Crystallography Open Database
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Result: there are 831 entries in the selection
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Searching journal of publication like 'Chem. Sci.' volume of publication is 6
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1518372 | CIF | C69 H35 Mg4 N7 O30 | P 1 2/c 1 | 34.3413; 10.0447; 17.7382 90; 96.234; 90 | 6082.6 | Mallick, Arijit; Garai, Bikash; Addicoat, Matthew A.; Petkov, Petko St.; Heine, Thomas; Banerjee, Rahul Solid state organic amine detection in a photochromic porous metal organic framework Chem. Sci., 2015, 6, 1420 |
| 1518407 | CIF | C74 H86 N6 O3 | P -1 | 9.827; 16.9659; 21.6298 69.273; 81.505; 87.976 | 3335.2 | Slater, Anna G.; Hu, Ya; Yang, Lixu; Argent, Stephen P.; Lewis, William; Blunt, Matthew O.; Champness, Neil R. Thymine functionalised porphyrins, synthesis and heteromolecular surface-based self-assembly Chem. Sci., 2015, 6, 1562 |
| 1518408 | CIF | C86 H92 Cl18 N6 O3 | P -1 | 15.4721; 16.3717; 19.0278 92.068; 110.731; 99.28 | 4426 | Slater, Anna G.; Hu, Ya; Yang, Lixu; Argent, Stephen P.; Lewis, William; Blunt, Matthew O.; Champness, Neil R. Thymine functionalised porphyrins, synthesis and heteromolecular surface-based self-assembly Chem. Sci., 2015, 6, 1562 |
| 1518409 | CIF | C28 H20 N2 | P 21 21 21 | 5.9763; 11.5786; 29.273 90; 90; 90 | 2025.6 | Chen, Ming; Li, Lingzhi; Nie, Han; Tong, Jiaqi; Yan, Lulin; Xu, Bin; Sun, Jing Zhi; Tian, Wenjing; Zhao, Zujin; Qin, Anjun; Tang, Ben Zhong Tetraphenylpyrazine-based AIEgens: facile preparation and tunable light emission Chem. Sci., 2015, 6, 1932 |
| 1518410 | CIF | C40 H28 N2 | P -1 | 10.6571; 11.1264; 13.1685 88; 76.566; 74.575 | 1463.4 | Chen, Ming; Li, Lingzhi; Nie, Han; Tong, Jiaqi; Yan, Lulin; Xu, Bin; Sun, Jing Zhi; Tian, Wenjing; Zhao, Zujin; Qin, Anjun; Tang, Ben Zhong Tetraphenylpyrazine-based AIEgens: facile preparation and tunable light emission Chem. Sci., 2015, 6, 1932 |
| 1518411 | CIF | C42 H32 N2 O2 | P -1 | 11.1806; 11.4458; 12.861 101.527; 91.283; 99.274 | 1589.02 | Chen, Ming; Li, Lingzhi; Nie, Han; Tong, Jiaqi; Yan, Lulin; Xu, Bin; Sun, Jing Zhi; Tian, Wenjing; Zhao, Zujin; Qin, Anjun; Tang, Ben Zhong Tetraphenylpyrazine-based AIEgens: facile preparation and tunable light emission Chem. Sci., 2015, 6, 1932 |
| 1518412 | CIF | C32 H28 N2 O4 | P -1 | 9.768; 12.3063; 12.4687 68.542; 70.492; 88.089 | 1308.1 | Chen, Ming; Li, Lingzhi; Nie, Han; Tong, Jiaqi; Yan, Lulin; Xu, Bin; Sun, Jing Zhi; Tian, Wenjing; Zhao, Zujin; Qin, Anjun; Tang, Ben Zhong Tetraphenylpyrazine-based AIEgens: facile preparation and tunable light emission Chem. Sci., 2015, 6, 1932 |
| 1518432 | CIF | C6 H12 O6 | P 21 21 21 | 10.336; 14.852; 4.924 90; 90; 90 | 755.9 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518433 | CIF | C6 H12 O6 | P 21 21 21 | 10.26; 14.837; 4.8169 90; 90; 90 | 733.3 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518434 | CIF | C6 H12 O6 | P 21 21 21 | 10.22; 14.832; 4.7689 90; 90; 90 | 722.9 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518435 | CIF | C6 H12 O6 | P 21 21 21 | 10.218; 14.823; 4.7439 90; 90; 90 | 718.5 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518436 | CIF | C6 H12 O6 | P 21 21 21 | 10.181; 14.808; 4.693 90; 90; 90 | 707.5 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518437 | CIF | C6 H12 O6 | P 21 21 21 | 10.11; 14.808; 4.5801 90; 90; 90 | 685.7 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518438 | CIF | C6 H12 O6 | P 21 21 21 | 10.06; 14.798; 4.537 90; 90; 90 | 675.4 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518439 | CIF | C6 H12 O6 | P 21 21 21 | 10.05; 14.807; 4.4206 90; 90; 90 | 657.8 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518440 | CIF | C6 H12 O6 | P 21 21 21 | 10.04; 14.796; 4.3879 90; 90; 90 | 651.8 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518441 | CIF | C6 H12 O6 | P 21 21 21 | 10.056; 14.779; 4.275 90; 90; 90 | 635.3 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518442 | CIF | C6 H12 O6 | P 21 21 21 | 10.059; 14.776; 4.261 90; 90; 90 | 633.3 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518443 | CIF | C6 H12 O6 | P 21 21 21 | 10.063; 14.787; 4.256 90; 90; 90 | 633.3 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518444 | CIF | C6 H12 O6 | P 21 21 21 | 9.714; 14.99; 4.262 90; 90; 90 | 621 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518445 | CIF | C6 H12 O6 | P 21 21 21 | 9.73; 14.987; 4.234 90; 90; 90 | 617.4 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518446 | CIF | C6 H12 O6 | P 21 21 21 | 9.694; 14.931; 4.2234 90; 90; 90 | 611.3 | Patyk, Ewa; Katrusiak, Andrzej Transformable H-bonds and conformation in compressed glucose Chem. Sci., 2015, 6, 1991 |
| 1518447 | CIF | C67 F6 | P b c a | 9.9998; 20.6538; 31.3512 90; 90; 90 | 6475.1 | San, Long K.; Bukovsky, Eric V.; Larson, Bryon W.; Whitaker, James B.; Deng, S. H. M.; Kopidakis, Nikos; Rumbles, Garry; Popov, Alexey A.; Chen, Yu-Sheng; Wang, Xue-Bin; Boltalina, Olga V.; Strauss, Steven H. A faux hawk fullerene with PCBM-like properties Chem. Sci., 2015, 6, 1801 |
| 1518448 | CIF | C60 H60 Li4 O5 Rb4 | C m c m | 14.166; 13.519; 25.901 90; 90; 90 | 4960 | Filatov, Alexander S.; Spisak, Sarah N.; Zabula, Alexander V.; McNeely, James; Rogachev, Andrey Yu.; Petrukhina, Marina A. Self-assembly of tetrareduced corannulene with mixed Li‒Rb clusters: dynamic transformations, unique structures and record7Li NMR shifts Chem. Sci., 2015, 6, 1959 |
| 1518449 | CIF | C66 H80 Li3 O12.5 Rb5 | P -1 | 10.064; 15.27; 22.129 90.416; 93.102; 94.532 | 3384.9 | Filatov, Alexander S.; Spisak, Sarah N.; Zabula, Alexander V.; McNeely, James; Rogachev, Andrey Yu.; Petrukhina, Marina A. Self-assembly of tetrareduced corannulene with mixed Li–Rb clusters: dynamic transformations, unique structures and record7Li NMR shifts Chem. Sci., 2015, 6, 1959 |
| 1518450 | CIF | C28 H46 N4 O19 Tm | C 1 c 1 | 23.1686; 9.677; 16.8001 90; 118.272; 90 | 3317.3 | Funk, Alexander M.; Finney, Katie-Louise N. A.; Harvey, Peter; Kenwright, Alan M.; Neil, Emily R.; Rogers, Nicola J.; Kanthi Senanayake, P.; Parker, David Critical analysis of the limitations of Bleaney's theory of magnetic anisotropy in paramagnetic lanthanide coordination complexes Chem. Sci., 2015, 6, 1655 |
| 1518469 | CIF | C21 H10 Au B Cl10 N6 Pb | P -1 | 8.5794; 13.7444; 13.7913 110.805; 93.371; 101.13 | 1477.17 | Echeverría, Raquel; López-de-Luzuriaga, José M.; Monge, Miguel; Olmos, M. Elena The gold(i)⋯lead(ii) interaction: a relativistic connection Chem. Sci., 2015, 6, 2022 |
| 1518476 | CIF | C14 H23 F6 O6 Pd Sb | P -1 | 9.539; 10.408; 11.253 115.767; 97.422; 91.945 | 992.6 | Commarieu, Basile; Claverie, Jerome P. Bypassing the lack of reactivity of endo-substituted norbornenes with the catalytic rectification‒insertion mechanism Chem. Sci., 2015, 6, 2172 |
| 1518477 | CIF | C15 H22 F6 N O6 Pd Sb | P n m a | 18.89; 16.805; 13.196 90; 90; 90 | 4189 | Commarieu, Basile; Claverie, Jerome P. Bypassing the lack of reactivity of endo-substituted norbornenes with the catalytic rectification‒insertion mechanism Chem. Sci., 2015, 6, 2172 |
| 1518478 | CIF | C22 H35 F6 O6 Pd Sb | P n a 21 | 16.758; 16.947; 9.5046 90; 90; 90 | 2699.3 | Commarieu, Basile; Claverie, Jerome P. Bypassing the lack of reactivity of endo-substituted norbornenes with the catalytic rectification–insertion mechanism Chem. Sci., 2015, 6, 2172 |
| 1518479 | CIF | C17 H28 F6 N3 O10 Pd Sb | P 1 21/c 1 | 10.0271; 19.0026; 14.5138 90; 92.747; 90 | 2762.3 | Commarieu, Basile; Claverie, Jerome P. Bypassing the lack of reactivity of endo-substituted norbornenes with the catalytic rectification‒insertion mechanism Chem. Sci., 2015, 6, 2172 |
| 1518480 | CIF | C66 H86 Cl20 F24 O16 Pd4 Sb4 | P -1 | 16.4284; 19.3745; 21.4447 66.181; 88.434; 72.775 | 5930.9 | Commarieu, Basile; Claverie, Jerome P. Bypassing the lack of reactivity of endo-substituted norbornenes with the catalytic rectification‒insertion mechanism Chem. Sci., 2015, 6, 2172 |
| 1518496 | CIF | C34 H58 As4 Co2 | P 1 21/n 1 | 8.4386; 13.7676; 16.0276 90; 100.27; 90 | 1832.24 | Graßl, C.; Bodensteiner, M.; Zabel, M.; Scheer, M. Synthesis of arsenic-rich Asnligand complexes from yellow arsenic Chem. Sci., 2015, 6, 1379 |
| 1518497 | CIF | C35 H60 As4 Cl2 Co2 | C 1 2/c 1 | 17.893; 19.9249; 11.6299 90; 107.903; 90 | 3945.5 | Graßl, C.; Bodensteiner, M.; Zabel, M.; Scheer, M. Synthesis of arsenic-rich Asnligand complexes from yellow arsenic Chem. Sci., 2015, 6, 1379 |
| 1518498 | CIF | C68 H116 As10 Co4 | P -1 | 10.3921; 14.3707; 14.8262 62.53; 76.535; 79.819 | 1904.35 | Graßl, C.; Bodensteiner, M.; Zabel, M.; Scheer, M. Synthesis of arsenic-rich Asnligand complexes from yellow arsenic Chem. Sci., 2015, 6, 1379 |
| 1518499 | CIF | C72 H124 As10 Cl8 Co4 | P -1 | 13.7956; 14.0892; 15.0382 62.971; 69.895; 61.292 | 2254 | Graßl, C.; Bodensteiner, M.; Zabel, M.; Scheer, M. Synthesis of arsenic-rich Asnligand complexes from yellow arsenic Chem. Sci., 2015, 6, 1379 |
| 1518500 | CIF | C51 H87 As12 Co3 | C 1 2/c 1 | 28.9202; 15.7899; 29.9375 90; 112.752; 90 | 12607.1 | Graßl, C.; Bodensteiner, M.; Zabel, M.; Scheer, M. Synthesis of arsenic-rich Asnligand complexes from yellow arsenic Chem. Sci., 2015, 6, 1379 |
| 1518501 | CIF | C23 H32 N2 Se | P n a 21 | 23.3; 7.0807; 11.6415 90; 90; 90 | 1920.6 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518502 | CIF | C15 H24 N2 Se | P 1 21/c 1 | 11.8147; 11.1443; 12.2088 90; 108.21; 90 | 1527 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518503 | CIF | C27 H48 N2 Se | P 1 21/n 1 | 14.4058; 7.4133; 25.023 90; 97.856; 90 | 2647.2 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518504 | CIF | C19 H20 N2 Se | P 1 2/n 1 | 8.3318; 7.4265; 13.6459 90; 98.798; 90 | 834.42 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518505 | CIF | C21 H24 N2 Se | P b c n | 16.043; 7.3937; 16.055 90; 90; 90 | 1904.4 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518506 | CIF | C35 H52 N2 Se | P 1 21/c 1 | 20.433; 7.6327; 21.563 90; 106.66; 90 | 3221.8 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518507 | CIF | C27 H34 Cl2 N2 Se | I 1 2/a 1 | 17.366; 9.4565; 21.295 90; 109.08; 90 | 3305 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518508 | CIF | C21 H26 N2 Se | P b c n | 15.9194; 7.4418; 16.1915 90; 90; 90 | 1918.2 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518509 | CIF | C11 H6 F5 N3 Se | P 1 21/c 1 | 9.3746; 15.527; 8.3524 90; 90.357; 90 | 1215.7 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518510 | CIF | C11 H11 N3 O Se | P -1 | 7.8283; 7.9731; 18.447 97.93; 94.637; 90.042 | 1136.6 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518511 | CIF | C21 H21 N3 O Se | P -1 | 8.5326; 10.637; 11.589 107.558; 101.546; 107.498 | 906.2 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518512 | CIF | C30 H35 N3 O Se Si | P b c a | 13.2692; 19.8926; 20.979 90; 90; 90 | 5537.6 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518526 | CIF | C12 H11 N O2 | P -1 | 4.00444; 11.1381; 12.202 71.955; 89.514; 80.992 | 510.62 | Surampudi, S.; Yeh, M.-L.; Siegler, M. A.; Hardigree, J. F. Martinez; Kasl, T. A.; Katz, H. E.; Klausen, R. S. Increased carrier mobility in end-functionalized oligosilanes Chem. Sci., 2015, 6, 1905 |
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