Crystallography Open Database
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Result: there are 259 entries in the selection
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Searching journal of publication like 'Faraday Discussions'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1548750 | CIF | C79.511 N0 O30.762 Pd0.546 Zr6 | F m -3 m | 26.79861; 26.79861; 26.79861 90; 90; 90 | 19245.8 | Bugaev, A. L.; Guda, Alexander A.; Lomachenko, Kirill A.; Kamyshova, Elizaveta G.; Soldatov, Mikhail A.; Kaur, Gurpreet; Øien-Ødegaard, Sigurd; Braglia, Luca; Lazzarini, Andrea; Manzoli, Maela; Bordiga, Silvia; Olsbye, Unni; Lillerud, Karl P.; Soldatov, Alexander V.; Lamberti, Carlo Operando study of palladium nanoparticles inside UiO-67 MOF for catalytic hydrogenation of hydrocarbons. Faraday discussions, 2018, 208, 287-306 |
| 1549248 | CIF | C57 H60 Cl2 N12 | P 1 21/n 1 | 16.565; 10.745; 31.067 90; 92.088; 90 | 5526 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549249 | CIF | C65 H69 Cl3 N12 | P 21 21 21 | 10.654; 23.151; 25.363 90; 90; 90 | 6256 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549250 | CIF | C103.75 H111.5 Cl15.5 N24 | R 3 | 21.3987; 21.3987; 21.3164 90; 90; 120 | 8453.2 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549251 | CIF | C106 H96 Cl40 N24 | F 2 3 | 24.3478; 24.3478; 24.3478 90; 90; 90 | 14433.7 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549252 | CIF | C107.33 H107.33 Cl33.97 N24 | P -1 | 17.1487; 18.3913; 24.7171 73.378; 72.98; 76.7 | 7050.9 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549372 | CIF | C12 H9 N3 O2 S | P 1 21 1 | 10.77117; 11.01902; 11.43023 90; 117.742; 90 | 1200.68 | Tan, Melissa; Shtukenberg, Alexander G.; Zhu, Shengcai; Xu, Wenqian; Dooryhee, Eric; Nichols, Shane M.; Ward, Michael D.; Kahr, Bart; Zhu, Qiang ROY revisited, again: the eighth solved structure. Faraday discussions, 2018, 211, 477-491 |
| 1549732 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 27.997; 4.918; 28.971 90; 108.987; 90 | 3772 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549733 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 35.652; 5.206; 22.743 90; 117.418; 90 | 3747 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549734 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 27.844; 4.867; 28.892 90; 108.98; 90 | 3702 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549735 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 28.502; 5.051; 29.231 90; 109.51; 90 | 3967 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549736 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 28.301; 4.998; 29.154 90; 109.217; 90 | 3894 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549737 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 28.201; 4.972; 29.106 90; 109.077; 90 | 3857 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549738 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 27.906; 4.886; 28.927 90; 109.016; 90 | 3728.9 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1550310 | CIF | C23 H56 F3 N2 O3 P4 Rh S | P 1 21/n 1 | 10.1497; 11.3546; 29.0077 90; 95.69; 90 | 3326.5 | Walsh, Aaron P.; Laureanti, Joseph A.; Katipamula, Sriram; Chambers, Geoffrey M.; Priyadarshani, Nilusha; Lense, Sheri; Bays, J. Timothy; Linehan, John C.; Shaw, Wendy J. Evaluating the impacts of amino acids in the second and outer coordination spheres of Rh-bis(diphosphine) complexes for CO<sub>2</sub> hydrogenation. Faraday discussions, 2019, 215, 123-140 |
| 1550432 | CIF | C65.56 H77.12 B2 Cl7.12 F8 N2 O8.38 P4 Pd0.98 | C 1 2/c 1 | 24.9341; 15.1575; 22.1525 90; 114.583; 90 | 7613.4 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550433 | CIF | C35 H30 Cl3 F6 N O4.4 P3 Pd | P 1 21/n 1 | 12.3522; 26.1118; 13.6448 90; 113.138; 90 | 4046.96 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550434 | CIF | C33 H38 Cl2 N2 O4 P2 Pd | P 1 21/n 1 | 12.9976; 18.6574; 14.6755 90; 105.169; 90 | 3434.83 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550435 | CIF | C35 H41 Cl8 N Ni O4 P2 | P 1 21/c 1 | 11.7989; 15.5485; 23.5593 90; 101.232; 90 | 4239.29 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550436 | CIF | C33 H38 Cl2 N2 Ni O4 P2 | P 1 21/n 1 | 12.8814; 18.6698; 14.5746 90; 105.006; 90 | 3385.56 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
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