Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1502903 | CIF | C12 H12 Br N O3 S | P n a 21 | 20.724; 5.8436; 10.4288 90; 90; 90 | 1262.96 | Burkhard, Johannes A.; Guérot, Carine; Knust, Henner; Rogers-Evans, Mark; Carreira, Erick M. Synthesis and structural analysis of a new class of azaspiro[3.3]heptanes as building blocks for medicinal chemistry. Organic letters, 2010, 12, 1944-1947 |
| 1502904 | CIF | C12 H12 Br N O2 | P -1 | 8.0257; 11.3647; 12.6017 90.2638; 91.1398; 106.705 | 1100.61 | Burkhard, Johannes A.; Guérot, Carine; Knust, Henner; Rogers-Evans, Mark; Carreira, Erick M. Synthesis and structural analysis of a new class of azaspiro[3.3]heptanes as building blocks for medicinal chemistry. Organic letters, 2010, 12, 1944-1947 |
| 1502905 | CIF | C19 H19 Br N2 O3 S | P 1 21/c 1 | 16.3389; 17.2034; 6.701 90; 100.42; 90 | 1852.49 | Burkhard, Johannes A.; Guérot, Carine; Knust, Henner; Rogers-Evans, Mark; Carreira, Erick M. Synthesis and structural analysis of a new class of azaspiro[3.3]heptanes as building blocks for medicinal chemistry. Organic letters, 2010, 12, 1944-1947 |
| 1502906 | CIF | C12 H12 Br N O2 | P b c a | 9.9717; 8.8126; 25.5594 90; 90; 90 | 2246.07 | Burkhard, Johannes A.; Guérot, Carine; Knust, Henner; Rogers-Evans, Mark; Carreira, Erick M. Synthesis and structural analysis of a new class of azaspiro[3.3]heptanes as building blocks for medicinal chemistry. Organic letters, 2010, 12, 1944-1947 |
| 1502907 | CIF | C18 H21 N O4 | P 1 21/c 1 | 8.465; 9.532; 19.588 90; 101.51; 90 | 1548.7 | Zhang, Zhi-Wei; Li, Wei-Dong Z A facile total synthesis of hainanensine via an unusual rearrangement–annulation cascade. Organic letters, 2010, 12, 1649-1651 |
| 1502908 | CIF | C36 H37 Ag Fe N3 O3 P S | P 43 | 12.266; 12.266; 23.225 90; 90; 90 | 3494.3 | Oura, Ichiro; Shimizu, Kenta; Ogata, Kenichi; Fukuzawa, Shin-Ichi Highly endo-selective and enantioselective 1,3-dipolar cycloaddition of azomethine ylide with alpha-enones catalyzed by a silver(I)/ThioClickFerrophos complex. Organic letters, 2010, 12, 1752-1755 |
| 1502909 | CIF | C36 H36 Fe N3 P S | P 21 21 21 | 10.478; 10.566; 28.685 90; 90; 90 | 3175.7 | Oura, Ichiro; Shimizu, Kenta; Ogata, Kenichi; Fukuzawa, Shin-Ichi Highly endo-selective and enantioselective 1,3-dipolar cycloaddition of azomethine ylide with alpha-enones catalyzed by a silver(I)/ThioClickFerrophos complex. Organic letters, 2010, 12, 1752-1755 |
| 1502910 | CIF | C20 H20 Cl N O3 | P 21 21 21 | 8.817; 9.476; 21.33 90; 90; 90 | 1782.1 | Oura, Ichiro; Shimizu, Kenta; Ogata, Kenichi; Fukuzawa, Shin-Ichi Highly endo-selective and enantioselective 1,3-dipolar cycloaddition of azomethine ylide with alpha-enones catalyzed by a silver(I)/ThioClickFerrophos complex. Organic letters, 2010, 12, 1752-1755 |
| 1502911 | CIF | C210 H216 N26 O10 | P 1 21/n 1 | 42.39; 22.0472; 42.441 90; 116.159; 90 | 35602 | Chas, Marcos; Gil-Ramírez, Guzmán; Escudero-Adán, Eduardo C; Benet-Buchholz, Jordi; Ballester, Pablo Efficient self-sorting of a racemic tetra-urea calix[4]pyrrole into a single heterodimeric capsule. Organic letters, 2010, 12, 1740-1743 |
| 1502912 | CIF | C21 H16 O4 | P 1 21/n 1 | 13.3623; 8.7047; 13.9012 90; 100.174; 90 | 1591.5 | Guin, Joyram; Besnard, Céline; Lacour, Jérôme Synthesis, resolution, and stabilities of a cationic chromenoxanthene [4]helicene. Organic letters, 2010, 12, 1748-1751 |
| 1502913 | CIF | C15 H19 I N2 O | P 21 21 21 | 7.0476; 11.747; 18.4424 90; 90; 90 | 1526.81 | Yoshida, Kazuhiro; Horiuchi, Shingo; Takeichi, Tomoko; Shida, Hiroaki; Imamoto, Tsuneo; Yanagisawa, Akira Bicyclic imidazoles for modular synthesis of chiral imidazolium salts. Organic letters, 2010, 12, 1764-1767 |
| 1502914 | CIF | C32 H31 B Cl3 F4 N5 Ni | P 21 21 21 | 9.2702; 15.574; 22.6712 90; 90; 90 | 3273.1 | Yoshida, Kazuhiro; Horiuchi, Shingo; Takeichi, Tomoko; Shida, Hiroaki; Imamoto, Tsuneo; Yanagisawa, Akira Bicyclic imidazoles for modular synthesis of chiral imidazolium salts. Organic letters, 2010, 12, 1764-1767 |
| 1502915 | CIF | C22 H32 O2 Si | P 1 21/c 1 | 6.25173; 10.8641; 32.1254 90; 94.065; 90 | 2176.45 | Yatsumonji, Yasutaka; Sugita, Takenori; Tsubouchi, Akira; Takeda, Takeshi Preparation of syn-tertiary homoallylic alcohols utilizing allenyltitanocenes generated by reductive titanation of gamma-trimethylsilylpropargylic carbonates. Organic letters, 2010, 12, 1968-1971 |
| 1502916 | CIF | C13 H13 F3 O2 | P 1 21/c 1 | 10.1139; 11.3708; 10.8402 90; 98.848; 90 | 1231.82 | Yatsumonji, Yasutaka; Sugita, Takenori; Tsubouchi, Akira; Takeda, Takeshi Preparation of syn-tertiary homoallylic alcohols utilizing allenyltitanocenes generated by reductive titanation of gamma-trimethylsilylpropargylic carbonates. Organic letters, 2010, 12, 1968-1971 |
| 1502917 | CIF | C119.5 H174 N8 O23.5 | C 1 2/c 1 | 14.843; 24.4118; 32.8037 90; 95.254; 90 | 11836.3 | Beyeh, N. Kodiah; Valkonen, Arto; Rissanen, Kari Piperazine bridged resorcinarene cages. Organic letters, 2010, 12, 1392-1395 |
| 1502918 | CIF | C117.5 H170.9 N8 O21.5 | P 1 21/n 1 | 14.8499; 23.0759; 34.3415 90; 99.455; 90 | 11608.1 | Beyeh, N. Kodiah; Valkonen, Arto; Rissanen, Kari Piperazine bridged resorcinarene cages. Organic letters, 2010, 12, 1392-1395 |
| 1502919 | CIF | C19 H23 N O4 | P 1 21/c 1 | 18.189; 10.0277; 9.4674 90; 93.858; 90 | 1722.88 | Saha, Pipas; Reddy, U. C.; Bondalapati, S.; Saikia, Anil K. A novel synthesis of oxabicyclo[3.3.1]nonanone via (3,5)-oxonium-ene reaction. Organic letters, 2010, 12, 1824-1826 |
| 1502920 | CIF | C53.5 H45.5 N6.5 O7.5 Zn | P -1 | 13.341; 14.609; 16.419 105.126; 112.399; 103.261 | 2655 | Zhou, Zaichun; Cao, Chenzhong; Liu, Qiuhua; Jiang, Rongqing Hybrid orbital deformation (HOD) effect and spectral red-shift property of nonplanar porphyrin. Organic letters, 2010, 12, 1780-1783 |
| 1502921 | CIF | C17 H28 Cl N2 Rh | P b c a | 10.7478; 12.6636; 26.7573 90; 90; 90 | 3641.82 | Kim, Min; Chang, Sukbok Rhodium(NHC)-catalyzed amination of aryl bromides. Organic letters, 2010, 12, 1640-1643 |
| 1502922 | CIF | C20 H30 N2 O4 S Si | P 1 21/c 1 | 21.878; 8.1149; 12.6652 90; 105.15; 90 | 2170.4 | Dekorver, Kyle A.; Hsung, Richard P.; Lohse, Andrew G.; Zhang, Yu A divergent mechanistic course of Pd(0)-catalyzed aza-Claisen rearrangement and aza-Rautenstrauch-type cyclization of N-allyl ynamides. Organic letters, 2010, 12, 1840-1843 |
| 1502923 | CIF | C18 H17 N O2 S | P -1 | 8.5547; 10.0913; 11.0298 62.869; 70.922; 79.74 | 800.39 | Dekorver, Kyle A.; Hsung, Richard P.; Lohse, Andrew G.; Zhang, Yu A divergent mechanistic course of Pd(0)-catalyzed aza-Claisen rearrangement and aza-Rautenstrauch-type cyclization of N-allyl ynamides. Organic letters, 2010, 12, 1840-1843 |
| 1502924 | CIF | C134 H149 N9 Zn2 | C 1 2/c 1 | 29.021; 10.712; 49.322 90; 98.552; 90 | 15162 | Maeda, Chihiro; Shinokubo, Hiroshi; Osuka, Atsuhiro Synthesis of meso,meso'-pyrrole-bridged diporphyrins by Cu(I)-mediated annulation. Organic letters, 2010, 12, 1820-1823 |
| 1502925 | CIF | C12 H15 N O5 | P 1 21 1 | 7.206; 7.0551; 11.5524 90; 97.855; 90 | 581.8 | Tong, Xiao-Gang; Zhou, Li-Li; Wang, Yue-Hu; Xia, Chengfeng; Wang, Ye; Liang, Min; Hou, Fan-Fan; Cheng, Yong-Xian Acortatarins A and B, two novel antioxidative spiroalkaloids with a naturally unusual morpholine motif from Acorus tatarinowii. Organic letters, 2010, 12, 1844-1847 |
| 1502926 | CIF | C25 H22 N2 O2 | P 21 21 21 | 7.3472; 9.8722; 26.8795 90; 90; 90 | 1949.65 | Rohbogner, Christoph J.; Wirth, Stefan; Knochel, Paul Phosphorodiamidate-directed metalation of N-heterocycles using Mg- and Zn-TMP bases. Organic letters, 2010, 12, 1984-1987 |
| 1502927 | CIF | C16 H19 F3 N3 O5 P S | P 1 21/c 1 | 10.2499; 10.0927; 19.7258 90; 98.197; 90 | 2019.77 | Rohbogner, Christoph J.; Wirth, Stefan; Knochel, Paul Phosphorodiamidate-directed metalation of N-heterocycles using Mg- and Zn-TMP bases. Organic letters, 2010, 12, 1984-1987 |
| 1502928 | CIF | C22 H26 N3 O4 P | P 1 21/c 1 | 13.619; 11.209; 14.083 90; 94.89; 90 | 2142 | Rohbogner, Christoph J.; Wirth, Stefan; Knochel, Paul Phosphorodiamidate-directed metalation of N-heterocycles using Mg- and Zn-TMP bases. Organic letters, 2010, 12, 1984-1987 |
| 1502929 | CIF | C64 H62 N16 O33 Pd2 | P -1 | 14.326; 17.092; 17.164 89.769; 70.447; 84.337 | 3939 | Peinador, Carlos; Pía, Elena; Blanco, Víctor; García, Marcos D; Quintela, José M Complexation of pyrene in aqueous solution with a self-assembled palladium metallocycle. Organic letters, 2010, 12, 1380-1383 |
| 1502930 | CIF | C20 H25 N O4 | P 1 21/n 1 | 11.4585; 15.7832; 11.6608 90; 118.889; 90 | 1846.4 | Dunet, Julie; Lebeuf, Raphaël; Bose, Gopal; Robert, Frédéric; Landais, Yannick Straightforward assembly of the octahydroisoquinoline core of morphinan alkaloids. Organic letters, 2010, 12, 2178-2181 |
| 1502931 | CIF | C26 H23 N3 O7 | P 1 21/c 1 | 11.1057; 26.7309; 8.1244 90; 96.958; 90 | 2394.1 | Dunet, Julie; Lebeuf, Raphaël; Bose, Gopal; Robert, Frédéric; Landais, Yannick Straightforward assembly of the octahydroisoquinoline core of morphinan alkaloids. Organic letters, 2010, 12, 2178-2181 |
| 1502932 | CIF | C22 H25 N O4 | P -1 | 10.652; 12.569; 15.424 70.89; 80.85; 72.13 | 1853.16 | Dunet, Julie; Lebeuf, Raphaël; Bose, Gopal; Robert, Frédéric; Landais, Yannick Straightforward assembly of the octahydroisoquinoline core of morphinan alkaloids. Organic letters, 2010, 12, 2178-2181 |
| 1502933 | CIF | C15 H17 N O3 | P -1 | 5.3913; 10.1972; 12.9979 111.41; 98.712; 88.915 | 657.07 | Flores, Melissa A.; Bode, Jeffrey W. Chemoselective protection of alpha-ketoacids by direct annulations with oximes. Organic letters, 2010, 12, 1924-1927 |
| 1502934 | CIF | C17 H14 O4 S | P 1 21/c 1 | 8.2156; 17.9778; 11.0456 90; 106.053; 90 | 1567.8 | Gao, Meng; Yang, Yan; Wu, Yan-Dong; Deng, Cong; Cao, Li-Ping; Meng, Xiang-Gao; Wu, An-Xin Formation of unsymmetrical 1,4-enediones via a focusing domino strategy: cross-coupling of 1,3-dicarbonyl compounds and methyl ketones or terminal aryl alkenes. Organic letters, 2010, 12, 1856-1859 |
| 1502935 | CIF | C29 H17 N | P 1 21/c 1 | 11.9328; 6.1643; 25.0228 90; 91.946; 90 | 1839.55 | Tatar, Ameneh; Cejka, Jan; Král, Vladimír; Dolenský, Bohumil Spiro Tröger's base derivatives: another structural phoenix? Organic letters, 2010, 12, 1872-1875 |
| 1502936 | CIF | C27 H22 N2 O4 | P 1 21/c 1 | 14.4584; 12.419; 12.013 90; 107.201; 90 | 2060.6 | Tatar, Ameneh; Cejka, Jan; Král, Vladimír; Dolenský, Bohumil Spiro Tröger's base derivatives: another structural phoenix? Organic letters, 2010, 12, 1872-1875 |
| 1502937 | CIF | C12 H13 Cl O2 | P 21 21 21 | 6.792; 12.2189; 13.1263 90; 90; 90 | 1089.36 | Mukherjee, Santanu; Scopton, Alex P.; Corey, E. J. Enantioselective pathway for the synthesis of laurenditerpenol. Organic letters, 2010, 12, 1836-1838 |
| 1502938 | CIF | C30 H24 Cl N O2 | C 1 c 1 | 5.5972; 22.0274; 19.8862 90; 91.438; 90 | 2451 | Yu, Xiuzhao; Du, Bo; Wang, Kai; Zhang, Junliang Highly substituted 2,3-dihydroisoxazoles by Et(3)N-catalyzed tandem reaction of electron-deficient 1,3-conjugated enynes with hydroxylamines. Organic letters, 2010, 12, 1876-1879 |
| 1502939 | CIF | C18 H15 N O3 | P -1 | 6.876; 10.0689; 11.7443 68.416; 73.999; 72.367 | 708.08 | Yu, Xiuzhao; Du, Bo; Wang, Kai; Zhang, Junliang Highly substituted 2,3-dihydroisoxazoles by Et(3)N-catalyzed tandem reaction of electron-deficient 1,3-conjugated enynes with hydroxylamines. Organic letters, 2010, 12, 1876-1879 |
| 1502940 | CIF | C16 H14 Br N O3 S | P 1 21/n 1 | 10.252; 7.4707; 20.115 90; 100.217; 90 | 1516.2 | Samarakoon, Thiwanka B.; Hur, Moon Y.; Kurtz, Ryan D.; Hanson, Paul R. A formal [4 + 4] complementary ambiphile pairing reaction: a new cyclization pathway for ortho-quinone methides. Organic letters, 2010, 12, 2182-2185 |
| 1502941 | CIF | C19 H20 Br N O5 S | P 21 21 21 | 7.9647; 10.191; 24.5 90; 90; 90 | 1988.6 | Samarakoon, Thiwanka B.; Hur, Moon Y.; Kurtz, Ryan D.; Hanson, Paul R. A formal [4 + 4] complementary ambiphile pairing reaction: a new cyclization pathway for ortho-quinone methides. Organic letters, 2010, 12, 2182-2185 |
| 1502942 | CIF | C17 H21 Br N O2 P | P 1 21 1 | 5.4412; 18.481; 9.1796 90; 106.141; 90 | 886.7 | Zhao, Depeng; Mao, Lijuan; Wang, Yuan; Yang, Dongxu; Zhang, Quanliang; Wang, Rui Catalytic asymmetric hydrophosphinylation of alpha,beta-unsaturated N-acylpyrroles: application of dialkyl phosphine oxides in enantioselective synthesis of chiral phosphine oxides or phosphines. Organic letters, 2010, 12, 1880-1882 |
| 1502943 | CIF | C18 H24 N2 O7 | P 1 21 1 | 8.809; 9.2002; 11.103 90; 92.499; 90 | 899 | Konishi, Hideyuki; Lam, Tin Yiu; Malerich, Jeremiah P.; Rawal, Viresh H. Enantioselective alpha-amination of 1,3-dicarbonyl compounds using squaramide derivatives as hydrogen bonding catalysts. Organic letters, 2010, 12, 2028-2031 |
| 1502944 | CIF | C22 H30 O4 S2 | P 21 21 21 | 9.573; 14.186; 16.8432 90; 90; 90 | 2287.3 | Chen, Qing-An; Dong, Xiang; Chen, Mu-Wang; Wang, Duo-Sheng; Zhou, Yong-Gui; Li, Yu-Xue Highly effective and diastereoselective synthesis of axially chiral bis-sulfoxide ligands via oxidative aryl coupling. Organic letters, 2010, 12, 1928-1931 |
| 1502945 | CIF | C8 H10 B I O4 | P b c a | 9.1721; 14.0916; 16.1791 90; 90; 90 | 2091.14 | Al-Zoubi, Raed M; Hall, Dennis G. Mild silver(I)-mediated regioselective iodination and bromination of arylboronic acids. Organic letters, 2010, 12, 2480-2483 |
| 1502946 | CIF | C9 H12 B I O5 | P -1 | 7.3184; 9.7046; 9.7487 60.4397; 77.0255; 86.2786 | 586.02 | Al-Zoubi, Raed M; Hall, Dennis G. Mild silver(I)-mediated regioselective iodination and bromination of arylboronic acids. Organic letters, 2010, 12, 2480-2483 |
| 1502947 | CIF | C23 H31 N O Si | P 1 21/c 1 | 10.092; 11.0553; 19.3868 90; 97.512; 90 | 2144.4 | Lamas, Marie-Céline; Vaillard, Santiago E.; Wibbeling, Birgit; Studer, Armido Radical amination with trimethylstannylated benzophenone imine. Organic letters, 2010, 12, 2072-2075 |
| 1502948 | CIF | C16 H11 N O2 | P 1 21/a 1 | 11.701; 5.714; 17.818 90; 96.491; 90 | 1183.7 | Nakamura, Itaru; Okamoto, Masashi; Terada, Masahiro Gold-catalyzed cyclization and subsequent arylidene group transfer of O-propioloyl oximes. Organic letters, 2010, 12, 2453-2455 |
| 1502949 | CIF | C82 H111 F12 N5 O22 P2 | C 1 2/c 1 | 28.597; 10.465; 29.068 90; 95.36; 90 | 8661 | Su, Yong-Sheng; Chen, Chuan-Feng Novel anthracene-based cylindrical macrotricyclic polyether: powerful host for bispyridinium dications. Organic letters, 2010, 12, 1888-1891 |
| 1502950 | CIF | C85 H112 Cl3 F12 N5 O21 P2 | P 1 | 10.5785; 12.5308; 20.433 97.683; 97.63; 111.007 | 2457.6 | Su, Yong-Sheng; Chen, Chuan-Feng Novel anthracene-based cylindrical macrotricyclic polyether: powerful host for bispyridinium dications. Organic letters, 2010, 12, 1888-1891 |
| 1502951 | CIF | C86 H108 F12 N4 O20 P2 | P -1 | 11.732; 12.02; 18.224 79.289; 85.127; 88.981 | 2516 | Su, Yong-Sheng; Chen, Chuan-Feng Novel anthracene-based cylindrical macrotricyclic polyether: powerful host for bispyridinium dications. Organic letters, 2010, 12, 1888-1891 |
| 1502952 | CIF | C10 H14 N2 O4 Se | P 1 21 1 | 9.2745; 5.2059; 12.1233 90; 92.047; 90 | 584.97 | Alexander, Varughese; Choi, Won Jun; Chun, Jeongha; Kim, Hea Ok; Jeon, Ji Hye; Tosh, Dilip K.; Lee, Hyuk Woo; Chandra, Girish; Choi, Jungwon; Jeong, Lak Shin A new DNA building block, 4'-selenothymidine: synthesis and modification to 4'-seleno-AZT as a potential anti-HIV agent. Organic letters, 2010, 12, 2242-2245 |
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