Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1573498 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6147; 4.8463; 19.3274 90; 109.551; 90 | 1466.51 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573499 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6128; 4.8607; 19.3367 90; 109.37; 90 | 1473.05 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573500 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.55; 4.6266; 19.089 90; 111.96; 90 | 1356 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573501 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6153; 4.8619; 19.34 90; 109.35; 90 | 1474.07 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573502 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6155; 4.8646; 19.3384 90; 109.321; 90 | 1475.05 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573503 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6252; 4.8647; 19.3379 90; 109.278; 90 | 1476.3 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573504 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6176; 4.8671; 19.3394 90; 109.301; 90 | 1476.25 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573505 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6174; 4.8695; 19.3375 90; 109.268; 90 | 1477.11 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573506 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6187; 4.872; 19.3377 90; 109.242; 90 | 1478.23 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573507 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6197; 4.8747; 19.3362 90; 109.217; 90 | 1479.25 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573508 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6216; 4.877; 19.3388 90; 109.193; 90 | 1480.54 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573509 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6256; 4.8792; 19.3393 90; 109.164; 90 | 1481.86 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573510 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6268; 4.881; 19.3397 90; 109.141; 90 | 1482.75 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573511 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6279; 4.8825; 19.3411 90; 109.105; 90 | 1483.73 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573512 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.53; 4.5612; 19.065 90; 112.63; 90 | 1326.8 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573513 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6313; 4.8871; 19.3441 90; 109.05; 90 | 1486.16 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573514 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6408; 4.8878; 19.3501 90; 109.048; 90 | 1487.7 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573515 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.48; 4.5205; 19.083 90; 113.24; 90 | 1306 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573516 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6494; 4.9069; 19.3575 90; 108.812; 90 | 1497 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573517 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.469; 4.4857; 19.042 90; 113.63; 90 | 1288.8 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573518 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.462; 4.4828; 19.038 90; 113.66; 90 | 1286.8 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573519 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.446; 4.46879; 19.038 90; 113.81; 90 | 1280.1 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573520 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.33; 4.4824; 19.06 90; 113.4; 90 | 1280 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573521 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6688; 4.9269; 19.3733 90; 108.522; 90 | 1508.63 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573522 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.661; 4.9284; 19.3767 90; 108.52; 90 | 1508.7 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573523 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.429; 4.4214; 19.02 90; 114.32; 90 | 1259 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573524 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.44; 4.4104; 18.97 90; 114; 90 | 1257 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573525 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.46; 4.3839; 18.94 90; 114.3; 90 | 1246 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573526 | CIF | C16 H18 N2 O4 | I 1 2/a 1 | 16.6711; 4.9272; 19.3744 90; 108.512; 90 | 1509.1 | Patyk-Kaźmierczak, Ewa; Szymańska, Kornelia; Kaźmierczak, Michał Managing negative linear compressibility and thermal expansion through steric hindrance: a case study of 1,2-bis(4'-pyridyl)ethane cocrystals. IUCrJ, 2025, 12 |
| 1573579 | CIF Paper | C14 H13 N3 O4 S2 | P -1 | 11.2439; 11.2772; 13.4027 65.901; 87.254; 79.439 | 1524.37 | Jeziorna, Agata; Malinska, Maura; Sugden, Isaac; Paluch, Piotr; Dolot, Rafał; Dudek, Marta K. SCXRD, CSP-NMRX and microED in the quest for three elusive polymorphs of meloxicam. IUCrJ, 2025, 12 |
| 1573873 | CIF | C10 H16 N2 O3 S | P 21 21 21 | 5.17; 10.11; 20.71 90; 90; 90 | 1082.5 | Vlahakis, Niko; Clauss, Arden; Rodriguez, Jose A. Accounting for electron-beam-induced warping of molecular nanocrystals in MicroED structure determination. IUCrJ, 2025, 12 |
| 1573874 | CIF | C12 H24 Cu2 N4 O12 | P 1 21 1 | 5.51; 8.24; 9.72 90; 90.33; 90 | 441.3 | Vlahakis, Niko; Clauss, Arden; Rodriguez, Jose A. Accounting for electron-beam-induced warping of molecular nanocrystals in MicroED structure determination. IUCrJ, 2025, 12 |
| 1573875 | CIF | C20 H40 N4 O8 S4 Zn2 | P 1 21 1 | 9.07; 4.91; 14.97 90; 106.94; 90 | 637.7 | Vlahakis, Niko; Clauss, Arden; Rodriguez, Jose A. Accounting for electron-beam-induced warping of molecular nanocrystals in MicroED structure determination. IUCrJ, 2025, 12 |
| 1573876 | CIF | C12 H16 N6 O4 Zn | P 43 21 2 | 7.09; 7.09; 29.07 90; 90; 90 | 1461.3 | Vlahakis, Niko; Clauss, Arden; Rodriguez, Jose A. Accounting for electron-beam-induced warping of molecular nanocrystals in MicroED structure determination. IUCrJ, 2025, 12 |
| 1573877 | CIF | C44 H28 Co N4 | P -1 | 9.6; 13.145; 13.28 79.53; 71.78; 69.39 | 1485.1 | Vlahakis, Niko; Clauss, Arden; Rodriguez, Jose A. Accounting for electron-beam-induced warping of molecular nanocrystals in MicroED structure determination. IUCrJ, 2025, 12 |
| 1574021 | CIF Paper | C29 H44 N2 O2 | P 1 21/c 1 | 8.8766; 17.645; 17.2008 90; 91.5518; 90 | 2693.13 | Zmeškalová, Eliška; Stara, František; Havlůjová, Tereza; Šoóš, Miroslav Surface analysis of cannabigerol cocrystals: linking crystal structure to enhanced properties. IUCrJ, 2025, 12 |
| 1574022 | CIF Paper | C25 H42 N2 O2 | P 1 21/n 1 | 8.7047; 26.7487; 11.0627 90; 111.236; 90 | 2400.92 | Zmeškalová, Eliška; Stara, František; Havlůjová, Tereza; Šoóš, Miroslav Surface analysis of cannabigerol cocrystals: linking crystal structure to enhanced properties. IUCrJ, 2025, 12 |
| 1574023 | CIF Paper | C21 H32 O2 | P 21 21 21 | 4.5073; 11.4901; 36.7494 90; 90; 90 | 1903.23 | Zmeškalová, Eliška; Stara, František; Havlůjová, Tereza; Šoóš, Miroslav Surface analysis of cannabigerol cocrystals: linking crystal structure to enhanced properties. IUCrJ, 2025, 12 |
| 1574357 | CIF | C3 H I O S2 | P 1 | 4.09358; 5.63601; 6.64675 103.946; 91.017; 91.983 | 148.687 | Shukla, Rahul; Aubert, Emmanuel; Brezgunova, Mariya; Lebègue, Sébastien; Fourmigué, Marc; Espinosa, Enrique The origin of synthons and supramolecular motifs: beyond atoms and functional groups. IUCrJ, 2025, 12 |
| 1574526 | CIF | C3 H7 N O2 | P 21 21 21 | 5.79932; 5.94057; 12.2815 90; 90; 90 | 423.113 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574527 | CIF | C3 H7 N O2 | P 21 21 21 | 5.8033; 5.95953; 12.2978 90; 90; 90 | 425.32 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574528 | CIF | C3 H7 N O2 | P 21 21 21 | 5.80343; 5.98084; 12.3143 90; 90; 90 | 427.422 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574529 | CIF | C3 H7 N O2 | P 21 21 21 | 5.803; 6.0038; 12.333 90; 90; 90 | 429.68 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574530 | CIF | C2 H7 N O3 S | P 1 21/c 1 | 5.27398; 11.655; 7.8107 90; 93.993; 90 | 478.94 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574531 | CIF | C2 H7 N O3 S | P 1 21/c 1 | 5.274; 11.6462; 7.8849 90; 94.073; 90 | 483.08 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574532 | CIF | C2 H7 N O3 S | P 1 21/c 1 | 5.2794; 11.6513; 7.9226 90; 94.112; 90 | 486.08 | Hayashi, Mibuki; Nishioka, Takashi; Kasai, Hidetaka; Nishibori, Eiji Accurate temperature dependence of structure factors of L-alanine and taurine for quantum crystallography. IUCrJ, 2025, 12 |
| 1574545 | CIF | C8 H11 N O | P 1 c 1 | 9.1243; 9.6491; 8.7744 90; 104.232; 90 | 748.8 | Grabowski, Szymon; Nowakowska, Klaudia; Butkiewicz, Helena; Hoser, Anna; Wesełucha-Birczyńska, Aleksandra; Seidler, Tomasz; Moskal, Paulina; Gryl, Marlena Additive-driven microwave crystallization of tyramine polymorphs and salts: a quantum crystallography perspective. IUCrJ, 2025, 12 |
| 1574546 | CIF | C8 H11 N O | P -1 | 5.4977; 8.9826; 14.6789 85.742; 89.93; 81.52 | 714.96 | Grabowski, Szymon; Nowakowska, Klaudia; Butkiewicz, Helena; Hoser, Anna; Wesełucha-Birczyńska, Aleksandra; Seidler, Tomasz; Moskal, Paulina; Gryl, Marlena Additive-driven microwave crystallization of tyramine polymorphs and salts: a quantum crystallography perspective. IUCrJ, 2025, 12 |
| 1574547 | CIF | C32 H47 N5 O7 | P 1 21 1 | 9.1192; 19.0384; 10.0172 90; 95.648; 90 | 1730.69 | Grabowski, Szymon; Nowakowska, Klaudia; Butkiewicz, Helena; Hoser, Anna; Wesełucha-Birczyńska, Aleksandra; Seidler, Tomasz; Moskal, Paulina; Gryl, Marlena Additive-driven microwave crystallization of tyramine polymorphs and salts: a quantum crystallography perspective. IUCrJ, 2025, 12 |
| 1574548 | CIF | C16.67 H24 N3.33 O4 | R -3 c :H | 17.23677; 17.23677; 62.5877 90; 90; 120 | 16103.9 | Grabowski, Szymon; Nowakowska, Klaudia; Butkiewicz, Helena; Hoser, Anna; Wesełucha-Birczyńska, Aleksandra; Seidler, Tomasz; Moskal, Paulina; Gryl, Marlena Additive-driven microwave crystallization of tyramine polymorphs and salts: a quantum crystallography perspective. IUCrJ, 2025, 12 |
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