Crystallography Open Database
Search results
Result: there are 1146 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'IuCrJ'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1560046 | CIF | C26 H21 N5 O4 | P -1 | 7.3217; 11.6513; 13.9987 105.915; 102.665; 91.242 | 1116.2 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560047 | CIF | C42 H34 N8 O8 | P -1 | 7.4323; 9.1138; 14.562 106.397; 103.133; 90.486 | 918.7 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560048 | CIF | C18 H17 N3 O4 | P 1 21/c 1 | 17.802; 7.5355; 12.5671 90; 91.187; 90 | 1685.5 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560049 | CIF | C18 H15 N3 O4 | P 1 21/c 1 | 17.9122; 7.4259; 12.1765 90; 92.337; 90 | 1618.3 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560050 | CIF | C16 H13 N5 O4 | P 1 21/c 1 | 18.213; 7.2967; 11.94 90; 92.967; 90 | 1584.6 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560051 | CIF | C20 H25 N5 O4 | P -1 | 7.7563; 8.1082; 16.24 97.387; 95.164; 95.007 | 1003.7 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560052 | CIF | C13 H15 N3 O4 | P 1 21/n 1 | 10.1301; 12.6967; 10.3338 90; 99.17; 90 | 1312.1 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560053 | CIF | C29 H26 N3 O4 | P 1 21 1 | 7.7925; 12.885; 12.398 90; 104.054; 90 | 1207.6 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560054 | CIF | C58 H50 N6 O8 | P -1 | 13.337; 13.504; 16.069 75.831; 66.422; 67.934 | 2442.9 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560055 | CIF | C40 H46 N8 O8 | P -1 | 7.5319; 8.6425; 15.3925 78.729; 75.782; 89.099 | 951.99 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560056 | CIF | C38 H42 N8 O8 | P -1 | 7.4104; 8.8964; 15.7722 95.531; 101.446; 111.676 | 930.47 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560057 | CIF | C22 H23 N3 O4 S2 | P -1 | 7.6512; 8.9495; 18.121 87.883; 78.725; 65.728 | 1108 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560058 | CIF | C62 H50 N6 O8 | P -1 | 7.684; 9.266; 18.043 96.343; 94.419; 107.054 | 1212.5 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560059 | CIF | C50 H52 N8 O8 | P -1 | 7.7634; 8.9486; 16.368 83.021; 82.842; 88.111 | 1119.7 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560060 | CIF | C42 H42 N8 O8 | P -1 | 7.5543; 8.914; 14.713 85.797; 88.497; 89.487 | 987.7 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560061 | CIF | C42 H40 N8 O8 | P -1 | 7.504; 9.428; 14.102 94.052; 91.192; 90.498 | 994.9 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560062 | CIF | C40 H40 N6 O8 S2 | P -1 | 7.489; 9.107; 14.187 97.784; 93.611; 90.872 | 956.5 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560063 | CIF | C40 H38 N6 O8 S2 | P -1 | 7.514; 9.272; 13.852 83.832; 89.887; 88.173 | 959 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560064 | CIF | C41 H41 N7 O8 S | P -1 | 7.4741; 9.2215; 14.295 96.245; 92.609; 92.314 | 977.4 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560065 | CIF | C41 H39 N7 O8 S | P -1 | 7.4078; 9.3192; 13.815 94.239; 91.445; 90.299 | 950.8 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560066 | CIF | C14 H16 Cl2 N2 O2 | P 1 21/n 1 | 9.302; 9.394; 17.66 90; 104.075; 90 | 1496.9 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560067 | CIF | C72 H48 Cl4 N10 O4 | P -1 | 10.807; 12.145; 12.466 108.22; 104.061; 101.072 | 1442.4 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560068 | CIF | C12 H12 Cl2 N2 O2 | P 1 21/c 1 | 8.188; 15.73; 11.247 90; 110.491; 90 | 1357 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560069 | CIF | C44 H42 Cl4 N4 O4 | C 1 2/c 1 | 42.727; 8.899; 22.92 90; 114.062; 90 | 7958 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560070 | CIF | C84 H54 Cl4 N4 O4 | C 1 2/c 1 | 33.873; 10.374; 18.332 90; 91.186; 90 | 6440 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560071 | CIF | C28 H22 Cl2 N2 O2 | P -1 | 8.8453; 10.4891; 12.694 94.129; 94.866; 98.239 | 1157.1 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560072 | CIF | C80 H66 Cl8 N8 O8 | P 1 21 1 | 17.219; 22.693; 18.331 90; 91.312; 90 | 7161 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560131 | CIF | C23 H20 N4 O10 | P 1 21/n 1 | 19.932; 4.461; 24.275 90; 97.73; 90 | 2138.8 | Xia, Yanming; Wei, Yuanfeng; Chen, Hui; Qian, Shuai; Zhang, Jianjun; Gao, Yuan Competitive cocrystallization and its application in the separation of flavonoids IUCrJ, 2021, 8, 195-207 |
1560861 | CIF | C26 H32 N2 Ni O2 | P -1 | 6.4256; 7.7129; 11.9856 98.709; 101.8; 104.3 | 550.52 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
1560862 | CIF | C26 H32 Cu N2 O2 | P -1 | 6.4641; 7.7224; 11.9925 97.647; 101.861; 105.261 | 553.99 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
1560863 | CIF | C34 H36 N2 Ni O2 | P 1 21/n 1 | 6.0847; 10.5704; 20.8597 90; 97.882; 90 | 1328.97 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
1560864 | CIF | C34 H36 Cu N2 O2 | P 1 21/n 1 | 11.0325; 5.6889; 21.554 90; 99.41; 90 | 1334.59 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
1563356 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.7493; 10.072; 20.462 90; 94.781; 90 | 1386.1 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563357 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.7637; 10.0716; 20.4697 90; 94.79; 90 | 1389.55 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563358 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.7832; 10.0779; 20.4867 90; 94.754; 90 | 1395.66 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563359 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.7983; 10.0786; 20.4949 90; 94.744; 90 | 1399.44 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563360 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.8159; 10.0882; 20.5143 90; 94.74; 90 | 1405.74 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563361 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.8491; 10.096; 20.5281 90; 94.735; 90 | 1414.64 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563362 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.855; 10.0998; 20.5333 90; 94.69; 90 | 1416.84 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563363 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.8717; 10.105; 20.5512 90; 94.688; 90 | 1422.27 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563364 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.8752; 10.1004; 20.5391 90; 94.709; 90 | 1421.47 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563365 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.9337; 10.1217; 20.599 90; 94.713; 90 | 1440.8 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563366 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.9626; 10.1312; 20.609 90; 94.7; 90 | 1448.86 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563367 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.8312; 10.0839; 20.5232 90; 94.635; 90 | 1409.12 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563368 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.7445; 10.0486; 20.4539 90; 94.589; 90 | 1381.77 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563369 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.6277; 10.005; 20.3418 90; 94.609; 90 | 1344.51 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563370 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.5155; 9.9444; 20.2293 90; 94.662; 90 | 1306.38 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563371 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.4387; 9.9135; 20.1349 90; 94.729; 90 | 1280.84 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563372 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.259; 9.8519; 19.8571 90; 95.624; 90 | 1218.56 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1563373 | CIF | C15 H7 Cl2 N4 O2 | P 1 21/n 1 | 6.2058; 9.8299; 19.7739 90; 95.781; 90 | 1200.12 | Milašinović, Valentina; Molčanov, Krešimir; Krawczuk, Anna; Bogdanov, Nikita E.; Zakharov, Boris A.; Boldyreva, Elena V.; Jelsch, Christian; Kojić-Prodić, Biserka Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure IUCrJ, 2021, 8 |
1564497 | CIF | C10 H24 Cl2 Co N4 S2 | P 1 21/n 1 | 9.9071; 12.7019; 14.1556 90; 92.824; 90 | 1779.16 | Klahn, Emil Andreasen; Damgaard-Møller, Emil; Krause, Lennard; Kibalin, Iurii; Gukasov, Arsen; Tripathi, Shalini; Swain, Abinash; Shanmugam, Maheswaran; Overgaard, Jacob Quantifying magnetic anisotropy using X-ray and neutron diffraction IUCrJ, 2021, 8 |
1564498 | CIF | C10 H24 Br2 Co N4 S2 | P 1 21/n 1 | 9.798; 12.961; 14.636 90; 92.363; 90 | 1857.1 | Klahn, Emil Andreasen; Damgaard-Møller, Emil; Krause, Lennard; Kibalin, Iurii; Gukasov, Arsen; Tripathi, Shalini; Swain, Abinash; Shanmugam, Maheswaran; Overgaard, Jacob Quantifying magnetic anisotropy using X-ray and neutron diffraction IUCrJ, 2021, 8 |
1564942 | CIF Paper | C20 H14 O2 | P n m a | 7.21024; 16.4876; 11.2792 90; 90; 90 | 1340.87 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564943 | CIF | C20 H14 O2 | P n m a | 7.2462; 16.536; 11.255 90; 90; 90 | 1348.6 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564944 | CIF | C20 H14 O2 | P n m a | 7.15; 16.17; 11.288 90; 90; 90 | 1305 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564945 | CIF | C20 H14 O2 | P n m a | 7.0642; 16.22; 11.165 90; 90; 90 | 1279.3 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564946 | CIF | C20 H14 O2 | P n 21 a | 7.03; 16.147; 11.1214 90; 90; 90 | 1262.4 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564947 | CIF | C20 H14 O2 | P n 21 a | 7.0202; 16.0775; 11.161 90; 90; 90 | 1259.7 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564948 | CIF | C20 H14 O2 | P n 21 a | 6.9714; 16.139; 11.072 90; 90; 90 | 1245.7 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1564949 | CIF | C20 H14 O2 | P 1 1 21/a | 6.8697; 15.96; 11.1099 90; 90; 95.074 | 1213.3 | Tchoń, D.; Makal, A. Maximizing completeness in single-crystal high-pressure diffraction experiments: phase transitions in 2{^i̧rc}AP IUCrJ, 2021, 8 |
1565826 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.91895; 9.91895; 9.91895 90; 90; 90 | 975.882 | Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof Tracing electron density changes in langbeinite under pressure IUCrJ, 2022, 9, 146-162 |
1565827 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.91895; 9.91895; 9.91895 90; 90; 90 | 975.882 | Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof Tracing electron density changes in langbeinite under pressure IUCrJ, 2022, 9, 146-162 |
1565828 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.91977; 9.91977; 9.91977 90; 90; 90 | 976.124 | Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof Tracing electron density changes in langbeinite under pressure IUCrJ, 2022, 9, 146-162 |
1565829 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.91977; 9.91977; 9.91977 90; 90; 90 | 976.124 | Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof Tracing electron density changes in langbeinite under pressure IUCrJ, 2022, 9, 146-162 |
1565830 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.9045; 9.9045; 9.9045 90; 90; 90 | 971.623 | Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof Tracing electron density changes in langbeinite under pressure IUCrJ, 2022, 9, 146-162 |
1565831 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.9045; 9.9045; 9.9045 90; 90; 90 | 971.623 | Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof Tracing electron density changes in langbeinite under pressure IUCrJ, 2022, 9, 146-162 |
1565846 | CIF Paper | C54 H58 Cl3 O11 Rb | P -1 | 13.44; 14.3933; 14.8036 84.073; 76.728; 62.777 | 2478.47 | Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung; Park, In-Hyeok Regioisomers of singly bridged calix[6]crown-6 and their heavy alkali metal complexes: a molecular baseball glove for caesium(I) IUCrJ, 2022, 9, 43-48 |
1565847 | CIF | C55 H53 Cl9 Cs O10 | P 1 21/n 1 | 13.1773; 20.344; 22.581 90; 106.172; 90 | 5814 | Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung; Park, In-Hyeok Regioisomers of singly bridged calix[6]crown-6 and their heavy alkali metal complexes: a molecular baseball glove for caesium(I) IUCrJ, 2022, 9, 43-48 |
1565848 | CIF | C53 H55 Cl3 Cs2 O11 | P 1 21/c 1 | 13.166; 31.338; 14.278 90; 117.28; 90 | 5236 | Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung; Park, In-Hyeok Regioisomers of singly bridged calix[6]crown-6 and their heavy alkali metal complexes: a molecular baseball glove for caesium(I) IUCrJ, 2022, 9, 43-48 |
1565849 | CIF Paper | Cu H10 O9 S | P -1 | 5.9523; 6.1001; 10.647 77.308; 82.353; 72.64 | 359.02 | Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J. Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate IUCrJ, 2022, 9, 73-85 |
1565850 | CIF | Cu H10 O9 S | P -1 | 5.9523; 6.1001; 10.647 77.308; 82.353; 72.64 | 359.02 | Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J. Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate IUCrJ, 2022, 9, 73-85 |
1565851 | CIF | Cu H10 O9 S | P -1 | 5.9523; 6.1001; 10.647 77.308; 82.353; 72.64 | 359.016 | Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J. Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate IUCrJ, 2022, 9, 73-85 |
1565852 | CIF | Cu H10 O9 S | P -1 | 5.9523; 6.1001; 10.647 77.308; 82.353; 72.64 | 359.016 | Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J. Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate IUCrJ, 2022, 9, 73-85 |
1565853 | CIF Paper | C73 H100 O6 | P 1 21/c 1 | 16.252; 23.5373; 17.2102 90; 101.773; 90 | 6444.9 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565854 | CIF Paper | C66 H84 O6 | P -1 | 9.59; 18.199; 18.547 114.31; 91.36; 91.7 | 2946 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565855 | CIF Paper | C70 H92 Cl8 O6 | P -1 | 13.8727; 16.0717; 17.6177 77.127; 66.915; 76.404 | 3474.5 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565856 | CIF Paper | C68 H88 Cl4 O6 | P -1 | 12.261; 17.2425; 17.417 118.625; 92.647; 98.062 | 3172.8 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565857 | CIF Paper | C84 H102 O6 | P -1 | 13.5391; 14.7702; 19.045 80.68; 72.393; 78.191 | 3532.8 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565858 | CIF Paper | C69 H90 Cl6 O6 | P 1 21/c 1 | 17.8792; 19.6559; 18.9669 90; 96.732; 90 | 6619.6 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565859 | CIF Paper | C72 H96 O6 | P 1 21/n 1 | 17.2109; 18.2986; 19.6172 90; 94.521; 90 | 6158.9 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565860 | CIF Paper | C73 H92 O6 | P 1 21/n 1 | 17.1817; 18.7393; 19.4157 90; 95.843; 90 | 6218.9 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565861 | CIF Paper | C69 H90 O8 | P 1 21/n 1 | 17.0366; 18.4996; 19.762 90; 94.288; 90 | 6210.96 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565862 | CIF Paper | C70 H92 O7 | P 1 21/n 1 | 17.1261; 17.8832; 19.8489 90; 93.914; 90 | 6064.9 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565863 | CIF Paper | C73 H92 O7 | P -1 | 14.1349; 16.1763; 17.0355 83.979; 72.392; 73.292 | 3555.3 | Malinska, Maura Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents IUCrJ, 2022, 9, 55-64 |
1565864 | CIF Paper | C4 H2 Cl N5 | P 21 21 21 | 7.0651; 8.7859; 10.0906 90; 90; 90 | 626.36 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565865 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0604; 8.78; 10.0712 90; 90; 90 | 624.32 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565866 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0533; 8.7742; 10.0552 90; 90; 90 | 622.29 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565867 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0476; 8.7682; 10.0363 90; 90; 90 | 620.19 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565868 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0422; 8.7617; 10.0158 90; 90; 90 | 617.99 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565869 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0473; 8.7636; 10.0299 90; 90; 90 | 619.44 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565870 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0342; 8.7569; 10.0049 90; 90; 90 | 616.28 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565871 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0336; 8.7575; 10.0065 90; 90; 90 | 616.37 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565872 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0291; 8.7539; 9.9932 90; 90; 90 | 614.902 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565873 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0245; 8.7517; 9.9817 90; 90; 90 | 613.638 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565874 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0753; 8.7825; 10.099 90; 90; 90 | 627.5 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565875 | CIF | C4 H2 Cl N5 | P 21 21 21 | 6.934; 8.7568; 10.029 90; 90; 90 | 609 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565876 | CIF | C4 H2 Cl N5 | P n m a | 10.697; 6.2545; 8.8012 90; 90; 90 | 588.8 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565877 | CIF | C4 H2 Cl N5 | P n m a | 10.654; 6.1954; 8.7823 90; 90; 90 | 579.68 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565878 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0542; 8.7774; 10.1041 90; 90; 90 | 625.62 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
1565879 | CIF | C4 H2 Cl N5 | P 21 21 21 | 7.0733; 8.7965; 10.042 90; 90; 90 | 624.8 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Stochastic hydration of a high-nitrogen-content molecular compound recrystallized under pressure IUCrJ, 2022, 9, 49-54 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!