Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1513922 | CIF | C13 H25 N O4 | P 1 21/c 1 | 20.097; 5.6328; 26.033 90; 105.683; 90 | 2837.3 | Rigoli, Jared W.; Guzei, Ilia A.; Schomaker, Jennifer M. Aminodiols via Stereocontrolled Oxidation of Methyleneaziridines. Organic letters, 2014, 16, 1696-1699 |
| 1513923 | CIF | C12 H23 N O4 | P 1 21/c 1 | 13.862; 9.1079; 10.5256 90; 102.094; 90 | 1299.4 | Rigoli, Jared W.; Guzei, Ilia A.; Schomaker, Jennifer M. Aminodiols via Stereocontrolled Oxidation of Methyleneaziridines. Organic letters, 2014, 16, 1696-1699 |
| 1513924 | CIF | C28.89 H34.77 N3 O10.94 | C 1 2/c 1 | 35.053; 8.354; 25.955 90; 129.604; 90 | 5856 | Rigoli, Jared W.; Guzei, Ilia A.; Schomaker, Jennifer M. Aminodiols via Stereocontrolled Oxidation of Methyleneaziridines. Organic letters, 2014, 16, 1696-1699 |
| 1513925 | CIF | C27 H31 N3 O10 | P -1 | 7.988; 13.4927; 15.604 108.116; 93.05; 104.286 | 1533.5 | Rigoli, Jared W.; Guzei, Ilia A.; Schomaker, Jennifer M. Aminodiols via Stereocontrolled Oxidation of Methyleneaziridines. Organic letters, 2014, 16, 1696-1699 |
| 1513926 | CIF | C56 H76 F9 N3 O16 | P -1 | 13.7974; 14.6937; 15.3341 95.649; 97.703; 95.445 | 3047.3 | Rigoli, Jared W.; Guzei, Ilia A.; Schomaker, Jennifer M. Aminodiols via Stereocontrolled Oxidation of Methyleneaziridines. Organic letters, 2014, 16, 1696-1699 |
| 1513927 | CIF | C28 H21 Br N2 O10 | P 1 21/c 1 | 8.043; 14.966; 21.126 90; 91.963; 90 | 2541.5 | Castillo-Contreras, Emmanuel B; Dake, Gregory R. DMAP Promoted Tandem Addition Reactions Forming Substituted Tetrahydroxanthones. Organic letters, 2014, 16, 1642-1645 |
| 1513928 | CIF | C30 H22 N2 O10 | P 1 21/c 1 | 8.395; 14.767; 20.845 90; 92.298; 90 | 2582.1 | Castillo-Contreras, Emmanuel B; Dake, Gregory R. DMAP Promoted Tandem Addition Reactions Forming Substituted Tetrahydroxanthones. Organic letters, 2014, 16, 1642-1645 |
| 1513929 | CIF | C75 H27 N O4 | P -1 | 10.1322; 14.72; 15.8556 105.938; 93.37; 108.963 | 2121.81 | Aroua, Safwan; Schweizer, W. Bernd; Yamakoshi, Yoko C60 Pyrrolidine Bis-carboxylic Acid Derivative as a Versatile Precursor for Biocompatible Fullerenes. Organic letters, 2014, 16, 1688-1691 |
| 1513930 | CIF | C31 H24 Cl N | P -1 | 9.6185; 10.2636; 12.3384 76.047; 78.775; 81.549 | 1153.08 | Bunescu, Ala; Wang, Qian; Zhu, Jieping Three-Component Povarov Reaction-Heteroannulation with Arynes: Synthesis of 5,6-Dihydroindolo[1,2-a]quinolines. Organic letters, 2014, 16, 1756-1759 |
| 1513931 | CIF | C19 H14 Cl N O5 | P 21 21 21 | 8.0659; 8.7522; 23.942 90; 90; 90 | 1690.2 | Zari, Sergei; Kudrjashova, Marina; Pehk, Tõnis; Lopp, Margus; Kanger, Tõnis Remote activation of the nucleophilicity of isatin. Organic letters, 2014, 16, 1740-1743 |
| 1513932 | CIF | C32 H25 N O2 S | P 1 21/c 1 | 10.2775; 11.529; 21.0711 90; 101.425; 90 | 2447.2 | Zhu, Can; Ma, Shengming Efficient Carbazole Synthesis via Pd/Cu-Cocatalyzed Cross-Coupling/Isomerization of 2-Allyl-3-iodoindoles and Terminal Alkynes. Organic letters, 2014, 16, 1542-1545 |
| 1513933 | CIF | C20 H17 N O2 S | P 1 21/c 1 | 12.928; 11.9718; 11.6528 90; 114.04; 90 | 1647.1 | Zhu, Can; Ma, Shengming Efficient Carbazole Synthesis via Pd/Cu-Cocatalyzed Cross-Coupling/Isomerization of 2-Allyl-3-iodoindoles and Terminal Alkynes. Organic letters, 2014, 16, 1542-1545 |
| 1513934 | CIF | C26 H18 F N O3 S | P 1 21/c 1 | 11.29; 15.2347; 13.7812 90; 110.517; 90 | 2220.01 | Li, Zexiang; Ling, Fei; Cheng, Dong; Ma, Cheng Pd-Catalyzed Branching Cyclizations of Enediyne-Imides toward Furo[2,3-b]pyridines. Organic letters, 2014, 16, 1822-1825 |
| 1513935 | CIF | C37 H29 N O | P -1 | 10.8495; 12.3266; 12.3307 106.273; 95.855; 114.131 | 1399.8 | Li, Zexiang; Ling, Fei; Cheng, Dong; Ma, Cheng Pd-Catalyzed Branching Cyclizations of Enediyne-Imides toward Furo[2,3-b]pyridines. Organic letters, 2014, 16, 1822-1825 |
| 1513936 | CIF | C29 H24 Br N O3 S | P -1 | 13.4073; 13.4502; 15.0436 77.579; 89.394; 74.486 | 2549.62 | Li, Zexiang; Ling, Fei; Cheng, Dong; Ma, Cheng Pd-Catalyzed Branching Cyclizations of Enediyne-Imides toward Furo[2,3-b]pyridines. Organic letters, 2014, 16, 1822-1825 |
| 1513937 | CIF | C31 H30 F6 N6 O3 S | P 1 21/c 1 | 13.442; 23.75; 9.908 90; 99.766; 90 | 3117.3 | Osorio-Planes, Laura; Rodríguez-Escrich, Carles; Pericàs, Miquel A Photoswitchable thioureas for the external manipulation of catalytic activity. Organic letters, 2014, 16, 1704-1707 |
| 1513938 | CIF | C24 H18 F6 N4 O2 S | P -1 | 8.695; 9.993; 13.764 80.053; 87.203; 75.852 | 1142.2 | Osorio-Planes, Laura; Rodríguez-Escrich, Carles; Pericàs, Miquel A Photoswitchable thioureas for the external manipulation of catalytic activity. Organic letters, 2014, 16, 1704-1707 |
| 1513939 | CIF | C29 H24 Br N O5 | P 21 21 21 | 8.915; 11.1839; 25.103 90; 90; 90 | 2502.9 | Zhao, Shuai; Lin, Jun-Bing; Zhao, Yuan-Yuan; Liang, Yong-Min; Xu, Peng-Fei Hydrogen-Bond-Directed Formal [5 + 1] Annulations of Oxindoles with Ester-Linked Bisenones: Facile Access to Chiral Spirooxindole δ-Lactones. Organic letters, 2014, 16, 1802-1805 |
| 1513940 | CIF | C26 H19 N5 | P -1 | 8.4418; 10.0416; 12.6007 71.386; 80.108; 80.498 | 990.2 | Gulevskaya, Anna V.; Tyaglivy, Alexander S.; Pozharskii, Alexander F.; Nelina-Nemtseva, Julia I; Steglenko, Dmitry V. Heterocyclization of Enediynes Promoted by Sodium Azide: A Case of Ambiguity of X-ray Data and Structure Revision. Organic letters, 2014, 16, 1582-1585 |
| 1513941 | CIF | C36 H19 N7 | P -1 | 7.6291; 12.2206; 14.8111 87.143; 83.175; 73.598 | 1315.1 | Gulevskaya, Anna V.; Tyaglivy, Alexander S.; Pozharskii, Alexander F.; Nelina-Nemtseva, Julia I; Steglenko, Dmitry V. Heterocyclization of Enediynes Promoted by Sodium Azide: A Case of Ambiguity of X-ray Data and Structure Revision. Organic letters, 2014, 16, 1582-1585 |
| 1513942 | CIF | C22 H15 N3 | P 1 21/n 1 | 9.586; 9.8319; 16.7791 90; 91.418; 90 | 1580.92 | Gulevskaya, Anna V.; Tyaglivy, Alexander S.; Pozharskii, Alexander F.; Nelina-Nemtseva, Julia I; Steglenko, Dmitry V. Heterocyclization of Enediynes Promoted by Sodium Azide: A Case of Ambiguity of X-ray Data and Structure Revision. Organic letters, 2014, 16, 1582-1585 |
| 1513943 | CIF | C20 H17 N3 | P 1 21/c 1 | 13.0279; 11.261; 11.0155 90; 108.566; 90 | 1531.9 | Gulevskaya, Anna V.; Tyaglivy, Alexander S.; Pozharskii, Alexander F.; Nelina-Nemtseva, Julia I; Steglenko, Dmitry V. Heterocyclization of Enediynes Promoted by Sodium Azide: A Case of Ambiguity of X-ray Data and Structure Revision. Organic letters, 2014, 16, 1582-1585 |
| 1513944 | CIF | C17 H16 F3 N3 | P 1 21/c 1 | 14.4399; 7.9155; 26.9248 90; 100.693; 90 | 3024 | Gulevskaya, Anna V.; Tyaglivy, Alexander S.; Pozharskii, Alexander F.; Nelina-Nemtseva, Julia I; Steglenko, Dmitry V. Heterocyclization of Enediynes Promoted by Sodium Azide: A Case of Ambiguity of X-ray Data and Structure Revision. Organic letters, 2014, 16, 1582-1585 |
| 1513945 | CIF | C27 H32 N2 O4 S | P 21 21 21 | 6.5295; 16.1868; 22.781 90; 90; 90 | 2407.8 | Fang, Li-Chao; Hsung, Richard P. Stereoselective Synthesis of Isoquinuclidines through an Aza-[4 + 2] Cycloaddition of Chiral Cyclic 2-Amidodienes. Organic letters, 2014, 16, 1826-1829 |
| 1513946 | CIF | C18 H17 Cl N4 O4 | P 1 21 1 | 8.2102; 7.2353; 29.835 90; 90.168; 90 | 1772.3 | Yin, Qin; You, Shu-Li Asymmetric Chlorination/Ring Expansion for the Synthesis of α-Quaternary Cycloalkanones. Organic letters, 2014, 16, 1810-1813 |
| 1513947 | CIF | C9 H8 F3 N O2 | C 1 2/c 1 | 15.293; 8.606; 14.701 90; 106.01; 90 | 1859.8 | Xie, Jin; Yuan, Xiangai; Abdukader, Ablimit; Zhu, Chengjian; Ma, Jing Visible-light-promoted radical C-h trifluoromethylation of free anilines. Organic letters, 2014, 16, 1768-1771 |
| 1513948 | CIF | C8 H8 F3 N O2 S | P b c a | 7.968; 15.3; 16.954 90; 90; 90 | 2066.9 | Xie, Jin; Yuan, Xiangai; Abdukader, Ablimit; Zhu, Chengjian; Ma, Jing Visible-light-promoted radical C-h trifluoromethylation of free anilines. Organic letters, 2014, 16, 1768-1771 |
| 1513949 | CIF | C121 H108 Cl2 O4 | P 1 21/c 1 | 19.4814; 18.4101; 18.5749 90; 99.456; 90 | 6571.4 | Tran-Van, Anne-Florence; Huxol, Elena; Basler, Jonathan M.; Neuburger, Markus; Adjizian, Jean-Joseph; Ewels, Chris P.; Wegner, Hermann A. Synthesis of substituted [8]cycloparaphenylenes by [2 + 2 + 2] cycloaddition. Organic letters, 2014, 16, 1594-1597 |
| 1513950 | CIF | C11 H9 F3 N2 O | P 1 21/c 1 | 7.8552; 5.5784; 24.405 90; 93.577; 90 | 1067.3 | Wang, Shuai; Nie, Jing; Zheng, Yan; Ma, Jun-An A direct copper-promoted three-component entry to trifluoromethylketoximes. Organic letters, 2014, 16, 1606-1609 |
| 1513951 | CIF | C45 H31 N O2 | P 1 21/c 1 | 16.1601; 8.647; 22.3451 90; 94.538; 90 | 3112.6 | Bock, Harald; Subervie, Daniel; Mathey, Pierre; Pradhan, Anirban; Sarkar, Parantap; Dechambenoit, Pierre; Hillard, Elizabeth A.; Durola, Fabien Helicenes from diarylmaleimides. Organic letters, 2014, 16, 1546-1549 |
| 1513952 | CIF | C57 H59 N O2 | A b a 2 | 23.975; 82.044; 14.299 90; 90; 90 | 28126 | Bock, Harald; Subervie, Daniel; Mathey, Pierre; Pradhan, Anirban; Sarkar, Parantap; Dechambenoit, Pierre; Hillard, Elizabeth A.; Durola, Fabien Helicenes from diarylmaleimides. Organic letters, 2014, 16, 1546-1549 |
| 1513953 | CIF | C27 H27 N O5 | C 1 2/c 1 | 27.41; 7.7863; 22.292 90; 107.21; 90 | 4544.6 | Kim, Yong Wook; Georg, Gunda I. Boron-Heck Reaction of Cyclic Enaminones: Regioselective Direct Arylation via Oxidative Palladium(II) Catalysis. Organic letters, 2014, 16, 1574-1577 |
| 1513954 | CIF | C23 H20 O5 | P 1 21/c 1 | 10.0755; 13.4968; 13.586 90; 93.953; 90 | 1843.1 | Yamamoto, Yoshihiko; Matsui, Kazuma; Shibuya, Masatoshi Tandem ruthenium-catalyzed transfer-hydrogenative cyclization/intramolecular diels-alder reaction of enediynes affording dihydrocoumarin-fused polycycles. Organic letters, 2014, 16, 1806-1809 |
| 1513955 | CIF | C16 H17 N O6 | P -1 | 7.5175; 10.5792; 11.8536 115.153; 102.95; 96.901 | 806.44 | Boyer, Alistair Rhodium(II)-Catalyzed Stereocontrolled Synthesis of Dihydrofuran-3-imines from 1-Tosyl-1,2,3-triazoles. Organic letters, 2014, 16, 1660-1663 |
| 1513956 | CIF | Li Mn O2 | P m n m :2 | 2.805; 5.757; 4.572 90; 90; 90 | 73.83 | Hoppe, R.; Brachtel, G.; Jansen, M. Zur Kenntnis der Oxomanganate(III):, Über LiMnO~2~ und β-NaMnO~2~ [1] Zeitschrift fuer Anorganische und Allgemeine Chemie, 1975, 417, 1-10 |
| 1513958 | CIF | Li2 Mn O3 | C 1 2/c 1 | 4.928; 8.533; 9.604 90; 99.5; 90 | 398.316 | Jansen, M.; Hoppe, R. Zur Kenntnis der NaCl Struktur Familie: neue Untersuchungen an Li~2~MnO~3~ Zeitschrift fuer Anorganische und Allgemeine Chemie, 1973, 397, 279-289 |
| 1513959 | CIF | Li2 Mn O2 | P -3 m 1 | 3.195; 3.195; 5.303 90; 90; 120 | 46.88 | David, W. I. F.; Goodenough, J. B.; Thackeray, M. M.; Thomas, M. G. S. R. The Crystal structure of Li2 Mn O2 Revue de Chimie Minerale, 1983, 20, 636-642 |
| 1513960 | CIF | Li0.83 Mn1.76 O4 | F d -3 m :2 | 8.174; 8.174; 8.174 90; 90; 90 | 546.14 | de Kock, A.; Rossouw, M. H.; de Picciotto, L. A.; Thackeray, M. M.; David, W. I. F.; Ibberson, R. M. Defect spinels in the system Li2 O * y(Mn O2) (y>2.5): A neutron- diffraction study and electrochemical characterization of Li2 Mn4 O9 Materials Research Bulletin, 1990, 25, 657-664 |
| 1513961 | CIF | Li0.03 Mn2 O4 | F d -3 m :2 | 8.029; 8.029; 8.029 90; 90; 90 | 517.6 | Mosbah, A.; Verbaere, A.; Tournoux, M. Phases Lix Mn O2 lambda rattachees au type spinelle Materials Research Bulletin, 1983, 18, 1375-1381 |
| 1513962 | CIF | Li Mn2 O4 | F d -3 m :2 | 8.245; 8.245; 8.245 90; 90; 90 | 560.5 | Mosbah, A.; Verbaere, A.; Tournoux, M. Phases Lix Mn O2 lambda rattachees au type spinelle Materials Research Bulletin, 1983, 1375-1381 |
| 1513963 | CIF | Li Mn O2 | I 41/a m d :2 | 5.6504; 5.6504; 9.242 90; 90; 90 | 295.07 | Mosbah, A.; Verbaere, A.; Tournoux, M. Phases Lix Mn O2 lambda rattachees au type spinelle Materials Research Bulletin, 1938, 18, 1375-1381 |
| 1513964 | CIF | Li Mn2 O4 | F d -3 m :2 | 8.251; 8.251; 8.251 90; 90; 90 | 561.7 | Berg, H.; Thomas, J. O.; Wen, L.; Farrington, G. C. A neutron diffraction study of Ni substituted Li Mn2 O4 Solid State Ionics, 1998, 112, 165-168 |
| 1513965 | CIF | Li Mn2 O4 | F d -3 m :1 | 8.2383; 8.2383; 8.2383 90; 90; 90 | 559.13 | Yoo, Kwang Soo; Cho, Nam Woong; Oh, Yong-Joo Structural and electrical characterization of Li (Mn(1-d) Ti(d))2 O4 Solid State Ionics, 1998, 113, 43-49 |
| 1513966 | CIF | Li Mn2 O4 | F d -3 m :1 | 8.2402; 8.2402; 8.2402 90; 90; 90 | 559.517 | Shimakawa, Y.; Numata, T.; Tabuchi, J. Verwey-type transition and magnetic properties of the LiMn~2~O~4~ spinels Journal of Solid State Chemistry, 1997, 131, 138-143 |
| 1513967 | CIF | Li Mn2 O4 | F d d d :2 | 24.75193; 24.87184; 8.1995 90; 90; 90 | 5047.83 | Piszora, P. Temperature dependence of the order and distribution of Mn^3+^ and Mn^4+^ cations in orthorhombic LiMn~2~O~4~ Journal of Alloys and Compounds, 2004, 382, 112-118 |
| 1513968 | CIF | Li Mn2 O4 | F d d d :2 | 24.76328; 24.80455; 8.1936 90; 90; 90 | 5032.85 | Piszora, P. Temperature dependence of the order and distribution of Mn^3+^ and Mn^4+^ cations in orthorhombic LiMn~2~O~4~ Journal of Alloys and Compounds, 2004, 382, 112-118 |
| 1513969 | CIF | Li Mn2 O3.868 | F d -3 m :2 | 8.24609; 8.24609; 8.24609 90; 90; 90 | 560.718 | Yonemura, M.; Yamada, A.; Kobayashi, H.; Tabuchi, M.; Kamiyama, T.; Kawamoto, Y.; Kanno, R. Synthesis, structure and phase relationship in lithium manganese oxide spinel Journal of Materials Chemistry, 2004, 14, 1948-1958 |
| 1513971 | CIF | Li1.5 Mn0.97 O2 | I 41/a m d :2 | 5.672; 5.672; 9.182 90; 90; 90 | 295.399 | David, W. I. F.; Thackeray, M. M.; Bruce, P. G.; Goodenough, J. B. Lithium insertion into beta-MnO2 and the rutile spinel transformation Materials Research Bulletin, 1984, 19, 99-106 |
| 1513972 | CIF | Li Mn O4 | C m c m | 5.51402; 8.39754; 6.35911 90; 90; 90 | 294.454 | Fischer, D.; Hoppe, R.; Schaefer, W.; Knight, K. S. Koordinationszahl 4 oder 6 fuer Lithium?: Die Kristallstruktur von wasserfreiem Lithiumpermanganat, Li (Mn O4) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1993, 619, 1419-1425 |
| 1513973 | CIF | Li2 Mn O3 | C 1 2/c 1 | 4.921; 8.526; 9.606 90; 99.47; 90 | 397.5 | Riou, A.; Lecerf, A.; Gerault, Y.; Cudennec, Y. Etude structurale de Li2MnO3 Materials Research Bulletin, 1992, 27, 269-275 |
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