Crystallography Open Database
Search results
Result: there are 299 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 'Beilstein journal of organic chemistry'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 4029769 | CIF | C10 H6 F12 O S2 | C c c a :2 | 21.271; 25.685; 10.563 90; 90; 90 | 5771 | Petrov, Viacheslav A.; Marshall, Will Acid catalyzed cyclodimerization of 2,2-bis(trifluoromethyl)-4-alkoxy-oxetanes and -thietanes. Synthesis of 2,2,6,6-tetrakis(trifluoromethyl)-4,8-dialkoxy-1,5-dioxocanes and 3,3,7,7-tetrakis(trifluoromethyl)-9-oxa-2,6-dithia-bicyclo[3.3.1]nonane. Beilstein journal of organic chemistry, 2010, 6, 46 |
| 4029770 | CIF | C29 H39 Cl N8 O6 | P 1 21/n 1 | 12.4965; 13.0048; 18.7848 90; 106.648; 90 | 2924.84 | Schmaderer, Harald; Bhuyan, Mouchumi; König, Burkhard Synthesis of rigidified flavin-guanidinium ion conjugates and investigation of their photocatalytic properties. Beilstein journal of organic chemistry, 2009, 5, 26 |
| 4029771 | CIF | C20 H22 N4 | P -1 | 9.3287; 9.479; 10.4921 87.4755; 70.5173; 76.4271 | 849.64 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029772 | CIF | C7 H10 N8 O2 | C 1 2/c 1 | 14.3618; 7.5472; 18.9922 90; 91.838; 90 | 2057.5 | Thomas, Reji; Kulkarni, G. U. A hydrogen-bonded channel structure formed by a complex of uracil and melamine. Beilstein journal of organic chemistry, 2007, 3, 17 |
| 4029773 | CIF | C63 H97 N8 O6 P S | P -1 | 11.3537; 15.5301; 18.6701 81.989; 76.082; 78.338 | 3115.09 | Makuc, Damjan; Hiscock, Jennifer R.; Light, Mark E.; Gale, Philip A.; Plavec, Janez NMR studies of anion-induced conformational changes in diindolylureas and diindolylthioureas. Beilstein journal of organic chemistry, 2011, 7, 1205-1214 |
| 4029774 | CIF | C19 H20 N4 | P 1 21/c 1 | 17.0057; 8.9486; 34.3882 90; 98.2202; 90 | 5179.33 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029775 | CIF | C24 H31 N O4 | P 1 21 1 | 6.6454; 17.9624; 9.3062 90; 98.981; 90 | 1097.24 | Adalder, Tapas Kumar; Adarsh, N. N.; Sankolli, Ravish; Dastidar, Parthasarathi Chiral gels derived from secondary ammonium salts of (1R,3S)-(+)-camphoric acid. Beilstein journal of organic chemistry, 2010, 6, 848-858 |
| 4029776 | CIF | C17 H28 N4 | C 1 2/c 1 | 33.1028; 6.1643; 20.2723 90; 125.581; 90 | 3364.33 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029777 | CIF | C17 H14 O | C 1 2/c 1 | 13.3991; 8.2341; 22.8014 90; 96.356; 90 | 2500.2 | Cadman, Christopher J.; Croft, Anna K. Anion-π interactions influence pK(a) values. Beilstein journal of organic chemistry, 2011, 7, 320-328 |
| 4029778 | CIF | C18 H33 N O4 | P 21 21 21 | 8.6977; 12.5877; 18.8825 90; 90; 90 | 2067.3 | Adalder, Tapas Kumar; Adarsh, N. N.; Sankolli, Ravish; Dastidar, Parthasarathi Chiral gels derived from secondary ammonium salts of (1R,3S)-(+)-camphoric acid. Beilstein journal of organic chemistry, 2010, 6, 848-858 |
| 4029779 | CIF | C21 H24 N4 | P 1 21/n 1 | 9.8002; 7.2445; 26.1183 90; 94.6725; 90 | 1848.17 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029780 | CIF | C26 H20 O8 | P -1 | 9.2883; 11.2794; 11.673 62.356; 89.008; 89.893 | 1083.15 | Arimura, Junya; Mizuta, Tsutomu; Hiraga, Yoshikazu; Abe, Manabu Formation of macrocyclic lactones in the Paternò-Büchi dimerization reaction. Beilstein journal of organic chemistry, 2011, 7, 265-269 |
| 4029781 | CIF | C34 H62 N2 O4 | P 1 21 1 | 12.2424; 17.278; 16.726 90; 98.199; 90 | 3501.8 | Adalder, Tapas Kumar; Adarsh, N. N.; Sankolli, Ravish; Dastidar, Parthasarathi Chiral gels derived from secondary ammonium salts of (1R,3S)-(+)-camphoric acid. Beilstein journal of organic chemistry, 2010, 6, 848-858 |
| 4029782 | CIF | C22 H20 N4 | P -1 | 5.7578; 10.3819; 15.1645 86.213; 79.332; 84.967 | 886.24 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029783 | CIF | C25 H33 B F3 N | P b c 21 | 8.3106; 16.12; 16.9678 90; 90; 90 | 2273.1 | Monot, Julien; Fensterbank, Louis; Malacria, Max; Lacôte, Emmanuel; Geib, Steven J.; Curran, Dennis P. CAAC Boranes. Synthesis and characterization of cyclic (alkyl) (amino) carbene borane complexes from BF₃ and BH₃. Beilstein journal of organic chemistry, 2010, 6, 709-712 |
| 4029784 | CIF | C23 H22 N4 | P 1 21/n 1 | 7.2282; 14.5797; 18.0219 90; 94.6029; 90 | 1893.11 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029785 | CIF | C23 H35 B F3 N | P 1 21/m 1 | 8.0309; 14.995; 9.5461 90; 106.162; 90 | 1104.1 | Monot, Julien; Fensterbank, Louis; Malacria, Max; Lacôte, Emmanuel; Geib, Steven J.; Curran, Dennis P. CAAC Boranes. Synthesis and characterization of cyclic (alkyl) (amino) carbene borane complexes from BF₃ and BH₃. Beilstein journal of organic chemistry, 2010, 6, 709-712 |
| 4029786 | CIF | C19 H32 N4 | P 1 21/c 1 | 11.5364; 10.5199; 31.4132 90; 97.9299; 90 | 3775.91 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029787 | CIF | C56 H48 N4 O12 | C 1 2 1 | 29.889; 5.2454; 31.439 90; 96.584; 90 | 4896.5 | Castilla, Ana Maria; Morgan Conn, M.; Ballester, Pablo Synthesis and binding studies of two new macrocyclic receptors for the stereoselective recognition of dipeptides. Beilstein journal of organic chemistry, 2010, 6, 5 |
| 4029788 | CIF | C20 H22 N4 O | P 1 21/n 1 | 5.717; 13.99; 22.318 90; 93.12; 90 | 1782.4 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029789 | CIF | C6 H7 Cl I N | P 21 a b | 8.28; 9.8354; 10.7554 90; 90; 90 | 875.89 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029790 | CIF | C6 H7 Br I N | P -1 | 10.065; 10.9183; 12.6269 100.866; 106.743; 95.177 | 1289.45 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029791 | CIF | C6 H9 I N O4 P | P c a b | 7.8119; 9.8242; 25.8681 90; 90; 90 | 1985.26 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029792 | CIF | C6 H9 Cl N O4 P | P c a b | 7.8654; 9.6441; 25.0515 90; 90; 90 | 1900.27 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029793 | CIF | C13 H15 Cl I N O | P 1 21/n 1 | 8.1841; 16.9194; 20.4094 90; 94.603; 90 | 2816.98 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029794 | CIF | C5.5 H6.5 Cl I N O0.25 | P -1 | 8.1913; 11.4208; 17.9429 80.027; 78.217; 76.302 | 1582.66 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029795 | CIF | C13 H9 I N2 O6 | P -1 | 8.1247; 8.4128; 11.7526 87.9511; 73.0323; 62.9872 | 680.09 | Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts. Beilstein journal of organic chemistry, 2010, 6, 4 |
| 4029796 | CIF | C19 H32 N4 | P 1 21/n 1 | 9.3059; 12.1138; 16.5226 90; 100.91; 90 | 1828.9 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029797 | CIF | C18 H30 N4 | P 1 21/c 1 | 14.3412; 10.9327; 11.1408 90; 91.0293; 90 | 1746.46 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029798 | CIF | C21 H30 N4 | P -1 | 9.3343; 9.6107; 12.4635 70.786; 74.417; 67.211 | 960.51 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029799 | CIF | C22 H26 N4 | P -1 | 10.7318; 11.9553; 17.3861 106.348; 91.1499; 111.053 | 1979.23 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029800 | CIF | C20 H28 N4 | P -1 | 8.9442; 9.2587; 12.0545 74.61; 82.151; 68.098 | 892.2 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029801 | CIF | C32 H30 N6 | P -1 | 10.2471; 10.8387; 13.1028 73.0483; 69.9698; 88.6849 | 1303.04 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029802 | CIF | C16 H26 N4 | P 1 21/n 1 | 5.5435; 27.744; 10.0705 90; 96.989; 90 | 1537.32 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029803 | CIF | C18 H29 N5 O2 | P n a 21 | 18.066; 10.234; 22.275 90; 90; 90 | 4118.4 | Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines. Beilstein journal of organic chemistry, 2008, 4, 23 |
| 4029804 | CIF | C30 H27 Cl2 N O3 | P 32 | 21.483; 21.483; 14.924 90; 90; 120 | 5964.9 | Akalay, Deniz; Dürner, Gerd; Bats, Jan W.; Göbel, Michael W C2-symmetric bisamidines: chiral Brønsted bases catalysing the Diels-Alder reaction of anthrones. Beilstein journal of organic chemistry, 2008, 4, 28 |
| 4029805 | CIF | C30 H29 N O3 | P 21 21 21 | 11.2325; 13.594; 15.866 90; 90; 90 | 2422.7 | Akalay, Deniz; Dürner, Gerd; Bats, Jan W.; Göbel, Michael W C2-symmetric bisamidines: chiral Brønsted bases catalysing the Diels-Alder reaction of anthrones. Beilstein journal of organic chemistry, 2008, 4, 28 |
| 4029806 | CIF | C74 H44 F68 I4 O4.5 | P -1 | 11.9956; 19.4176; 39.769 90.915; 92.614; 91.654 | 9248.3 | Osipov, Maksim; Chu, Qianli; Geib, Steven J.; Curran, Dennis P.; Weber, Stephen G. Synthesis of deep-cavity fluorous calix[4]arenes as molecular recognition scaffolds. Beilstein journal of organic chemistry, 2008, 4, 36 |
| 4029830 | CIF | C14 H16 Cl2 O3 | P 21 21 21 | 5.2508; 14.2668; 19.7267 90; 90; 90 | 1477.8 | Ding, Haixin; Li, Wei; Ruan, Zhizhong; Yang, Ruchun; Mao, Zhijie; Xiao, Qiang; Wu, Jun Concise total synthesis of two marine natural nucleosides: trachycladines A and B. Beilstein journal of organic chemistry, 2014, 10, 1681-1685 |
| 4029844 | CIF | C40 H34 N6 O4 | P -1 | 8.2597; 9.772; 11.0233 95.851; 99.783; 100.761 | 853.13 | Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes Macrocyclic bis(ureas) as ligands for anion complexation. Beilstein journal of organic chemistry, 2014, 10, 1834-1839 |
| 4029845 | CIF | C38 H32 N4 O4 S2 | P 1 21/c 1 | 8.2244; 17.995; 12.1198 90; 113.483; 90 | 1645.1 | Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes Macrocyclic bis(ureas) as ligands for anion complexation. Beilstein journal of organic chemistry, 2014, 10, 1834-1839 |
| 4029846 | CIF | C42 H40 Br N5 O2 | P 1 21/c 1 | 12.7152; 17.5556; 20.5472 90; 125.548; 90 | 3731.8 | Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes Macrocyclic bis(ureas) as ligands for anion complexation. Beilstein journal of organic chemistry, 2014, 10, 1834-1839 |
| 4029847 | CIF | C15 H10 N2 O | P 1 21/c 1 | 11.8302; 7.098; 13.47 90; 102.437; 90 | 1104.5 | Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes Macrocyclic bis(ureas) as ligands for anion complexation. Beilstein journal of organic chemistry, 2014, 10, 1834-1839 |
| 4029967 | CIF | C14 H12 F3 N O3 | P -1 | 9.8661; 12.1391; 12.6797 74.046; 77.445; 67.218 | 1335.61 | Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir (CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones. Beilstein journal of organic chemistry, 2014, 10, 2270-2278 |
| 4029968 | CIF | C12 H14 Cl N O2 | P 1 21/c 1 | 6.872; 22.4177; 7.7044 90; 90.798; 90 | 1186.78 | Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir (CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones. Beilstein journal of organic chemistry, 2014, 10, 2270-2278 |
| 4029969 | CIF | C18 H14 Br2 N2 | P 1 21/c 1 | 4.7721; 11.6674; 28.3435 90; 91.577; 90 | 1577.51 | Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir (CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones. Beilstein journal of organic chemistry, 2014, 10, 2270-2278 |
| 4029970 | CIF | C21 H24 O2 | P -1 | 6.5776; 7.4148; 17.7488 100.413; 92.503; 104.794 | 819.48 | Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir (CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones. Beilstein journal of organic chemistry, 2014, 10, 2270-2278 |
| 4029994 | CIF | C22 H17 F3 N2 O2 | P -1 | 7.4466; 11.1033; 12.5493 74.933; 73.64; 78.131 | 951.49 | Zhou, Xiaoli; Liu, Meiling; Luo, Puying; Lai, Yingjun; Yang, Tangtao; Ding, Qiuping Synthesis of 2-trifluoromethylpyrazolo[5,1-a]isoquinolines via silver triflate-catalyzed or electrophile-mediated one-pot tandem reaction. Beilstein journal of organic chemistry, 2014, 10, 2286-2292 |
| 4029995 | CIF | C18 H13 F3 I N2 O2 | C 1 2/c 1 | 19.222; 13.042; 14.091 90; 95.239; 90 | 3518 | Zhou, Xiaoli; Liu, Meiling; Luo, Puying; Lai, Yingjun; Yang, Tangtao; Ding, Qiuping Synthesis of 2-trifluoromethylpyrazolo[5,1-a]isoquinolines via silver triflate-catalyzed or electrophile-mediated one-pot tandem reaction. Beilstein journal of organic chemistry, 2014, 10, 2286-2292 |
| 4030315 | CIF | C18 H15 Br N2 O3 | P 1 21/c 1 | 13.5133; 13.5483; 9.6825 90; 92.293; 90 | 1771.3 | Singh, Radhey Mohan; Bharadwaj, Kishor Chandra; Tiwari, Dharmendra Kumar Morita-Baylis-Hillman reaction of acrylamide with isatin derivatives. Beilstein journal of organic chemistry, 2014, 10, 2975-2980 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

