Crystallography Open Database
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Result: there are 189 entries in the selection
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Searching journal of publication like 'IUCrData' volume of publication is 3
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
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1550336 | CIF HKL Paper | C9 H11 N O3 | P 1 | 4.8011; 6.5522; 7.5052 93.618; 107.044; 95.658 | 223.575 | Baillargeon, Pierre; Rahem, Tarik; Amigo, Carl; Fortin, Daniel; Dory, Yves L. Polar crystal of vanillylformamide through replacement of the alkene by an isosteric formamide group IUCrData, 2018, 3, x181630 |
1550295 | CIF HKL Paper | Ca2 Cl2 Cu O2 | I 4/m m m | 3.868; 3.868; 15.0321 90; 90; 90 | 224.9 | Baptiste, Benoît; Azuma, Masaki; Yu, Runze; Giura, Paola; d'Astuto, Matteo Ca2CuO2Cl2, a redetermination from single-crystal X-ray diffraction data IUCrData, 2018, 3 |
1549176 | CIF HKL Paper | C6 H6 N4 O | P -1 | 3.8342; 5.5701; 15.0346 93.396; 92.812; 92.361 | 319.83 | El Hafi, Mohamed; Lahmidi, Sanae; Boulhaoua, Mohammed; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-Methyl-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-4(5<i>H</i>)-one IUCrData, 2018, 3, x180483 |
1548728 | CIF HKL Paper | C7 H5 N O3 | P 1 21 1 | 3.7363; 7.0071; 12.5877 90; 94.8144; 90 | 328.39 | Engwerda, Antonius H.J.; Brugman, Sander J.T.; Tinnemans, Paul; Vlieg, Elias 3-Nitrobenzaldehyde IUCrData, 2018, 3, x180092 |
1549780 | CIF HKL Paper | H4 N O3 V | P b c m | 4.9045; 11.7945; 5.8231 90; 90; 90 | 336.84 | Pérez-Benítez, Aarón; Bernès, Sylvain Redetermination of ammonium metavanadate IUCrData, 2018, 3 |
1548675 | CIF HKL Paper | C7 H3 Br2 N | P 1 21/m 1 | 4.0047; 13.2585; 7.3356 90; 97.44; 90 | 386.21 | Noland, Wayland E.; Tritch, Kenneth J. 3,5-Dibromobenzonitrile IUCrData, 2018, 3, x180059 |
1548931 | CIF HKL Paper | Al10 Fe0.83 Ni3 | P 63/m m c | 7.6981; 7.6981; 7.6231 90; 90; 120 | 391.227 | Wang, Sai; Liu, Cong; Fan, Changzeng Al~10~Ni~3~Fe~0.83~, an Fe-depleted phase in the Al‒Ni‒Fe system IUCrData, 2018, 3, x180237 |
1549359 | CIF HKL Paper | Br F4 K | I 4/m c m | 6.0999; 6.0999; 11.0509 90; 90; 90 | 411.19 | Ivlev, Sergei I.; Kraus, Florian Redetermination of the crystal structure of K[BrF4] from single-crystal X-ray diffraction data IUCrData, 2018, 3 |
1548676 | CIF HKL Paper | C7 H2 Br2 Cl N | P 1 21/m 1 | 4.7215; 10.0181; 8.7689 90; 93.023; 90 | 414.2 | Noland, Wayland E.; Tritch, Kenneth J. 2,6-Dibromo-4-chlorophenyl isocyanide IUCrData, 2018, 3, x171819 |
1548892 | CIF HKL Paper | Al4 Cr | C 1 m 1 | 5.1574; 17.413; 5.1107 90; 100.357; 90 | 451.49 | Fan, Changzeng; Liu, Cong Crystal structure of ω-Al~4~Cr IUCrData, 2018, 3, x180216 |
1548681 | CIF HKL Paper | C8 H7 Br Cl N O2 | P -1 | 4.6637; 9.4598; 11.9898 111.639; 101.035; 93.712 | 477.25 | El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alshammari, Mohammed B.; Kariuki, Benson M. Methyl <i>N</i>-(2-bromo-4-chlorophenyl)carbamate IUCrData, 2018, 3, x180054 |
1549412 | CIF HKL Paper | C18 H16 Cu Na2 O16 | P -1 | 6.9048; 7.0555; 11.8449 105.071; 93.073; 109.955 | 517.26 | Yang, Annabeth P.; LaDuca, Robert L. Poly[diaquabis(μ-hydrogen benzene-1,2,4-tricarboxylato)copper(II)disodium]: a novel 4,5,6-connected trinodal net IUCrData, 2018, 3, x180676 |
1549129 | CIF HKL Paper | C2 H6 Ni O6 | P 1 21/c 1 | 8.5806; 7.0202; 9.2257 90; 97.551; 90 | 550.91 | Weil, Matthias Redetermination of nickel(II) formate dihydrate IUCrData, 2018, 3, x180428 |
1549351 | CIF HKL Paper | C12 H14 N2 O3 | P -1 | 4.8082; 8.26; 14.413 84.072; 81.473; 85.14 | 561.7 | Abad, Nadeem; Sebhaoui, Jihad; El Bakri, Youness; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetate IUCrData, 2018, 3, x180596 |
1550129 | CIF HKL Paper | C12 H8 Br2 N2 O | P 1 21/n 1 | 3.8938; 5.8223; 25.8645 90; 92.044; 90 | 586 | Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim (<i>Z</i>)-1,2-Bis(3-bromophenyl)diazene 1-oxide IUCrData, 2018, 3, x181486 |
1550217 | CIF HKL Paper | C16 H14 O2 | P 1 21 1 | 10.1497; 5.1276; 11.6896 90; 99.541; 90 | 599.95 | Detert, Heiner; Schollmeyer, Dieter The <i>rel-R</i>,<i>R</i>-enantiomer of 7-[7-hydroxybicyclo[4.2.0]octa-1(6),2,4-trien-7-yl]bicyclo[4.2.0]octa-1(6),2,4-trien-7-ol IUCrData, 2018, 3, x181550 |
1550276 | CIF HKL Paper | C2 H10 N4 O8 S4 | P -1 | 5.1371; 9.5237; 12.9884 106.521; 96.067; 95.618 | 600.32 | Zouihri, Hafid; El Korchi, Khadija; Yamni, Khalid; Tijani, Najib Dithiobis(formamidinium) bis(hydrogen sulfate) IUCrData, 2018, 3, x181540 |
1549019 | CIF HKL Paper | C10 H10 N2 O4 S2 | P 21 21 2 | 11.232; 12.283; 4.401 90; 90; 90 | 607.2 | Lynch, Will; Padgett, Clifford W. 2,2′-Disulfanediylbis(pyridine N-oxide)‒hydrogen peroxide (1/1) IUCrData, 2018, 3 |
1549125 | CIF HKL Paper | C16 H12 N2 O | P -1 | 4.0205; 11.316; 13.781 85.067; 88.517; 84.335 | 621.5 | Umezono, Satoru; Okuno, Tsunehisa 5-[Phenyl(pyridin-4-yl)amino]penta-2,4-diyn-1-ol IUCrData, 2018, 3, x180454 |
1549130 | CIF HKL Paper | C6 H5 F N2 O2 | P 1 21/n 1 | 12.1967; 3.7559; 14.4539 90; 102.143; 90 | 647.31 | Moorthy, K.; NizamMohideen, M.; Vetrivel, S.; Vinoth, E.; Arun, A. 2-Fluoro-5-nitroaniline IUCrData, 2018, 3, x180425 |
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