Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1502303 | CIF | C23 H19 F O2 S2 | P -1 | 9.2779; 9.5225; 12.6163 90.857; 99.261; 113.392 | 1005.9 | Chowdhury, Sushobhan; Nandi, Ganesh Chandra; Samai, Subhasis; Singh, Maya Shankar Regioselective synthesis of tetrahydrothiochromen-5-ones via a one-pot three-component solvent-free domino protocol. Organic letters, 2011, 13, 3762-3765 |
| 1502304 | CIF | C27 H24 O6 S3 | P -1 | 8.3376; 10.1962; 16.0046 77.913; 85.229; 89.651 | 1325.72 | Chen, Jia-Hong; Wang, Shao-An; Liu, Yi-Hung; Wong, Ken-Tsung Synthesis and properties of novel C3-symmetric coplanar chromophores. Organic letters, 2011, 13, 4168-4171 |
| 1502305 | CIF | C155 H135 Cl9 O2 S6 | R -3 :H | 22.5627; 22.5627; 43.5749 90; 90; 120 | 19211 | Chen, Jia-Hong; Wang, Shao-An; Liu, Yi-Hung; Wong, Ken-Tsung Synthesis and properties of novel C3-symmetric coplanar chromophores. Organic letters, 2011, 13, 4168-4171 |
| 1502306 | CIF | C84 H96 S3 Si3 | C 1 2/c 1 | 48.802; 9.1918; 39.5359 90; 123.36; 90 | 14812.8 | Chen, Jia-Hong; Wang, Shao-An; Liu, Yi-Hung; Wong, Ken-Tsung Synthesis and properties of novel C3-symmetric coplanar chromophores. Organic letters, 2011, 13, 4168-4171 |
| 1502307 | CIF | C42 H50 N2 O14 | P 1 21/n 1 | 7.03389; 8.73956; 32.833 90; 93.7759; 90 | 2013.97 | Niu, Zhenbin; Slebodnick, Carla; Schoonover, Daniel; Azurmendi, Hugo; Harich, Kim; Gibson, Harry W. Pseudocryptand-type [2]pseudorotaxanes based on bis(meta-phenylene)-32-crown-10 derivatives and paraquats with remarkably improved association constants. Organic letters, 2011, 13, 3992-3995 |
| 1502308 | CIF | C63 H77 F18 N5 O15 P3 | P 1 21/n 1 | 20.4716; 12.92677; 26.7661 90; 93.5313; 90 | 7069.71 | Niu, Zhenbin; Slebodnick, Carla; Schoonover, Daniel; Azurmendi, Hugo; Harich, Kim; Gibson, Harry W. Pseudocryptand-type [2]pseudorotaxanes based on bis(meta-phenylene)-32-crown-10 derivatives and paraquats with remarkably improved association constants. Organic letters, 2011, 13, 3992-3995 |
| 1502309 | CIF | C60 H66 F12 N6 O14 P2 | P 1 21/n 1 | 10.4472; 31.1654; 21.6799 90; 98.224; 90 | 6986.2 | Niu, Zhenbin; Slebodnick, Carla; Schoonover, Daniel; Azurmendi, Hugo; Harich, Kim; Gibson, Harry W. Pseudocryptand-type [2]pseudorotaxanes based on bis(meta-phenylene)-32-crown-10 derivatives and paraquats with remarkably improved association constants. Organic letters, 2011, 13, 3992-3995 |
| 1502310 | CIF | C67.56 H76.33 F12 N6.78 O14 P2 | P 1 21/n 1 | 10.677; 31.7992; 21.0198 90; 97.495; 90 | 7075.7 | Niu, Zhenbin; Slebodnick, Carla; Schoonover, Daniel; Azurmendi, Hugo; Harich, Kim; Gibson, Harry W. Pseudocryptand-type [2]pseudorotaxanes based on bis(meta-phenylene)-32-crown-10 derivatives and paraquats with remarkably improved association constants. Organic letters, 2011, 13, 3992-3995 |
| 1502311 | CIF | C19 H18 O2 | P 1 21/c 1 | 9.9829; 7.6696; 19.7014 90; 93.905; 90 | 1504.93 | Briones, John F.; Davies, Huw M. L. Silver triflate-catalyzed cyclopropenation of internal alkynes with donor-/acceptor-substituted diazo compounds. Organic letters, 2011, 13, 3984-3987 |
| 1502312 | CIF | C17 H25 N O3 S | P 1 21 1 | 7.0411; 8.8042; 13.9063 90; 92.013; 90 | 861.54 | Söderman, Stefan C; Schwan, Adrian L. The diastereoselective alkylation of arenesulfenate anions using homochiral electrophiles. Organic letters, 2011, 13, 4192-4195 |
| 1502313 | CIF | C156 H199 Cl2 N29 O14.93 | P -1 | 13.2033; 19.022; 30.5196 87.879; 86.34; 75.761 | 7412.7 | Havel, Vaclav; Svec, Jan; Wimmerova, Michaela; Dusek, Michal; Pojarova, Michaela; Sindelar, Vladimir Bambus[n]urils: a new family of macrocyclic anion receptors. Organic letters, 2011, 13, 4000-4003 |
| 1502314 | CIF | C85 H149 I N25 O17 | P -1 | 13.2454; 13.5102; 29.984 85.77; 83.333; 66.044 | 4868.12 | Havel, Vaclav; Svec, Jan; Wimmerova, Michaela; Dusek, Michal; Pojarova, Michaela; Sindelar, Vladimir Bambus[n]urils: a new family of macrocyclic anion receptors. Organic letters, 2011, 13, 4000-4003 |
| 1502315 | CIF | C80 H79.59 N18 O8.79 | P -1 | 11.8221; 14.9512; 21.7562 90.37; 96.069; 110.902 | 3568.27 | Havel, Vaclav; Svec, Jan; Wimmerova, Michaela; Dusek, Michal; Pojarova, Michaela; Sindelar, Vladimir Bambus[n]urils: a new family of macrocyclic anion receptors. Organic letters, 2011, 13, 4000-4003 |
| 1502316 | CIF | C23 H24 Cl N O5 S | P 21 21 21 | 5.176; 9.5637; 44.8293 90; 90; 90 | 2219.13 | Medeiros, Matthew R.; Schaus, Scott E.; Porco, Jr, John A A cycloisomerization/Friedel-Crafts alkylation strategy for the synthesis of pyrano[3,4-b]indoles. Organic letters, 2011, 13, 4012-4015 |
| 1502317 | CIF | C23 H25 N O5 S | P 1 21 1 | 13.8192; 5.693; 14.7334 90; 116.69; 90 | 1035.61 | Medeiros, Matthew R.; Schaus, Scott E.; Porco, Jr, John A A cycloisomerization/Friedel-Crafts alkylation strategy for the synthesis of pyrano[3,4-b]indoles. Organic letters, 2011, 13, 4012-4015 |
| 1502318 | CIF | C18 H11 Cl N2 | P 1 21/c 1 | 10.9585; 8.8553; 15.429 90; 109.564; 90 | 1410.8 | Wang, Chao; Flanigan, Darrin M.; Zakharov, Lev N.; Blakemore, Paul R. Synthesis of 7,7'-dihydroxy-8,8'-biquinolyl (azaBINOL) via Pd-catalyzed directed double C-H functionalization of 8,8'-biquinolyl: emergence of an atropos from a tropos state. Organic letters, 2011, 13, 4024-4027 |
| 1502319 | CIF | C27 H26 O3 | P 1 21/c 1 | 11.968; 19.9487; 9.6958 90; 106.578; 90 | 2218.6 | Inami, Tasuku; Sako, Saori; Kurahashi, Takuya; Matsubara, Seijiro Methylenecyclopropanes in [4+1] cycloaddition with enones. Organic letters, 2011, 13, 3837-3839 |
| 1502320 | CIF | C20 H12 Cl N O2 | P 1 21/m 1 | 8.265; 6.753; 14.254 90; 103.68; 90 | 773 | Fei, Na; Yin, Hao; Wang, Shaozhong; Wang, Huaqin; Yao, Zhu-Jun CuCl2-promoted 6-endo-dig chlorocyclization and oxidative aromatization cascade: efficient construction of 1-azaanthraquinones from N-propargylaminoquinones. Organic letters, 2011, 13, 4208-4211 |
| 1502321 | CIF | C12 H18 O4 | P c c n | 27.989; 9.0736; 9.4414 90; 90; 90 | 2397.7 | Hao, Hong-Dong; Li, Yun; Han, Wei-Bo; Wu, Yikang A hydrogen peroxide based access to qinghaosu (artemisinin). Organic letters, 2011, 13, 4212-4215 |
| 1502322 | CIF | C15 H22 O4 | P 21 21 21 | 9.0867; 12.11; 13.383 90; 90; 90 | 1472.7 | Hao, Hong-Dong; Li, Yun; Han, Wei-Bo; Wu, Yikang A hydrogen peroxide based access to qinghaosu (artemisinin). Organic letters, 2011, 13, 4212-4215 |
| 1502323 | CIF | C42 H50 F6 O10 S6 | P -1 | 9.481; 12.997; 21.734 97.541; 100.665; 110.165 | 2414.73 | Kundrat, Ondrej; Eigner, Vaclav; Dvorakova, Hana; Lhotak, Pavel S-alkylation of thiacalixarenes: a long-neglected possibility in the calixarene family. Organic letters, 2011, 13, 4032-4035 |
| 1502324 | CIF | C25.75 H23 Br0.25 N2 O5.5 | P 1 21 1 | 13.505; 6.1813; 15.804 90; 93.51; 90 | 1316.8 | Varga, Szilárd; Jakab, Gergely; Drahos, László; Holczbauer, Tamás; Czugler, Mátyás; Soós, Tibor Double diastereocontrol in bifunctional thiourea organocatalysis: iterative Michael-Michael-Henry sequence regulated by the configuration of chiral catalysts. Organic letters, 2011, 13, 5416-5419 |
| 1502325 | CIF | C26 H30 N2 O7 | P 21 21 21 | 6.0225; 19.0267; 21.5818 90; 90; 90 | 2473.02 | Varga, Szilárd; Jakab, Gergely; Drahos, László; Holczbauer, Tamás; Czugler, Mátyás; Soós, Tibor Double diastereocontrol in bifunctional thiourea organocatalysis: iterative Michael-Michael-Henry sequence regulated by the configuration of chiral catalysts. Organic letters, 2011, 13, 5416-5419 |
| 1502326 | CIF | C17 H14 O8 | P -1 | 8.1082; 8.129; 12.9822 79.872; 85.732; 61.496 | 740.19 | Yu, Min; Snider, Barry B. Syntheses of chloroisosulochrin and isosulochrin and biomimetic elaboration to maldoxin, maldoxone, dihydromaldoxin, and dechlorodihydromaldoxin. Organic letters, 2011, 13, 4224-4227 |
| 1502327 | CIF | C29 H28.5 F3 I N3 O1.75 | P 1 21 1 | 13.5694; 17.621; 24.7835 90; 101.814; 90 | 5800.4 | Vu, Jenny M Baxter; Leighton, James L. A new synthesis of pyrrolidines by way of an enantioselective Mannich/diastereoselective hydroamination reaction sequence. Organic letters, 2011, 13, 4056-4059 |
| 1502328 | CIF | C24 H22 O3 | P -1 | 10.1304; 11.4; 17.702 76.36; 85.057; 71.691 | 1886 | Basheer, Ahmad; Mishima, Masaaki; Marek, Ilan Regioselective carbon-carbon bond cleavage in the oxidation of cyclopropenylcarbinols. Organic letters, 2011, 13, 4076-4079 |
| 1502329 | CIF | C38 H36 O2 Si | P -1 | 9.415; 9.448; 20.671 76.93; 82.6; 62.75 | 1591.7 | Basheer, Ahmad; Mishima, Masaaki; Marek, Ilan Regioselective carbon-carbon bond cleavage in the oxidation of cyclopropenylcarbinols. Organic letters, 2011, 13, 4076-4079 |
| 1502330 | CIF | C31 H22 O5 | C 1 2/c 1 | 20.496; 18.931; 15.444 90; 108.178; 90 | 5693 | Fan, Yukai; Feng, Pengju; Liu, Mao; Pan, Hongjie; Shi, Yian A concise approach to the dalesconol skeleton. Organic letters, 2011, 13, 4494-4497 |
| 1502331 | CIF | C33 H28 O6 | P -1 | 7.7247; 14.258; 22.761 84.359; 87.427; 87.679 | 2490.6 | Fan, Yukai; Feng, Pengju; Liu, Mao; Pan, Hongjie; Shi, Yian A concise approach to the dalesconol skeleton. Organic letters, 2011, 13, 4494-4497 |
| 1502332 | CIF | C33 H28 O6 | P 1 21 1 | 8.1397; 32.018; 9.9603 90; 97.59; 90 | 2573.1 | Fan, Yukai; Feng, Pengju; Liu, Mao; Pan, Hongjie; Shi, Yian A concise approach to the dalesconol skeleton. Organic letters, 2011, 13, 4494-4497 |
| 1502333 | CIF | C23 H30 N2 O6 S | P 1 21 1 | 7.5028; 5.9354; 25.0935 90; 90.569; 90 | 1117.41 | Peña-López, Miguel; Martínez, M. Montserrat; Sarandeses, Luis A.; Sestelo, José Pérez A Versatile Enantioselective Synthesis of Barrenazines Organic Letters, 2011, 13, 4151 |
| 1502334 | CIF | C24 H17 Br O3 | P 21 21 21 | 7.6826; 11.6731; 21.484 90; 90; 90 | 1926.7 | Rong, Zi-Qiang; Jia, Min-Qiang; You, Shu-Li Enantioselective N-heterocyclic carbene-catalyzed Michael addition to α,β-unsaturated aldehydes by redox oxidation. Organic letters, 2011, 13, 4080-4083 |
| 1502335 | CIF | C23 H25 B F2 I N3 | P 1 21/c 1 | 8.429; 9.844; 27.51 90; 105.68; 90 | 2198 | Niu, Songlin; Ulrich, Gilles; Retailleau, Pascal; Ziessel, Raymond Regioselective synthesis of 5-monostyryl and 2-tetracyanobutadiene BODIPY dyes. Organic letters, 2011, 13, 4996-4999 |
| 1502336 | CIF | C25 H24 N2 O4 S | P -1 | 8.492; 8.849; 15.021 92.659; 91.269; 102.379 | 1100.7 | Ghorai, Manas K.; Nanaji, Y.; Yadav, A. K. Ring opening/C-N cyclization of activated aziridines with carbon nucleophiles: highly diastereo- and enantioselective synthesis of tetrahydroquinolines. Organic letters, 2011, 13, 4256-4259 |
| 1502337 | CIF | C20 H20 N2 O2 S | P 1 21/n 1 | 8.996; 17.247; 11.869 90; 110.366; 90 | 1726.4 | Ghorai, Manas K.; Nanaji, Y.; Yadav, A. K. Ring opening/C-N cyclization of activated aziridines with carbon nucleophiles: highly diastereo- and enantioselective synthesis of tetrahydroquinolines. Organic letters, 2011, 13, 4256-4259 |
| 1502338 | CIF | C29 H33 Br N2 O4 S | P -1 | 11.004; 11.586; 12.288 93.336; 101.165; 114.297 | 1384.1 | Ghorai, Manas K.; Nanaji, Y.; Yadav, A. K. Ring opening/C-N cyclization of activated aziridines with carbon nucleophiles: highly diastereo- and enantioselective synthesis of tetrahydroquinolines. Organic letters, 2011, 13, 4256-4259 |
| 1502339 | CIF | C26 H26 N2 O2 S | P 1 21 1 | 9.314; 12.85; 9.334 90; 95.772; 90 | 1111.5 | Ghorai, Manas K.; Nanaji, Y.; Yadav, A. K. Ring opening/C-N cyclization of activated aziridines with carbon nucleophiles: highly diastereo- and enantioselective synthesis of tetrahydroquinolines. Organic letters, 2011, 13, 4256-4259 |
| 1502340 | CIF | C152 H208 F12 N8 O34 P2 | P 1 21/n 1 | 14.1502; 21.6375; 27.7335 90; 95.86; 90 | 8446.9 | Jiang, Wei; Sattler, Dominik; Rissanen, Kari; Schalley, Christoph A. [4]Pseudorotaxanes with remarkable self-sorting selectivities. Organic letters, 2011, 13, 4502-4505 |
| 1502341 | CIF | C12 H13 N O3 S | P b c 21 | 7.7751; 10.3561; 30.771 90; 90; 90 | 2477.7 | Jin, Weiwei; Du, Wangming; Yang, Qin; Yu, Haifeng; Chen, Jiping; Yu, Zhengkun Regio- and stereoselective synthesis of multisubstituted olefins and conjugate dienes by using α-oxo ketene dithioacetals as the building blocks. Organic letters, 2011, 13, 4272-4275 |
| 1502342 | CIF | C15 H14 O2 S | P -1 | 10.5132; 10.9768; 12.1803 106.285; 91.85; 90.48 | 1348.3 | Jin, Weiwei; Du, Wangming; Yang, Qin; Yu, Haifeng; Chen, Jiping; Yu, Zhengkun Regio- and Stereoselective Synthesis of Multisubstituted Olefins and Conjugate Dienes by Using α-Oxo Ketene Dithioacetals as the Building Blocks Organic Letters, 2011, 13, 4272-4275 |
| 1502343 | CIF | C19 H13 Cl O S | P 1 21/c 1 | 13.017; 9.1064; 13.6673 90; 105.084; 90 | 1564.3 | Jin, Weiwei; Du, Wangming; Yang, Qin; Yu, Haifeng; Chen, Jiping; Yu, Zhengkun Regio- and stereoselective synthesis of multisubstituted olefins and conjugate dienes by using α-oxo ketene dithioacetals as the building blocks. Organic letters, 2011, 13, 4272-4275 |
| 1502344 | CIF | C23 H18 O | P 21 21 21 | 10.4782; 12.795; 12.858 90; 90; 90 | 1723.9 | Jin, Weiwei; Du, Wangming; Yang, Qin; Yu, Haifeng; Chen, Jiping; Yu, Zhengkun Regio- and stereoselective synthesis of multisubstituted olefins and conjugate dienes by using α-oxo ketene dithioacetals as the building blocks. Organic letters, 2011, 13, 4272-4275 |
| 1502345 | CIF | C17 H15 Br O | C 1 2 1 | 18.9697; 6.1032; 12.078 90; 95.162; 90 | 1392.67 | Ovalles, Stephanie R.; Hansen, Jørn H; Davies, Huw M. L. Thermally induced cycloadditions of donor/acceptor carbenes. Organic letters, 2011, 13, 4284-4287 |
| 1502346 | CIF | C21 H24 N2 O2 | P 41 21 2 | 9.1072; 9.1072; 42.969 90; 90; 90 | 3563.9 | Giovanelli, Emerson; Leroux, Sébastien; Moisan, Lionel; Carreyre, Hélène; Thuéry, Pierre; Buisson, David-Alexandre; Meddour, Abdelkrim; Coustard, Jean-Marie; Thibaudeau, Sébastien; Rousseau, Bernard; Nicolas, Marc; Hellier, Paul; Doris, Eric On the elucidation of the mechanism of Vinca alkaloid fluorination in superacidic medium. Organic letters, 2011, 13, 4116-4119 |
| 1502347 | CIF | C18 H31 Br O Si | P 1 21/c 1 | 7.9868; 16.291; 15.104 90; 100.77; 90 | 1930.6 | Liang, Huan; Hu, Lin; Corey, E. J. Di-tert-butylisobutylsilyl, another useful protecting group. Organic letters, 2011, 13, 4120-4123 |
| 1502348 | CIF | C24 H32 O4 S | P 1 21 1 | 9.9752; 10.52392; 11.2107 90; 116.107; 90 | 1056.81 | Soni, Rina; Collinson, John-Michael; Clarkson, Guy C.; Wills, Martin An unexpected directing effect in the asymmetric transfer hydrogenation of α,α-disubstituted ketones. Organic letters, 2011, 13, 4304-4307 |
| 1502349 | CIF | C36 H34 O | P 1 21/n 1 | 10.3318; 18.3947; 14.2896 90; 108.039; 90 | 2582.25 | Soni, Rina; Collinson, John-Michael; Clarkson, Guy C.; Wills, Martin An unexpected directing effect in the asymmetric transfer hydrogenation of α,α-disubstituted ketones. Organic letters, 2011, 13, 4304-4307 |
| 1502350 | CIF | C28 H32 O4 S | P 21 21 21 | 7.43712; 8.62914; 36.4793 90; 90; 90 | 2341.09 | Soni, Rina; Collinson, John-Michael; Clarkson, Guy C.; Wills, Martin An unexpected directing effect in the asymmetric transfer hydrogenation of α,α-disubstituted ketones. Organic letters, 2011, 13, 4304-4307 |
| 1502351 | CIF | C48 H46 S4 | P -1 | 7.5858; 13.6821; 18.7826 74.53; 88.182; 87.442 | 1876.54 | Zöphel, Lukas; Enkelmann, Volker; Rieger, Ralph; Müllen, Klaus Saddle Shaped Hexaaryl[a,c,fg,j,l,op]tetracenes from 4,5,9,10-Tetrafunctionalized Pyrenes Organic Letters, 2011, 13, 4506-4509 |
| 1502352 | CIF | C44 H38 O S4 | C 1 2/c 1 | 14.1748; 23.6414; 20.9266 90; 100.256; 90 | 6900.7 | Zöphel, Lukas; Enkelmann, Volker; Rieger, Ralph; Müllen, Klaus Saddle Shaped Hexaaryl[a,c,fg,j,l,op]tetracenes from 4,5,9,10-Tetrafunctionalized Pyrenes Organic Letters, 2011, 13, 4506-4509 |
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