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 |
|---|---|---|---|---|---|---|
| 1542844 | CIF HKL | C46 H46 Cl2 N4 O12 | P -1 | 7.3994; 25.6703; 5.8254 90.162; 98.598; 98.315 | 1082.2 | Sanphui, Palash; Bolla, Geetha; Nangia, Ashwini; Chernyshev, Vladimir Acemetacin cocrystals and salts: structure solution from powder X-ray data and form selection of the piperazine salt IUCrJ, 2014, 1, 136-150 |
| 1542845 | CIF Paper | C12 H9 Cl4 N O | P -1 | 7.0243; 9.4152; 10.928 82.75; 79.147; 76.703 | 688.2 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542846 | CIF Paper | C12 H9 Cl4 N O | P 1 21/c 1 | 6.9676; 21.336; 9.1861 90; 99.139; 90 | 1348.3 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542847 | CIF Paper | C12 H8 Cl5 N O | P 1 21 1 | 7.0572; 15.4665; 13.2112 90; 98.98; 90 | 1424.3 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542848 | CIF Paper | C12 H8 Cl5 N O | I 1 2/a 1 | 22.638; 7.2553; 18.013 90; 90.767; 90 | 2958.3 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542849 | CIF Paper | C12 H7 Cl5 N O | P -1 | 7.0681; 9.5008; 11.4095 85.402; 83.071; 71.211 | 719.36 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542850 | CIF Paper | C12 H9 Br Cl3 N O | P -1 | 7.0562; 9.373; 11.11 83.358; 79.173; 76.588 | 700 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542851 | CIF Paper | C12 H9 Cl3 I N O | P -1 | 7.083; 9.354; 11.456 84.118; 79.555; 76.553 | 724.5 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542852 | CIF Paper | C12 H7 Cl4 I N O | P -1 | 7.107; 9.498; 11.827 85.425; 81.804; 71.851 | 750.4 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542853 | CIF Paper | C12 H9 Cl4 N O | P 1 21/c 1 | 7.851; 11.865; 14.891 90; 106.79; 90 | 1328 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542854 | CIF Paper | C12 H9 Cl4 N O | P -1 | 7.208; 9.333; 10.884 99.035; 107.107; 102.219 | 664.8 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542855 | CIF Paper | C12 H8 Cl5 N O | P -1 | 7.1441; 9.3027; 11.8726 77.966; 74.889; 77.979 | 735.06 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542856 | CIF Paper | C12 H8 Cl5 N O | P -1 | 7.206; 9.2558; 11.3203 99.693; 99.616; 101.387 | 713.76 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542857 | CIF Paper | C14 H14 N2 O4 | C 1 2/c 1 | 24.698; 5.1072; 20.6682 90; 99.673; 90 | 2570 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542858 | CIF Paper | C14 H14 N2 O4 | P 1 21/c 1 | 12.41; 5.124; 20.06 90; 92.901; 90 | 1274 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542859 | CIF Paper | C14 H14 N2 O5 | P -1 | 4.76; 11.501; 12.539 77.081; 86.975; 81.302 | 661.2 | Mukherjee, Arijit; Dixit, Karuna; Sarma, Siddhartha P.; Desiraju, Gautam R. Aniline‒phenol recognition: from solution through supramolecular synthons to cocrystals IUCrJ, 2014, 1, 228-239 |
| 1542860 | CIF | C44 H40 Ag2 N12 O8 | P b c m | 12.6641; 26.23; 35.269 90; 90; 90 | 11716 | Jiang, Ji-Jun; He, Jian-Rong; Lü, Xing-Qiang; Wang, Da-Wei; Li, Guo-Bi; Su, Cheng-Yong Structural disorder and transformation in crystal growth: direct observation of ring-opening isomerization in a metal‒organic solid solution IUCrJ, 2014, 1, 318-327 |
| 1542861 | CIF | C24 H20 Ag F3 N6 O11 | I b a m | 6.4005; 26.426; 35.016 90; 90; 90 | 5922.6 | Jiang, Ji-Jun; He, Jian-Rong; Lü, Xing-Qiang; Wang, Da-Wei; Li, Guo-Bi; Su, Cheng-Yong Structural disorder and transformation in crystal growth: direct observation of ring-opening isomerization in a metal‒organic solid solution IUCrJ, 2014, 1, 318-327 |
| 1543051 | CIF HKL | C6 H12 O6 | P 21/n | 11.58792; 12.2101; 5.25364 90; 90.5649; 90 | 743.3 | Bekö, Sándor L.; Alig, Edith; Schmidt, Martin U.; van de Streek, Jacco On the correlation between hydrogen bonding and melting points in the inositols IUCrJ, 2013, 1, 61-73 |
| 1543052 | CIF HKL | C6 H12 O6 | P b c a | 14.1313; 11.0757; 9.36191 90; 90; 90 | 1465.27 | Bekö, Sándor L.; Alig, Edith; Schmidt, Martin U.; van de Streek, Jacco On the correlation between hydrogen bonding and melting points in the inositols IUCrJ, 2013, 1, 61-73 |
| 1543053 | CIF HKL | C6 H12 O6 | P 21 21 21 | 14.01476; 11.03782; 9.33193 90; 90; 90 | 1443.58 | Bekö, Sándor L.; Alig, Edith; Schmidt, Martin U.; van de Streek, Jacco On the correlation between hydrogen bonding and melting points in the inositols IUCrJ, 2013, 1, 61-73 |
| 1543054 | CIF HKL | C6 H12 O6 | P c a 21 | 11.8577; 7.01486; 8.68032 90; 90; 90 | 722.03 | Bekö, Sándor L.; Alig, Edith; Schmidt, Martin U.; van de Streek, Jacco On the correlation between hydrogen bonding and melting points in the inositols IUCrJ, 2013, 1, 61-73 |
| 1543055 | CIF HKL | C6 H12 O6 | P 21 | 6.86637; 9.12272; 6.21914 90; 106.596; 90 | 373.338 | Bekö, Sándor L.; Alig, Edith; Schmidt, Martin U.; van de Streek, Jacco On the correlation between hydrogen bonding and melting points in the inositols IUCrJ, 2013, 1, 61-73 |
| 1543056 | CIF HKL | C6 H12 O6 | P 21/c | 10.1435; 8.1542; 8.6239 90; 92.3556; 90 | 712.7 | Bekö, Sándor L.; Alig, Edith; Schmidt, Martin U.; van de Streek, Jacco On the correlation between hydrogen bonding and melting points in the inositols IUCrJ, 2013, 1, 61-73 |
| 1543220 | CIF | C12 H8 Br N O2 | P 1 21 1 | 9.991; 14.1075; 15.656 90; 102; 90 | 2158.5 | Burgener, Matthias; Aboulfadl, Hanane; Labat, Gaël Charles; Bonin, Michel; Sommer, Martin; Sankolli, Ravish; Wübbenhorst, Michael; Hulliger, Jürg Peculiar orientational disorder in 4-bromo-4'-nitrobiphenyl (BNBP) and 4-bromo-4'-cyanobiphenyl (BCNBP) leading to bipolar crystals IUCrJ, 2016, 3, 219-225 |
| 1543221 | CIF | C12 H8 Br N O2 | P 1 21 1 | 9.971; 14.1307; 15.65 90; 101.71; 90 | 2159.1 | Burgener, Matthias; Aboulfadl, Hanane; Labat, Gaël Charles; Bonin, Michel; Sommer, Martin; Sankolli, Ravish; Wübbenhorst, Michael; Hulliger, Jürg Peculiar orientational disorder in 4-bromo-4'-nitrobiphenyl (BNBP) and 4-bromo-4'-cyanobiphenyl (BCNBP) leading to bipolar crystals IUCrJ, 2016, 3, 219-225 |
| 1543222 | CIF | C13 H8 Br N | P 1 21 1 | 9.6028; 14.6523; 15.5726 90; 97.34; 90 | 2173.2 | Burgener, Matthias; Aboulfadl, Hanane; Labat, Gaël Charles; Bonin, Michel; Sommer, Martin; Sankolli, Ravish; Wübbenhorst, Michael; Hulliger, Jürg Peculiar orientational disorder in 4-bromo-4'-nitrobiphenyl (BNBP) and 4-bromo-4'-cyanobiphenyl (BCNBP) leading to bipolar crystals IUCrJ, 2016, 3, 219-225 |
| 1543223 | CIF | C13 H8 Br N | P 1 21 1 | 9.5964; 14.6438; 15.5585 90; 97.429; 90 | 2168 | Burgener, Matthias; Aboulfadl, Hanane; Labat, Gaël Charles; Bonin, Michel; Sommer, Martin; Sankolli, Ravish; Wübbenhorst, Michael; Hulliger, Jürg Peculiar orientational disorder in 4-bromo-4'-nitrobiphenyl (BNBP) and 4-bromo-4'-cyanobiphenyl (BCNBP) leading to bipolar crystals IUCrJ, 2016, 3, 219-225 |
| 1543412 | CIF Paper | C45 H32 Cu2 I2 N4 S1.95 | I 4/m c m | 13.2563; 13.2563; 27.5616 90; 90; 90 | 4843.39 | Kitagawa, Hakuba; Ohtsu, Hiroyoshi; Cruz-Cabeza, Aurora J.; Kawano, Masaki Isolation and evolution of labile sulfur allotropesviakinetic encapsulation in interactive porous networks IUCrJ, 2016, 3 |
| 1543413 | CIF | C45 H32 Cu1.88 I1.88 N4 S3 | P -4 | 26.7176; 26.7176; 7.1942 90; 90; 90 | 5135.4 | Kitagawa, Hakuba; Ohtsu, Hiroyoshi; Cruz-Cabeza, Aurora J.; Kawano, Masaki Isolation and evolution of labile sulfur allotropesviakinetic encapsulation in interactive porous networks IUCrJ, 2016, 3 |
| 1543414 | CIF | C45 H32 Cu1.88 I1.88 N4 S3.01 | I -4 | 26.8758; 26.8758; 7.1689 90; 90; 90 | 5178.16 | Kitagawa, Hakuba; Ohtsu, Hiroyoshi; Cruz-Cabeza, Aurora J.; Kawano, Masaki Isolation and evolution of labile sulfur allotropesviakinetic encapsulation in interactive porous networks IUCrJ, 2016, 3 |
| 1543415 | CIF | C45 H32 Cu1.88 I1.88 N4 S3.01 | I -4 | 26.8987; 26.8987; 7.1788 90; 90; 90 | 5194.15 | Kitagawa, Hakuba; Ohtsu, Hiroyoshi; Cruz-Cabeza, Aurora J.; Kawano, Masaki Isolation and evolution of labile sulfur allotropesviakinetic encapsulation in interactive porous networks IUCrJ, 2016, 3 |
| 1543416 | CIF | C45 H32 Cu1.85 I1.85 N4 S3 | I -4 | 26.8664; 26.8664; 7.1717 90; 90; 90 | 5176.56 | Kitagawa, Hakuba; Ohtsu, Hiroyoshi; Cruz-Cabeza, Aurora J.; Kawano, Masaki Isolation and evolution of labile sulfur allotropesviakinetic encapsulation in interactive porous networks IUCrJ, 2016, 3 |
| 1543858 | CIF Paper | C4 H9 N O2 | I 1 2 1 | 9.6246; 5.2079; 43.103 90; 100.201; 90 | 2126.3 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543859 | CIF | C4 H9 N O2 | P 1 21 1 | 9.6176; 5.2126; 21.768 90; 101.123; 90 | 1070.79 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543860 | CIF | C4 H9 N O2 | P 1 21 1 | 9.6132; 5.2239; 22.4134 90; 101.453; 90 | 1103.15 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543861 | CIF | C4 H9 N O2 | C 1 2 1 | 9.6233; 5.2274; 22.877 90; 100.764; 90 | 1130.6 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543862 | CIF | C5 H11 N O2 | P 1 21 1 | 9.6123; 5.1222; 13.183 90; 98.609; 90 | 641.77 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543863 | CIF | C5 H11 N O2 | P 1 21 1 | 9.604; 5.1222; 13.352 90; 97.137; 90 | 651.7 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543864 | CIF | C5 H11 N O2 | I 1 2 1 | 9.5868; 5.156; 27.477 90; 93.203; 90 | 1356.1 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543865 | CIF | C5 H11 N O2 | I 1 2 1 | 9.5855; 5.1752; 27.959 90; 92.057; 90 | 1386.1 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543866 | CIF | C5 H11 N O2 | C 1 2 1 | 9.589; 5.2054; 14.698 90; 104.77; 90 | 709.4 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543867 | CIF | C6 H13 N O2 | C 1 2 1 | 28.516; 5.2346; 32.233 90; 116.25; 90 | 4315.2 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543868 | CIF | C6 H13 N O2 | C 1 2 1 | 9.5327; 5.2545; 14.959 90; 97.628; 90 | 742.66 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543869 | CIF | C6 H13 N O2 | C 1 2 1 | 9.5633; 5.2287; 15.674 90; 93.695; 90 | 782.1 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543870 | CIF | C6 H13 N O2 | C 1 2 1 | 9.6033; 5.2223; 15.983 90; 90.916; 90 | 801.5 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543871 | CIF | C6 H13 N O2 | C 1 2 1 | 9.648; 5.252; 16.561 90; 103.11; 90 | 817.3 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543872 | CIF | C5 H11 N O2 S | P 1 21 1 | 9.5118; 5.1936; 15.3419 90; 97.635; 90 | 751.18 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543873 | CIF | C5 H11 N O2 S | P 1 21 1 | 9.5473; 5.183; 15.583 90; 94.98; 90 | 768.19 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
| 1543874 | CIF | C5 H11 N O2 S | P 1 21 1 | 9.588; 5.203; 16.101 90; 99.869; 90 | 791.3 | Görbitz, Carl Henrik; Karen, Pavel; Dušek, Michal; Petříček, Václav An exceptional series of phase transitions in hydrophobic amino acids with linear side chains IUCrJ, 2016, 3 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!