391 90; 94.75; 90 | 316.78 | Vojtěch Kubíček; Pavel Vojtíšek; Jakub Rudovský; Petr Hermann; Ivan Lukeš Complexes of divalent transition metal ions with bis(aminomethyl)phosphinic acid in aqueous solution and in the solid state Dalton Trans., 2003, 3927-3938 |
| 7044318 | CIF | B Cd O4 Sc | P n m a | 9.921; 3.372; 9.469 90; 90; 90 | 316.8 | Ma, Ruru; Xu, Dongdong; Yang, Yun; Su, Xin; Lei, Bing-Hua; Yang, Zhihua; Pan, ShiLie ScMO(BO3) (M = Ca, Cd)：New Sc-based oxyborates featuring interesting edge-sharing sandwich-like chains and UV cut-off edges Dalton Trans., 2017 |
| 7043163 | CIF | B12 H18 N2 Na2 | P -3 m 1 | 7.16723; 7.16723; 7.15737 90; 90; 120 | 318.41 | Hansen, Bjarne R. S.; Tumanov, Nikolay; Santoru, Antonio; Pistidda, Claudio; Bednarcik, Jozef; Klassen, Thomas; Dornheim, Martin; Filinchuk, Yaroslav; Jensen, Torben Rene R. Synthesis, structures and thermal decomposition of ammine MxB12H12 complexes (M = Li, Na, Ca) Dalton Trans., 2017 |
| 7709746 | CIF | Cs Cu S4 | P -1 | 5.4472; 7.2597; 9.1804 105.097; 96.953; 110.347 | 319.53 | Yan, Qiu-Nan; Liu, Bin-Wen; Jiang, Xiao-Ming; Zhao, Jin-Xu; Pei, Shao-Min; Chen, Wen-Fa; Guo, Guo-Cong Photocurrent, Humidity Sensitive and Proton Conductive Properties of a New Sulfide Semiconductor CsCuS4 Dalton Transactions, 2022 |
| 7044319 | CIF | B Ca O4 Sc | P n m a | 10.283; 3.3636; 9.432 90; 90; 90 | 326.2 | Ma, Ruru; Xu, Dongdong; Yang, Yun; Su, Xin; Lei, Bing-Hua; Yang, Zhihua; Pan, ShiLie ScMO(BO3) (M = Ca, Cd)：New Sc-based oxyborates featuring interesting edge-sharing sandwich-like chains and UV cut-off edges Dalton Trans., 2017 |
| 9009748 | CIF | O3 Sb2 | P c c n | 4.8996; 12.449; 5.4103 90; 90; 90 | 330.002 | Whitten, A. E.; Dittrich, B.; Spackman, M. A.; Turner, P.; Brown, T. C. Charge density analysis of two polymorphs of antimony(III) oxide Dalton Transactions, 2004, 2004, 23-29 |
| 7043540 | CIF | Al0.17 Ge3 Ho | C m m m | 3.9484; 20.541; 4.0871 90; 90; 90 | 331.48 | Zhang, Jiliang; Liu, Yanyan; Shek, Chan Hung; Wang, Yingmin; Bobev, Svilen On the structures of the rare-earth metal germanides from the series REAl1−xGe3 (RE = Nd, Sm, Gd, Tb, Dy, Ho; 0.6 < x < 0.9). A tale of vacancies at the Al sites and the concomitant structural modulations Dalton Trans., 2017 |
| 7004732 | CIF | C H4 N5 Na O4 | P -1 | 6.4266; 7.8747; 8.18 104.663; 109.778; 110.281 | 331.67 | Klapötke, Thomas M.; Sabaté, Carles Miró; Welch, Jan M. Alkali metal 5-nitrotetrazolate salts: prospective replacements for service lead(ii) azide in explosive initiators Dalton Transactions, 2008, 6372-6380 |
| 7001320 | CIF | C4 H10 Br4 S2 Te | P 1 | 7.0419; 7.612; 7.6259 111.166; 112.45; 98.639 | 332.04 | Gurnani, Chitra; Jura, Marek; Levason, William; Ratnani, Raju; Reid, Gillian; Webster, Michael Preparation and structures of tellurium(iv) halide complexes with thioether coordination Dalton Transactions, 2009, 4122-4128 |
| 7002146 | CIF | C11 H13 N O6 Zn | P 1 | 5.9474; 7.1604; 9.0734 100.959; 107.771; 107.143 | 334.54 | Anselmo, Daniele; Escudero-Adán, Eduardo C.; Benet-Buchholz, Jordi; Kleij, Arjan W. Assembly of unusual Zn-cluster compounds based on pyridinealcohol platforms Dalton Transactions, 2009, 7368-7373 |
| 7043539 | CIF | Al0.21 Dy Ge3 | C m m m | 3.9608; 20.577; 4.1055 90; 90; 90 | 334.6 | Zhang, Jiliang; Liu, Yanyan; Shek, Chan Hung; Wang, Yingmin; Bobev, Svilen On the structures of the rare-earth metal germanides from the series REAl1−xGe3 (RE = Nd, Sm, Gd, Tb, Dy, Ho; 0.6 < x < 0.9). A tale of vacancies at the Al sites and the concomitant structural modulations Dalton Trans., 2017 |
| 7710627 | CIF | H4 N2 O6 S2 Sr | P 1 21 1 | 7.0047; 7.0574; 7.143 90; 107.246; 90 | 337.24 | Gross, Peter; Zhang, Yue; Bayarjargal, Lkhamsuren; Winkler, Bjoern; Höppe, Henning A. New Alkaline-Earth Amidosulfates and their Unexpected Decomposition to S4N4 Dalton Transactions, 2022 |
| 7708178 | CIF | B2 Eu0.98 O6 Sc1.02 | R -3 :H | 4.894; 4.894; 16.2663 90; 90; 120 | 337.402 | Kuznetsov, Artem B.; Kokh, Konstantin A.; Kaneva, Еkaterina V.; Svetlichnyi, Valery; Kononova, Nadezhda; Shevchenko, Vyacheslav; Rashchenko, Sergey V.; Kokh, Alexander E. Study of EuBO3 - ScBO3 system and EuSc3(BO3)4, EuSc(BO3)2 orthoborates Dalton Transactions, 2021 |
| 7043537 | CIF | Al0.22 Ge3 Tb | C m m m | 3.9727; 20.653; 4.1233 90; 90; 90 | 338.3 | Zhang, Jiliang; Liu, Yanyan; Shek, Chan Hung; Wang, Yingmin; Bobev, Svilen On the structures of the rare-earth metal germanides from the series REAl1−xGe3 (RE = Nd, Sm, Gd, Tb, Dy, Ho; 0.6 < x < 0.9). A tale of vacancies at the Al sites and the concomitant structural modulations Dalton Trans., 2017 |
| 7043558 | CIF | C10 H18 N8 Ni O2 | P -1 | 6.7068; 6.7518; 7.8797 75.399; 81.175; 81.118 | 338.7 | Bikbaeva, Zarina M.; Novikov, Alexander S.; Suslonov, Vitalii V.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu. Metal-mediated Reactions between Dialkylcyanamides and Acetamidoxime Generate Unusual (Nitrosoguanidinate)Nickel(II) Complexes Dalton Trans., 2017 |
| 7001616 | CIF | Ba O8 P2 Sn | C 1 2/m 1 | 8.214; 5.2456; 7.8938 90; 94.561; 90 | 339.05 | Zhao, Dan; Zhang, Hao; Xie, Zhi; Zhang, Wei-Long; Yang, Song-Ling; Cheng, Wen-Dan Syntheses, crystal and electronic structures of compounds AM(PO4)2 (A = Sr, M = Ti, Sn; A = Ba, M = Sn) Dalton Transactions, 2009, 5310-5318 |
| 7044307 | CIF | C3 H K N4 O5 | P -1 | 6.8618; 7.1833; 7.7371 84.776; 82.401; 64.52 | 341 | Yan, Chao; Wang, Kangcai; Liu, Tianlin; Yang, Hongwei; cheng, guangbing; Zhang, Qinghua Exploiting the Energetic Potential of 1,2,4-Oxadiazole Derivatives: Combining the Benefits of 1,2,4-Oxadiazole Framework with Various Energetic Functionalities Dalton Trans., 2017 |
| 7043830 | CIF | Cu2 P2 Th | P n m a | 8.9882; 3.8726; 9.8376 90; 90; 90 | 342.42 | JIN, GENG BANG; Malliakas, Christos D.; Lin, Jian Thorium Copper Phosphides: More Diverse Metal‒Phosphorus and Phosphorus‒Phosphorus Interactions than U analogues Dalton Trans., 2017 |
| 7710632 | CIF | H4 N2 O6 S2 Sr | P 1 c 1 | 7.005; 7.043; 7.2915 90; 107.787; 90 | 342.539 | Gross, Peter; Zhang, Yue; Bayarjargal, Lkhamsuren; Winkler, Bjoern; Höppe, Henning A. New Alkaline-Earth Amidosulfates and their Unexpected Decomposition to S4N4 Dalton Transactions, 2022 |
| 7000350 | CIF | C H4 N8 O4 | P 1 c 1 | 4.6283; 9.458; 9.0071 90; 119.343; 90 | 343.7 | Klapötke, Thomas M.; Stierstorfer, Jörg Azidoformamidinium and 5-aminotetrazolium dinitramide—two highly energetic isomers with a balanced oxygen content Dalton Transactions, 2009 |
| 7043535 | CIF | Al0.26 Gd Ge3 | C m m m | 4.0031; 20.739; 4.1624 90; 90; 90 | 345.56 | Zhang, Jiliang; Liu, Yanyan; Shek, Chan Hung; Wang, Yingmin; Bobev, Svilen On the structures of the rare-earth metal germanides from the series REAl1−xGe3 (RE = Nd, Sm, Gd, Tb, Dy, Ho; 0.6 < x < 0.9). A tale of vacancies at the Al sites and the concomitant structural modulations Dalton Trans., 2017 |
| 7003314 | CIF | C8 H6 Mn0.5 N O2 | P -1 | 4.935; 8.1072; 9.5198 70.435; 79.56; 76.137 | 346.3 | Mondal, Kartik Chandra; Sengupta, Oindrila; Nethaji, Munirathinam; Mukherjee, Partha Sarathi Assembling metals (CoII and MnII) with pyridylcarboxylates in the presence of azide: synthesis, structural aspects and magnetic behavior of three coordination polymers Dalton Transactions, 2008, 767-775 |
| 7000956 | CIF | C4 H10 Ag2 Cl2 N4 O10 | P -1 | 6.7481; 7.9981; 8.1382 65.302; 65.663; 66.151 | 349 | Gural'skiy, Il'ya A.; Escudero, Daniel; Frontera, Antonio; Solntsev, Pavlo V.; Rusanov, Eduard B.; Chernega, Alexander N.; Krautscheid, Harald; Domasevitch, Konstantin V. 1,2,4,5-Tetrazine: an unprecedented μ4-coordination that enhances ability for anion⋯π interactions Dalton Transactions, 2009, 2856-2864 |
| 7013360 | CIF | C3 H12 Ga P | P 1 21/m 1 | 5.8848; 9.212; 7.0781 90; 113.879; 90 | 350.86 | Tang, Christina Y.; Coxall, Robert A.; Downs, Anthony J.; Greene, Tim M.; Kettle, Lorna; Parsons, Simon; Rankin, David W. H.; Robertson, Heather E.; Turner, Andrew R. Molecular structure of trimethylphosphine?gallane, Me3P�GaH3: gas-phase electron diffraction, single-crystal X-ray diffraction, and quantum chemical studiesElectronic supplementary information (ESI) available: Cartesian coordinates and least squares correlation matrix for Me3P�GaH3. See http://www.rsc.org/suppdata/dt/b3/b306736j/ Dalton Transactions, 2003, 3526 |
| 7001236 | CIF | Fe1.5 H2 O5 P | I 41/a m d :2 | 5.2061; 5.2061; 12.9609 90; 90; 90 | 351.29 | Redrup, Kate V.; Weller, Mark T. Synthesis and crystal structures of iron hydrogen phosphates Dalton Transactions, 2009, 3786-3792 |
| 7003098 | CIF | C12 H8 Cu2 Fe N8 | P -1 | 6.8434; 7.7006; 7.7696 109.077; 108.194; 99.021 | 352 | Agustí, Gloria; Thompson, Amber L.; Gaspar, Ana B.; Muñoz, M. Carmen; Goeta, Andrés E.; Rodríguez-Velamazán, José Alberto; Castro, Miguel; Burriel, Ramón; Real, José Antonio Thermal, pressure and light induced spin transition in the two-dimensional coordination polymer {Fe(pmd)2[Cu(CN)2]2} Dalton Transactions, 2008, 642-649 |
| 7043541 | CIF | Al0.28 Ge3 Sm | C m m m | 4.04; 20.88; 4.21 90; 90; 90 | 355.1 | Zhang, Jiliang; Liu, Yanyan; Shek, Chan Hung; Wang, Yingmin; Bobev, Svilen On the structures of the rare-earth metal germanides from the series REAl1−xGe3 (RE = Nd, Sm, Gd, Tb, Dy, Ho; 0.6 < x < 0.9). A tale of vacancies at the Al sites and the concomitant structural modulations Dalton Trans., 2017 |
| 7712410 | CIF | Fe4 O5 | C m c m | 2.8906; 9.8024; 12.5804 90; 90; 90 | 356.46 | Ovsyannikov, Sergey; Kar'kin, Alexander Evgenievitch; Korobeinikov, Igor; Morozova, Natalia Vladimirovna; Bykov, Maxim; Bykova, Elena; Wilhelm, Fabrice; Rogalev, Andrei; Dubrovinsky, Leonid Electronic properties of single-crystalline Fe4O5 Dalton Transactions, 2023 |
| 7001185 | CIF | C2 H7 Gd O8 S | P -1 | 6.7281; 6.8746; 8.6645 109.685; 90.758; 107.504 | 356.93 | Liu, Hsiao-Chan; Chen, I-Han; Huang, Anny; Huang, Sin-Chiang; Hsu, Kuei-Fang Five related metal‒organic frameworks constructed from [Ln2(SO4)2(H2O)n]2+ units and oxalate or acetate ligands Dalton Transactions, 2009, 3447-3456 |
| 7713316 | CIF | K3 Nb O8 | I -4 2 m | 6.785; 6.785; 7.7718 90; 90; 90 | 357.78 | Talukdar, Hiya; Gogoi, Sandhya Rani; Sultana, Sazida Yasmin; Begum, Reshma; Dowerah, Dikshita; Sarma, Bipul; Islam, Nashreen S. Oxido- and Mixed-Ligand Peroxido Complexes of Niobium(V) as Potent Phosphatase Inhibitors and Efficient Catalysts for Eco-Friendly Styrene Epoxidation Dalton Transactions, 2023 |
| 7046372 | CIF | C2 H6 Mg | I b a m | 5.8233; 11.3102; 5.4324 90; 90; 90 | 357.79 | Stuhl, Christoph; Anwander, Reiner Dimethylmagnesium revisited Dalton Transactions, 2018 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!