Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1515389 | CIF | C31 H38 O6 | P -1 | 8.4549; 10.6064; 17.4616 72.98; 76.359; 67.627 | 1370.82 | Tran-Van, Anne-Florence; Götz, Silas; Neuburger, Markus; Wegner, Hermann A. A Strain Induced Change of Mechanism from a [2 + 2 + 2] to a [2 + 1 + 2 + 1] Cycloaddition Reaction. Organic letters, 2014, 16, 2410-2413 |
| 1515390 | CIF | C33 H39 N O6 S | P 1 21 1 | 9.3751; 9.8572; 16.631 90; 101.792; 90 | 1504.5 | Zhou, Zhi; Feng, Xin; Yin, Xiang; Chen, Ying-Chun Direct Remote Asymmetric Bisvinylogous 1,4-Additions of Cyclic 2,5-Dienones to Nitroalkenes. Organic letters, 2014, 16, 2370-2373 |
| 1515391 | CIF | C24 H27 N O3 S | P 21 21 21 | 6.8189; 9.465; 33.233 90; 90; 90 | 2144.9 | Zhou, Zhi; Feng, Xin; Yin, Xiang; Chen, Ying-Chun Direct Remote Asymmetric Bisvinylogous 1,4-Additions of Cyclic 2,5-Dienones to Nitroalkenes. Organic letters, 2014, 16, 2370-2373 |
| 1515392 | CIF | C15 H12 Br N O4 S | P 21 21 21 | 5.7785; 7.0086; 36.717 90; 90; 90 | 1487.01 | Zhang, Heng-Xia; Nie, Jing; Cai, Hua; Ma, Jun-An Cyclic Aldimines as Superior Electrophiles for Cu-Catalyzed Decarboxylative Mannich Reaction of β-Ketoacids with a Broad Scope and High Enantioselectivity. Organic letters, 2014, 16, 2542-2545 |
| 1515393 | CIF | C37 H32 Cl2 N4 O2 S12 | P -1 | 12.722; 13.0363; 13.7737 75.631; 88.85; 85.215 | 2205.2 | Cotelle, Yoann; Allain, Magali; Legoupy, Stéphanie; Hudhomme, Piétrick Fused glycoluril-tetrathiafulvalene molecular clips as receptors for neutral electron acceptor guests. Organic letters, 2014, 16, 2590-2593 |
| 1515394 | CIF | C45.34 H36.68 Cl2.68 N8 O2 S12 | P -1 | 8.2764; 17.108; 20.28 71.044; 86.04; 86.672 | 2707.4 | Cotelle, Yoann; Allain, Magali; Legoupy, Stéphanie; Hudhomme, Piétrick Fused glycoluril-tetrathiafulvalene molecular clips as receptors for neutral electron acceptor guests. Organic letters, 2014, 16, 2590-2593 |
| 1515395 | CIF | C22 H28 N2 O9 Zn | P 1 21/n 1 | 15.8662; 13.3414; 23.2173 90; 96.374; 90 | 4884.2 | Fuchs, M. A.; Altesleben, C.; Staudt, S. C.; Walter, O.; Zevaco, T. A.; Dinjus, E. New air-stable zinc complexes formed from cyanoacrylate- and methylenemalonate-based [N2O2]-ligands and their role as catalysts in epoxide‒CO2 coupling Catalysis Science & Technology, 2014, 4, 1658 |
| 1515396 | CIF | C22 H26 N4 O5 S Zn | P 1 21/c 1 | 10.7526; 11.5952; 19.6353 90; 100.72; 90 | 2405.38 | Fuchs, M. A.; Altesleben, C.; Staudt, S. C.; Walter, O.; Zevaco, T. A.; Dinjus, E. New air-stable zinc complexes formed from cyanoacrylate- and methylenemalonate-based [N2O2]-ligands and their role as catalysts in epoxide‒CO2 coupling Catalysis Science & Technology, 2014, 4, 1658 |
| 1515397 | CIF | C20 H20 Cl2 N4 O5 S Zn | P 1 21/c 1 | 10.9276; 11.7495; 18.1519 90; 97.784; 90 | 2309.1 | Fuchs, M. A.; Altesleben, C.; Staudt, S. C.; Walter, O.; Zevaco, T. A.; Dinjus, E. New air-stable zinc complexes formed from cyanoacrylate- and methylenemalonate-based [N2O2]-ligands and their role as catalysts in epoxide‒CO2 coupling Catalysis Science & Technology, 2014, 4, 1658 |
| 1515398 | CIF | C24 H30 Cl2 N2 O9 S Zn | P 1 21/n 1 | 13.3344; 9.1475; 24.1887 90; 103.983; 90 | 2863 | Fuchs, M. A.; Altesleben, C.; Staudt, S. C.; Walter, O.; Zevaco, T. A.; Dinjus, E. New air-stable zinc complexes formed from cyanoacrylate- and methylenemalonate-based [N2O2]-ligands and their role as catalysts in epoxide‒CO2 coupling Catalysis Science & Technology, 2014, 4, 1658 |
| 1515399 | CIF | C28 H42 N2 O10 S2 Zn | P 1 21/c 1 | 7.8991; 26.6878; 15.6509 90; 97.072; 90 | 3274.3 | Fuchs, M. A.; Altesleben, C.; Staudt, S. C.; Walter, O.; Zevaco, T. A.; Dinjus, E. New air-stable zinc complexes formed from cyanoacrylate- and methylenemalonate-based [N2O2]-ligands and their role as catalysts in epoxide‒CO2 coupling Catalysis Science & Technology, 2014, 4, 1658 |
| 1515400 | CIF | C51 H50 B Ca F15 N2 O | P 1 21/n 1 | 12.5666; 19.7682; 20.4056 90; 107.382; 90 | 4837.65 | Anker, Mathew D.; Arrowsmith, Merle; Bellham, Peter; Hill, Michael S.; Kociok-Köhn, Gabriele; Liptrot, David J.; Mahon, Mary F.; Weetman, Catherine Selective reduction of CO2 to a methanol equivalent by B(C6F5)3-activated alkaline earth catalysis Chemical Science, 2014, 5, 2826 |
| 1515401 | CIF | C56.8 H50.6 B F15 Mg N2 O4 | C 1 2/c 1 | 25.258; 12.873; 34.507 90; 99.746; 90 | 11057.9 | Anker, Mathew D.; Arrowsmith, Merle; Bellham, Peter; Hill, Michael S.; Kociok-Köhn, Gabriele; Liptrot, David J.; Mahon, Mary F.; Weetman, Catherine Selective reduction of CO2 to a methanol equivalent by B(C6F5)3-activated alkaline earth catalysis Chemical Science, 2014, 5, 2826 |
| 1515402 | CIF | C52 H58 N4 O8 S4 | P -1 | 9.371; 9.447; 27.755 84.533; 83.63; 88.365 | 2430.4 | Wu, Guanglu; Thomas, Joice; Smet, Mario; Wang, Zhiqiang; Zhang, Xi Controlling the self-assembly of cationic bolaamphiphiles: hydrotropic counteranions determine aggregated structures Chemical Science, 2014, 5, 3267 |
| 1515403 | CIF | C52.69 H51.38 Cl1.38 N8 O8 | P -1 | 13.5061; 13.6726; 15.5153 112.007; 103.362; 102.907 | 2427.06 | Gavette, Jesse V.; Evoniuk, Christopher J.; Zakharov, Lev N.; Carnes, Matthew E.; Haley, Michael M.; Johnson, Darren W. Exploring Anion-Induced Conformational Flexibility and Molecular Switching in a Series of Heteroaryl-Urea Receptors. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 2899-2905 |
| 1515404 | CIF | C24 H24 N4 O4 | P 1 21/n 1 | 12.6483; 6.9763; 25.125 90; 101.115; 90 | 2175.4 | Gavette, Jesse V.; Evoniuk, Christopher J.; Zakharov, Lev N.; Carnes, Matthew E.; Haley, Michael M.; Johnson, Darren W. Exploring Anion-Induced Conformational Flexibility and Molecular Switching in a Series of Heteroaryl-Urea Receptors. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 2899-2905 |
| 1515405 | CIF | C21 H28 N4 O8 | P -1 | 9.613; 10.826; 12.485 87.67; 67.81; 73.16 | 1148 | Johnston, Priscilla; Wheldale, Dylan; Braybrook, Carl; Saito, Kei Topochemical polymerization using bis-thyminyl monomers Polymer Chemistry, 2014, 5, 4375 |
| 1515406 | CIF | C28 H34 N4 O10 | P 1 21/n 1 | 9.06; 16.13; 9.92 90; 104.89; 90 | 1401 | Johnston, Priscilla; Wheldale, Dylan; Braybrook, Carl; Saito, Kei Topochemical polymerization using bis-thyminyl monomers Polymer Chemistry, 2014, 5, 4375 |
| 1515407 | CIF | C30 H38 N4 O10 | P -1 | 11.598; 13.027; 13.432 75.17; 72.07; 69.32 | 1781.5 | Johnston, Priscilla; Wheldale, Dylan; Braybrook, Carl; Saito, Kei Topochemical polymerization using bis-thyminyl monomers Polymer Chemistry, 2014, 5, 4375 |
| 1515408 | CIF | C19 H23 N S2 | P 1 21/c 1 | 5.48322; 41.7378; 7.65094 90; 107.176; 90 | 1672.89 | Allard, Nicolas; Najari, Ahmed; Pouliot, Jean-Rémi; Pron, Agnieszka; Grenier, François; Leclerc, Mario Easy and versatile synthesis of new poly(thieno[3,4-d]thiazole)s Polymer Chemistry, 2012, 3, 2875 |
| 1515409 | CIF | C19 H14 N4 | P 1 21/c 1 | 8.724; 13.085; 13.323 90; 97.447; 90 | 1508 | Sen, Supriti; Mukherjee, Titas; Sarkar, Sandipan; Mukhopadhyay, Subhra Kanti; Chattopadhyay, Pabitra Development of a highly selective cell-permeable ratiometric fluorescent chemosensor for oxorhenium(V) ion. The Analyst, 2011, 136, 4839-4845 |
| 1515410 | CIF | C12 H10 N2 O S | P 1 21/n 1 | 20.459; 9.635; 23.657 90; 111.067; 90 | 4352 | Cui, Daoping; Li, Yueqing; Lian, Mingming; Yang, Feng; Meng, Qingwei Development of a simple and stability-indicating RP-HPLC method for determining olanzapine and related impurities generated in the preparative process. The Analyst, 2011, 136, 3149-3156 |
| 1515411 | CIF | C21 H30 | P 1 21/c 1 | 9.5922; 7.2501; 24.0793 90; 95.81; 90 | 1665.98 | Bojase, Gomotsang; Nguyen, Thanh V.; Payne, Alan D.; Willis, Anthony C.; Sherburn, Michael S. Synthesis and properties of the ivyanes: the parent 1,1-oligocyclopropanes Chemical Science, 2011, 2, 229 |
| 1515412 | CIF | C24 H34 | P b c n | 10.5317; 13.1456; 13.7434 90; 90; 90 | 1902.71 | Bojase, Gomotsang; Nguyen, Thanh V.; Payne, Alan D.; Willis, Anthony C.; Sherburn, Michael S. Synthesis and properties of the ivyanes: the parent 1,1-oligocyclopropanes Chemical Science, 2011, 2, 229 |
| 1515413 | CIF | C47 H59 Cl3 N4 O8 Si | C 1 2 1 | 19.546; 17.36; 19.889 90; 105.63; 90 | 6499 | Knowles, Robert R.; Carpenter, Joseph; Blakey, Simon B.; Kayano, Akio; Mangion, Ian K.; Sinz, Christopher J.; Macmillan, David W. C. Total synthesis of diazonamide A. Chemical science (Royal Society of Chemistry : 2010), 2011, 2011, 308-311 |
| 1515414 | CIF | C12 H18 N2 O | P c c n | 21.8777; 24.4332; 8.9667 90; 90; 90 | 4793.1 | Andrews, Natalie J.; Haynes, Cally J. E.; Light, Mark E.; Moore, Stephen J.; Tong, Christine C.; Davis, Jeffery T.; Harrell Jr., William A.; Gale, Philip A. Structurally simple lipid bilayer transport agents for chloride and bicarbonate Chemical Science, 2011, 2, 256 |
| 1515415 | CIF | C14 H19 N3 S | I 41/a :2 | 29.2158; 29.2158; 7.5897 90; 90; 90 | 6478.3 | Andrews, Natalie J.; Haynes, Cally J. E.; Light, Mark E.; Moore, Stephen J.; Tong, Christine C.; Davis, Jeffery T.; Harrell Jr., William A.; Gale, Philip A. Structurally simple lipid bilayer transport agents for chloride and bicarbonate Chemical Science, 2011, 2, 256 |
| 1515416 | CIF | C50 H56 N4 O2 Pd | P 1 21/n 1 | 10.8887; 22.7188; 17.5682 90; 95.413; 90 | 4326.6 | Konnick, Michael M.; Decharin, Nattawan; Popp, Brian V.; Stahl, Shannon S. O2 insertion into a palladium(ii)-hydride bond: Observation of mechanistic crossover between HX-reductive-elimination and hydrogen-atom-abstraction pathways Chemical Science, 2011, 2, 326 |
| 1515417 | CIF | C100 H96 B Cl3 F24 N4 Ni2 | P -1 | 15.022; 18.047; 20.367 105.35; 111.153; 100.049 | 4736.7 | Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science, 2011, 2, 321 |
| 1515418 | CIF | C91 H96 B Cl3 F24 N4 Ni2 Si | P -1 | 13.729; 17.963; 20.822 69.525; 73.169; 82.761 | 4603 | Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science, 2011, 2, 321 |
| 1515419 | CIF | C88 H84 B Cl F24 N4 Ni2 O2 | P -1 | 12.531; 17.5339; 21.5138 106.672; 104.999; 91.05 | 4352 | Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science, 2011, 2, 321 |
| 1515420 | CIF | C74 H69 B F24 N5 Ni | P 1 21/c 1 | 20.61; 12.802; 30.984 90; 95.837; 90 | 8132.7 | Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science, 2011, 2, 321 |
| 1515421 | CIF | C22.27 H24.8 Cl0.47 N2 | P 1 21/c 1 | 12.378; 11.7627; 24.4212 90; 92.43; 90 | 3552.5 | Zhang, Chen; Das, Deepankar; Seidel, Daniel Azomethine ylide annulations: facile access to polycyclic ring systems Chemical Science, 2011, 2, 233 |
| 1515422 | CIF | C23 H26 N2 O2 | P 1 21/c 1 | 8.9485; 12.2725; 17.1292 90; 93.113; 90 | 1878.36 | Zhang, Chen; Das, Deepankar; Seidel, Daniel Azomethine ylide annulations: facile access to polycyclic ring systems Chemical Science, 2011, 2, 233 |
| 1515423 | CIF | C13 H17 Cl2 N5 O2 Pt | P -1 | 6.848; 11.736; 12.384 65.95; 79.94; 76.84 | 881.2 | Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science, 2011, 2, 216 |
| 1515424 | CIF | C13 H14.33 Cl2 N5 O0.67 Pt | P 1 21/c 1 | 12.588; 18.736; 20.805 90; 106.39; 90 | 4707.4 | Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science, 2011, 2, 216 |
| 1515425 | CIF | C13 H13 Cl2 N5 O4 Pt | P 1 21/c 1 | 10.669; 10.411; 15.689 90; 108.89; 90 | 1648.8 | Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science, 2011, 2, 216 |
| 1515426 | CIF | C13 H19 Cl2 N5 O3 Pt S | P 1 21/c 1 | 9.474; 7.1809; 27.9371 90; 91.94; 90 | 1899.52 | Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science, 2011, 2, 216 |
| 1515427 | CIF | C57 H65 F3 Si2 | P 1 21/c 1 | 14.7922; 17.7744; 18.0925 90; 98.265; 90 | 4707.52 | Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science, 2011, 2, 363 |
| 1515428 | CIF | C45 H53 F3 Si2 | P 1 21/c 1 | 9.0009; 12.9917; 33.9922 90; 96.2183; 90 | 3951.56 | Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science, 2011, 2, 363 |
| 1515429 | CIF | C44 H53 N O2 Si2 | P -1 | 7.3935; 7.7475; 17.3713 96.23; 100.619; 94.648 | 967.02 | Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science, 2011, 2, 363 |
| 1515430 | CIF | C45 H53 F3 Si2 | P -1 | 7.7521; 15.8341; 17.6273 70.941; 80.257; 81.988 | 2007.37 | Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science, 2011, 2, 363 |
| 1515431 | CIF | C45 H53 F3 Si2 | P 1 21/c 1 | 13.6256; 28.5329; 10.5392 90; 101.974; 90 | 4008.26 | Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science, 2011, 2, 363 |
| 1515432 | CIF | C53 H51 O6 Ti | P -1 | 9.536; 10.7745; 21.214 87.903; 87.712; 88.606 | 2175.9 | Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science, 2011, 2, 331 |
| 1515433 | CIF | C43 H39 Cl3 D N O6 Ti | P -1 | 12.0648; 12.6467; 14.4497 109.368; 96.4954; 106.998 | 1934.4 | Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science, 2011, 2, 331 |
| 1515434 | CIF | C40 H29 Cl6 N5 O14 Ti | P -1 | 11.2931; 13.344; 15.1141 96.792; 102.423; 93.434 | 2200.11 | Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science, 2011, 2, 331 |
| 1515435 | CIF | C35 H34 Cl2 D2 N2 O6 Ti | P 1 21/n 1 | 12.3148; 13.2234; 20.372 90; 94.795; 90 | 3305.8 | Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science, 2011, 2, 331 |
| 1515436 | CIF | C21 H18 O2 S | P 1 21 1 | 11.6322; 5.663; 13.3325 90; 102.479; 90 | 857.51 | Liu, Yu; Ma, Shengming Unique reactivity of Grignard reagents towards cyclopropenyl-carboxylates—highly selective carbon–carbon bond cleavage Chemical Science, 2011, 2, 811 |
| 1515437 | CIF | C24 H21 I O4 S | P -1 | 10.4567; 14.5947; 16.071 82.184; 80.017; 70.323 | 2266.47 | Liu, Yu; Ma, Shengming Unique reactivity of Grignard reagents towards cyclopropenyl-carboxylates—highly selective carbon‒carbon bond cleavage Chemical Science, 2011, 2, 811 |
| 1515438 | CIF | C36 H31 F3 N Ni O3 | P 1 21/n 1 | 13.992; 11.424; 18.291 90; 101.06; 90 | 2869.4 | Vogt, Matthias; de Bruin, Bas; Berke, Heinz; Trincado, Mónica; Grützmacher, Hansjörg Amino olefin nickel(i) and nickel(0) complexes as dehydrogenation catalysts for amine boranes Chemical Science, 2011, 2, 723 |
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