Crystallography Open Database
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Result: there are 349 entries in the selection
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Searching journal of publication like 'Chemical science' volume of publication is 8
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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1553651 | CIF | C8 H8 F6 Fe N4 O Si | P 4/m m m | 7.1831; 7.1831; 7.5839 90; 90; 90 | 391.31 | Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K. Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks. Chemical science, 2017, 8, 2373-2380 |
1553650 | CIF | C8 H8 F6 N4 Ni Si | P 4/m m m | 6.99732; 6.99732; 7.49177 90; 90; 90 | 366.816 | Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K. Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks. Chemical science, 2017, 8, 2373-2380 |
1553649 | CIF | C8 H8 F6 N4 Ni Si | P 4/m m m | 7.00122; 7.00122; 7.49794 90; 90; 90 | 367.527 | Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K. Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks. Chemical science, 2017, 8, 2373-2380 |
1553648 | CIF | C8 H8 F6 N4 Ni Si Xe0.34 | P 4/m m m | 7.0187; 7.0187; 7.5098 90; 90; 90 | 369.95 | Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K. Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks. Chemical science, 2017, 8, 2373-2380 |
1553647 | CIF | C27 H33 B2 F11 N6 Zn | F -4 3 c | 29.282; 29.282; 29.282 90; 90; 90 | 25107.4 | Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers. Chemical science, 2017, 8, 2448-2456 |
1553646 | CIF | C24 H27 B2 F11 Fe N6 | P 3 | 16.8376; 16.8376; 7.8829 90; 90; 120 | 1935.43 | Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers. Chemical science, 2017, 8, 2448-2456 |
1553645 | CIF | C25 H30 B2 F10 N6 Zn | P 1 c 1 | 13.6092; 14.5112; 14.1222 90; 90.875; 90 | 2788.61 | Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers. Chemical science, 2017, 8, 2448-2456 |
1553644 | CIF | C26 H31.5 B2 F10 Fe N6.5 | P -1 | 11.4603; 14.9231; 18.6992 110.254; 106.434; 91.133 | 2853 | Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers. Chemical science, 2017, 8, 2448-2456 |
1553643 | CIF | C27 H33 B2 F11 Fe N6 | F -4 3 c | 29.3374; 29.3374; 29.3374 90; 90; 90 | 25250.2 | Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers. Chemical science, 2017, 8, 2448-2456 |
1547319 | CIF | C30 H49 N5 O6 | P 1 21 1 | 8.3072; 7.8052; 25.7246 90; 97.491; 90 | 1653.7 | Colan E. Hughes; G. N. Manjunatha Reddy; Stefano Masiero; Steven P. Brown; P. Andrew Williams; Kenneth D. M. Harris Determination of a complex crystal structure in the absence of single crystals: analysis of powder X-ray diffraction data, guided by solid-state NMR and periodic DFT calculations, reveals a new 2'-deoxyguanosine structural motif Chemical Science, 2017, 8, 3971-3979 |
1546842 | CIF | C24 H20 N2 O6 | P n a 21 | 28.9068; 7.9025; 8.9889 90; 90; 90 | 2053.39 | Preindl, Johannes; Chakrabarty, Shyamal; Waser, Jérôme Dearomatization of electron poor six-membered N-heterocycles through [3 + 2] annulation with aminocyclopropanes Chemical Science, 2017, 8, 7112-7118 |
1545990 | CIF | C61 H71 N3 O10 | P b c a | 17.819; 17.457; 34.337 90; 90; 90 | 10681 | Zhu, Kelong; Baggi, Giorgio; Vukotic, V. Nicholas; Loeb, Stephen J. Reversible mechanical protection: building a 3D “suit” around a T-shaped benzimidazole axle Chem. Sci., 2017, 8, 3898 |
1545989 | CIF | C61 H76 N2 O12 | P 1 21/n 1 | 12.9848; 19.382; 22.2953 90; 99.8421; 90 | 5528.5 | Zhu, Kelong; Baggi, Giorgio; Vukotic, V. Nicholas; Loeb, Stephen J. Reversible mechanical protection: building a 3D “suit” around a T-shaped benzimidazole axle Chem. Sci., 2017, 8, 3898 |
1545678 | CIF | C32 H38 Cs K2 O6 | P -1 | 9.8938; 13.3712; 15.521 64.492; 78.484; 71.755 | 1755 | Spisak, Sarah N.; Rogachev, Andrey Yu.; Zabula, Alexander V.; Filatov, Alexander S.; Clérac, Rodolphe; Petrukhina, Marina A. Tuning the separation and coupling of corannulene trianion-radicals through sizable alkali metal belts Chem. Sci., 2017, 8, 3137 |
1545641 | CIF | C36 H26 F3 Fe I2 N4 O6 S | P -1 | 10.3585; 12.9759; 14.1074 78.558; 76.606; 86.265 | 1807.59 | Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J. Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis Chem. Sci., 2017, 8, 3949 |
1545640 | CIF | C36 H26 F3 Fe I2 N4 O6 S | P -1 | 10.3759; 12.8053; 13.8091 79.08; 76.267; 86.609 | 1749.85 | Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J. Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis Chem. Sci., 2017, 8, 3949 |
1545639 | CIF | C36 H28 F3 Fe I2 N4 O6 S | P -1 | 12.232; 12.547; 13.279 81.89; 67.04; 68.25 | 1742.9 | Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J. Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis Chem. Sci., 2017, 8, 3949 |
1545638 | CIF | C35 H26 F3 Fe I2 N4 O6 S | P -1 | 11.5289; 13.1814; 13.6233 71.947; 87.644; 68.871 | 1830.2 | Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J. Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis Chem. Sci., 2017, 8, 3949 |
1545637 | CIF | C35 H26 F3 Fe I2 N4 O6 S | P -1 | 11.5003; 13.1342; 13.5498 71.652; 87.488; 68.858 | 1806.23 | Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J. Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis Chem. Sci., 2017, 8, 3949 |
1545636 | CIF | C35 H26 F3 Fe I2 N4 O6 S | P -1 | 11.476; 13.0698; 13.4649 71.342; 87.437; 68.674 | 1776.5 | Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J. Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis Chem. Sci., 2017, 8, 3949 |
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