Crystallography Open Database
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Result: there are 24 entries in the selection
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Searching journal of publication like 'Journal of applied crystallography' volume of publication is 58
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
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| 2300745 | CIF Paper | C10 H13 Br N2 S | P 1 21/n 1 | 7.9876; 8.2176; 17.125 90; 91.141; 90 | 1123.84 | Rohlíček, Jan; Eigner, Václav; Czernek, Jiří; Brus, Jiří An advanced approach combining solid-state NMR with powder diffraction applied to newly synthesized iso-thio-uronium salts. Journal of applied crystallography, 2025, 58, 321-332 |
| 2300746 | CIF Paper | C10 H13 B F4 N2 S | P 1 21/c 1 | 5.6817; 7.4235; 29.057 90; 91.387; 90 | 1225.21 | Rohlíček, Jan; Eigner, Václav; Czernek, Jiří; Brus, Jiří An advanced approach combining solid-state NMR with powder diffraction applied to newly synthesized iso-thio-uronium salts. Journal of applied crystallography, 2025, 58, 321-332 |
| 2300747 | CIF Paper | C9 H13 Br N2 S | P 1 21/c 1 | 14.4689; 6.1901; 13.3423 90; 115.672; 90 | 1077.03 | Rohlíček, Jan; Eigner, Václav; Czernek, Jiří; Brus, Jiří An advanced approach combining solid-state NMR with powder diffraction applied to newly synthesized iso-thio-uronium salts. Journal of applied crystallography, 2025, 58, 321-332 |
| 2300748 | CIF Paper | C9 H13 B F4 N2 S | P 1 21 1 | 5.6075; 7.7882; 13.8649 90; 95.836; 90 | 602.37 | Rohlíček, Jan; Eigner, Václav; Czernek, Jiří; Brus, Jiří An advanced approach combining solid-state NMR with powder diffraction applied to newly synthesized iso-thio-uronium salts. Journal of applied crystallography, 2025, 58, 321-332 |
| 2300749 | CIF Paper | C12 H13 B F4 N2 S | P 1 21 1 | 5.8011; 7.4127; 15.2291 90; 90.776; 90 | 654.82 | Rohlíček, Jan; Eigner, Václav; Czernek, Jiří; Brus, Jiří An advanced approach combining solid-state NMR with powder diffraction applied to newly synthesized iso-thio-uronium salts. Journal of applied crystallography, 2025, 58, 321-332 |
| 2300750 | CIF | C2 H2.25 F2 N Ni0.25 Sb0.25 | P 4/n m m :2 | 9.9063; 9.9063; 6.4357 90; 90; 90 | 631.566 | Scatena, Rebecca; Manson, Zachary E.; Villa, Danielle Y.; Manson, Jamie L.; Allan, David R.; Goddard, Paul A.; Johnson, Roger D. Electron-density analysis of halide...halide through-space magnetic exchange Journal of Applied Crystallography, 2025, 58, 363-373 |
| 2300751 | CIF | C7 H9 Br0.5 N Ni0.25 | P 4/n n c :2 | 11.7571; 11.7571; 10.1909 90; 90; 90 | 1408.68 | Scatena, Rebecca; Manson, Zachary E.; Villa, Danielle Y.; Manson, Jamie L.; Allan, David R.; Goddard, Paul A.; Johnson, Roger D. Electron-density analysis of halide...halide through-space magnetic exchange Journal of Applied Crystallography, 2025, 58, 363-373 |
| 2300752 | CIF | C7 H9 Cl0.5 N Ni0.25 | P 4/n n c :2 | 11.5371; 11.5371; 10.5513 90; 90; 90 | 1404.43 | Scatena, Rebecca; Manson, Zachary E.; Villa, Danielle Y.; Manson, Jamie L.; Allan, David R.; Goddard, Paul A.; Johnson, Roger D. Electron-density analysis of halide...halide through-space magnetic exchange Journal of Applied Crystallography, 2025, 58, 363-373 |
| 2300753 | CIF | C7 H9 I0.5 N Ni0.25 | P 4/n n c :2 | 12.0231; 12.0231; 9.9896 90; 90; 90 | 1444.05 | Scatena, Rebecca; Manson, Zachary E.; Villa, Danielle Y.; Manson, Jamie L.; Allan, David R.; Goddard, Paul A.; Johnson, Roger D. Electron-density analysis of halide...halide through-space magnetic exchange Journal of Applied Crystallography, 2025, 58, 363-373 |
| 2300754 | CIF | C8 H10 Ni O7 | P b c n | 20.31; 22.85; 6.226 90; 90; 90 | 2889 | Biehler, Erik; Pagola, Silvina; Stam, Daniel; Merkelbach, Johannes; Jandl, Christian; Abdel-Fattah, Tarek M A comparison of microcrystal electron diffraction and X-ray powder diffraction for the structural analysis of metal-organic frameworks. Journal of applied crystallography, 2025, 58, 398-411 |
| 2300755 | CIF | C8 H8 Co O6 | C 1 2/c 1 | 18.22; 6.54; 7.28 90; 98.867; 90 | 857 | Biehler, Erik; Pagola, Silvina; Stam, Daniel; Merkelbach, Johannes; Jandl, Christian; Abdel-Fattah, Tarek M A comparison of microcrystal electron diffraction and X-ray powder diffraction for the structural analysis of metal-organic frameworks. Journal of applied crystallography, 2025, 58, 398-411 |
| 2300756 | CIF | C8 H8 Mn O6 | C 1 2/c 1 | 18.71; 6.57; 7.37 90; 99.27; 90 | 894 | Biehler, Erik; Pagola, Silvina; Stam, Daniel; Merkelbach, Johannes; Jandl, Christian; Abdel-Fattah, Tarek M A comparison of microcrystal electron diffraction and X-ray powder diffraction for the structural analysis of metal-organic frameworks. Journal of applied crystallography, 2025, 58, 398-411 |
| 2300757 | CIF | C52 H48 F12 Hg P6 | P 1 | 9.9613; 11.6741; 11.9272 102.495; 107.125; 96.849 | 1268.99 | Kleemiss, Florian; Meurer, Florian; Shenderovich, Ilya G.; Bodensteiner, Michael The use of effective core potentials in Hirshfeld atom refinement: making quantum crystallography faster in NoSpherA2 Journal of Applied Crystallography, 2025, 58 |
| 2300758 | CIF | C36 H31 Au I4 O2 P2 | P 1 | 9.23767; 10.52981; 10.54412 102.093; 112.84; 90.4679 | 919.677 | Kleemiss, Florian; Meurer, Florian; Shenderovich, Ilya G.; Bodensteiner, Michael The use of effective core potentials in Hirshfeld atom refinement: making quantum crystallography faster in NoSpherA2 Journal of Applied Crystallography, 2025, 58 |
| 2300759 | CIF Paper | C18 H10 O3 | F d d 2 | 18.0174; 20.9221; 26.0847 90; 90; 90 | 9832.94 | Meurer, Florian; Schimpf, Maximilian; Hischa, Birgit; Hennig, Christoph; Rehbein, Julia; Kleemiss, Florian; Bodensteiner, Michael Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival Journal of Applied Crystallography, 2025, 58, 678-687 |
| 2300760 | CIF | C20 H14 O3 S | P b c a | 14.4765; 9.1539; 23.3338 90; 90; 90 | 3092.11 | Meurer, Florian; Schimpf, Maximilian; Hischa, Birgit; Hennig, Christoph; Rehbein, Julia; Kleemiss, Florian; Bodensteiner, Michael Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival Journal of Applied Crystallography, 2025, 58, 678-687 |
| 2300761 | CIF | C20 H14 O3 S | P b c a | 14.54072; 9.17361; 23.4031 90; 90; 90 | 3121.76 | Meurer, Florian; Schimpf, Maximilian; Hischa, Birgit; Hennig, Christoph; Rehbein, Julia; Kleemiss, Florian; Bodensteiner, Michael Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival Journal of Applied Crystallography, 2025, 58, 678-687 |
| 2300762 | CIF | C20 H14 O3 S | P b c a | 14.49062; 9.15691; 23.329 90; 90; 90 | 3095.51 | Meurer, Florian; Schimpf, Maximilian; Hischa, Birgit; Hennig, Christoph; Rehbein, Julia; Kleemiss, Florian; Bodensteiner, Michael Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival Journal of Applied Crystallography, 2025, 58, 678-687 |
| 2300763 | CIF | C20 H14 O3 S | P b c a | 14.47962; 9.15557; 23.33502 90; 90; 90 | 3093.5 | Meurer, Florian; Schimpf, Maximilian; Hischa, Birgit; Hennig, Christoph; Rehbein, Julia; Kleemiss, Florian; Bodensteiner, Michael Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival Journal of Applied Crystallography, 2025, 58, 678-687 |
| 2300764 | CIF | C20 H14 O3 S | P b c a | 14.47953; 9.15279; 23.32492 90; 90; 90 | 3091.21 | Meurer, Florian; Schimpf, Maximilian; Hischa, Birgit; Hennig, Christoph; Rehbein, Julia; Kleemiss, Florian; Bodensteiner, Michael Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival Journal of Applied Crystallography, 2025, 58, 678-687 |
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