Crystallography Open Database
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Searching year of publication is 2017
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1544238 | CIF | C64 H102 O8 Y2 | P b c a | 19.3525; 15.6285; 20.6896 90; 90; 90 | 6257.6 | Xiong, Jin; Ding, Hai-Yan; Meng, Yin-Shan; Gao, Chen; Zhang, Xue-Jing; Meng, Zhao-Sha; Zhang, Yi-Quan; Shi, Wei; Wang, Bing-Wu; Gao, Song Hydroxide-bridged five-coordinate Dy(III) single-molecule magnet exhibiting the record thermal relaxation barrier of magnetization among lanthanide-only dimers. Chemical science, 2017, 8, 1288-1294 |
| 1544239 | CIF | C64 H102 Gd2 O8 | P b c a | 19.3419; 15.68151; 20.772 90; 90; 90 | 6300.36 | Xiong, Jin; Ding, Hai-Yan; Meng, Yin-Shan; Gao, Chen; Zhang, Xue-Jing; Meng, Zhao-Sha; Zhang, Yi-Quan; Shi, Wei; Wang, Bing-Wu; Gao, Song Hydroxide-bridged five-coordinate Dy(III) single-molecule magnet exhibiting the record thermal relaxation barrier of magnetization among lanthanide-only dimers. Chemical science, 2017, 8, 1288-1294 |
| 1544247 | CIF | C26 H17 N3 O6 | P 1 21/n 1 | 14.7815; 9.0701; 21.2106 90; 106.718; 90 | 2723.5 | Yu, Tao; Ou, Depei; Yang, Zhiyong; Huang, Qiuyi; Mao, Zhu; Chen, Junru; Zhang, Yi; Liu, Siwei; Xu, Jiarui; Bryce, Martin R.; Chi, Zhenguo The HOF structures of nitrotetraphenylethene derivatives provide new insights into the nature of AIE and a way to design mechanoluminescent materials Chem. Sci., 2017, 8, 1163 |
| 1544248 | CIF | C26 H16 N4 O8 | P 42/n | 19.9155; 19.9155; 13.4286 90; 90; 90 | 5326.15 | Yu, Tao; Ou, Depei; Yang, Zhiyong; Huang, Qiuyi; Mao, Zhu; Chen, Junru; Zhang, Yi; Liu, Siwei; Xu, Jiarui; Bryce, Martin R.; Chi, Zhenguo The HOF structures of nitrotetraphenylethene derivatives provide new insights into the nature of AIE and a way to design mechanoluminescent materials Chem. Sci., 2017, 8, 1163 |
| 1544249 | CIF | C26 H18 N2 O4 | P 1 21/c 1 | 10.52308; 8.79827; 22.9441 90; 95.4899; 90 | 2114.53 | Yu, Tao; Ou, Depei; Yang, Zhiyong; Huang, Qiuyi; Mao, Zhu; Chen, Junru; Zhang, Yi; Liu, Siwei; Xu, Jiarui; Bryce, Martin R.; Chi, Zhenguo The HOF structures of nitrotetraphenylethene derivatives provide new insights into the nature of AIE and a way to design mechanoluminescent materials Chem. Sci., 2017, 8, 1163 |
| 1544257 | CIF | C37 H59 Na O6 Si4 | C 1 2/c 1 | 23.272; 9.7485; 37.173 90; 94.149; 90 | 8411 | Li, H.; Aquino, A. J. A.; Cordes, D. B.; Hase, W. L.; Krempner, C. Electronic nature of zwitterionic alkali metal methanides, silanides and germanides - a combined experimental and computational approach. Chemical science, 2017, 8, 1316-1328 |
| 1544258 | CIF | C16 H39 Li O6 Si3 | C 1 c 1 | 9.531; 17.403; 15.039 90; 90.873; 90 | 2494 | Li, H.; Aquino, A. J. A.; Cordes, D. B.; Hase, W. L.; Krempner, C. Electronic nature of zwitterionic alkali metal methanides, silanides and germanides - a combined experimental and computational approach. Chemical science, 2017, 8, 1316-1328 |
| 1544259 | CIF | C15 H39 Ge Na O6 Si3 | P 1 21/c 1 | 15.729; 9.9209; 17.212 90; 90.3515; 90 | 2685.8 | Li, H.; Aquino, A. J. A.; Cordes, D. B.; Hase, W. L.; Krempner, C. Electronic nature of zwitterionic alkali metal methanides, silanides and germanides - a combined experimental and computational approach. Chemical science, 2017, 8, 1316-1328 |
| 1544260 | CIF | C15 H39 Ge K O6 Si3 | P 1 21/n 1 | 8.141; 19.245; 16.727 90; 90.528; 90 | 2620.6 | Li, H.; Aquino, A. J. A.; Cordes, D. B.; Hase, W. L.; Krempner, C. Electronic nature of zwitterionic alkali metal methanides, silanides and germanides - a combined experimental and computational approach. Chemical science, 2017, 8, 1316-1328 |
| 1544261 | CIF | C16 H39 K O6 Si3 | P 1 21/n 1 | 8.698; 18.417; 16.289 90; 90.2; 90 | 2609 | Li, H.; Aquino, A. J. A.; Cordes, D. B.; Hase, W. L.; Krempner, C. Electronic nature of zwitterionic alkali metal methanides, silanides and germanides - a combined experimental and computational approach. Chemical science, 2017, 8, 1316-1328 |
| 1544262 | CIF | C13 H10 N2 O2 | P 21 21 21 | 5.2167; 10.4562; 18.815 90; 90; 90 | 1026.3 | Xu, Pan; Wang, Guoqiang; Wu, Zhongkai; li, Shuhua; Zhu, Chengjian Rh(iii)-catalyzed double C‒H activation of aldehyde hydrazones: a route for functionalized 1H-indazole synthesis Chem. Sci., 2017, 8, 1303 |
| 1544263 | CIF | Al20 Er V2 | F d -3 m :2 | 14.5175; 14.5175; 14.5175 90; 90; 90 | 3059.68 | Winiarski, M.J.; Klimczuk, T. Crystal structure and low-energy Einstein mode in ErV2Al20 intermetallic cage compound Journal of Solid State Chemistry, 2017, 245, 10-16 |
| 1544277 | CIF | C17 H31 I O P2 | P 1 21/c 1 | 10.0682; 13.5159; 14.7514 90; 92.352; 90 | 2005.69 | Knopf, Ioana; Tofan, Daniel; Beetstra, Dirk; Al-Nezari, Abdulaziz; Al-Bahily, Khalid; Cummins, Christopher C. A family of cis-macrocyclic diphosphines: modular, stereoselective synthesis and application in catalytic CO2/ethylene coupling Chem. Sci., 2017, 8, 1463 |
| 1544278 | CIF | C14 H26 P2 | P 1 21/n 1 | 8.4848; 12.9532; 14.0671 90; 105.04; 90 | 1493.09 | Knopf, Ioana; Tofan, Daniel; Beetstra, Dirk; Al-Nezari, Abdulaziz; Al-Bahily, Khalid; Cummins, Christopher C. A family of cis-macrocyclic diphosphines: modular, stereoselective synthesis and application in catalytic CO2/ethylene coupling Chem. Sci., 2017, 8, 1463 |
| 1544279 | CIF | C14 H22 Cl6 I2 P2 | C 1 2/c 1 | 23.5655; 10.2998; 20.9628 90; 98.051; 90 | 5037.9 | Knopf, Ioana; Tofan, Daniel; Beetstra, Dirk; Al-Nezari, Abdulaziz; Al-Bahily, Khalid; Cummins, Christopher C. A family of cis-macrocyclic diphosphines: modular, stereoselective synthesis and application in catalytic CO2/ethylene coupling Chem. Sci., 2017, 8, 1463 |
| 1544280 | CIF | C27 H46 Ni O2 P2 | P 21 21 21 | 9.6408; 12.6202; 22.256 90; 90; 90 | 2707.9 | Knopf, Ioana; Tofan, Daniel; Beetstra, Dirk; Al-Nezari, Abdulaziz; Al-Bahily, Khalid; Cummins, Christopher C. A family of cis-macrocyclic diphosphines: modular, stereoselective synthesis and application in catalytic CO2/ethylene coupling Chem. Sci., 2017, 8, 1463 |
| 1544285 | CIF | C14 H10 N4 | P 1 21/n 1 | 9.3816; 6.7781; 16.9307 90; 99.5145; 90 | 1061.8 | Jash, Biswarup; Scharf, Philipp; Sandmann, Nikolas; Fonseca Guerra, Célia; Megger, Dominik A.; Müller, Jens A metal-mediated base pair that discriminates between the canonical pyrimidine nucleobases. Chemical science, 2017, 8, 1337-1343 |
| 1544287 | CIF | C50 H86 P3 Rh | P 1 21/c 1 | 10.4706; 22.65; 19.939 90; 98.7248; 90 | 4674 | Suga, Takuya; Saitou, Takanobu; Takaya, Jun; Iwasawa, Nobuharu Mechanistic study of the rhodium-catalyzed carboxylation of simple aromatic compounds with carbon dioxide Chem. Sci., 2017, 8, 1454 |
| 1544314 | CIF | C26 H23 O P S2 | P -1 | 8.4616; 11.5086; 12.4957 83.427; 77.321; 83.71 | 1174.89 | Wu, Nathan Man-Wai; Wong, Hok-Lai; Yam, Vivian Wing-Wah Photochromic benzo[b]phosphole oxide with excellent thermal irreversibility and fatigue resistance in the thin film solid state via direct attachment of dithienyl units to the weakly aromatic heterocycle Chem. Sci., 2017, 8, 1309 |
| 1544315 | CIF | C20 H19 Fe N O | P 21 21 21 | 5.7992; 11.4342; 24.017 90; 90; 90 | 1592.5 | Yang, Lei; Melot, Romain; Neuburger, Markus; Baudoin, Olivier Palladium(0)-catalyzed asymmetric C(sp(3))-H arylation using a chiral binol-derived phosphate and an achiral ligand. Chemical science, 2017, 8, 1344-1349 |
| 1544316 | CIF | C22 H21 Fe N O3 | P 32 | 9.7138; 9.7138; 33.882 90; 90; 120 | 2768.7 | Yang, Lei; Melot, Romain; Neuburger, Markus; Baudoin, Olivier Palladium(0)-catalyzed asymmetric C(sp(3))-H arylation using a chiral binol-derived phosphate and an achiral ligand. Chemical science, 2017, 8, 1344-1349 |
| 1544356 | CIF | C33 H46 Br N O5 Si | P 21 21 21 | 9.091; 18.1061; 20.6924 90; 90; 90 | 3406 | Abbasov, Mikail E.; Hudson, Brandi M.; Tantillo, Dean J.; Romo, Daniel Stereodivergent, Diels‒Alder-initiated organocascades employing α,β-unsaturated acylammonium salts: scope, mechanism, and application Chem. Sci., 2017, 8, 1511 |
| 1544357 | CIF | C18 H21 Br N2 O3 | P 1 21 1 | 8.8396; 17.5572; 11.6494 90; 94.347; 90 | 1802.77 | Sadhukhan, Arghya; Hobbs, Melanie C.; Meijer, Anthony J. H. M.; Coldham, Iain Highly enantioselective metallation‒substitution alpha to a chiral nitrile Chem. Sci., 2017, 8, 1436 |
| 1544369 | CIF | C60 H72 Br2 F48 I6 K2 N4 O12 | P -3 | 11.727; 11.727; 20.29 90; 90; 120 | 2416.5 | Kumar, Vijith; Pilati, Tullio; Terraneo, Giancarlo; Meyer, Franck; Metrangolo, Pierangelo; Resnati, Giuseppe Halogen bonded Borromean networks by design: topology invariance and metric tuning in a library of multi-component systems Chem. Sci., 2017, 8, 1801 |
| 1544385 | CIF | C114.7 H129.68 Br0.47 Cl3.14 I12 N24 O0.93 Zn6 | C 1 2 1 | 35.1845; 14.8561; 31.0855 90; 101.739; 90 | 15908.7 | Lee, Shoukou; Hoshino, Manabu; Fujita, Makoto; Urban, Sylvia Cycloelatanene A and B: absolute configuration determination and structural revision by the crystalline sponge method Chem. Sci., 2017, 8, 1547 |
| 1544386 | CIF | C118.68 H134.52 Br0.86 Cl0.86 I12 N24 O1.71 Zn6 | C 1 2 1 | 35.2593; 14.8434; 31.0697 90; 101.611; 90 | 15928.1 | Lee, Shoukou; Hoshino, Manabu; Fujita, Makoto; Urban, Sylvia Cycloelatanene A and B: absolute configuration determination and structural revision by the crystalline sponge method Chem. Sci., 2017, 8, 1547 |
| 1544404 | CIF | C37 H36 Cl F5 N4 O2 U | C 1 c 1 | 24.5647; 8.4279; 16.8859 90; 91.172; 90 | 3495.14 | Pankhurst, James R.; Bell, Nicola L.; Zegke, Markus; Platts, Lucy N.; Lamfsus, Carlos Alvarez; Maron, Laurent; Natrajan, Louise S.; Sproules, Stephen; Arnold, Polly L.; Love, Jason B. Inner-sphere vs. outer-sphere reduction of uranyl supported by a redox-active, donor-expanded dipyrrin. Chemical science, 2017, 8, 108-116 |
| 1544405 | CIF | C51 H50 Cl3 F5 N4 O2 Ti2 U | P 1 21/c 1 | 14.486; 30.377; 12.092 90; 107.081; 90 | 5086 | Pankhurst, James R.; Bell, Nicola L.; Zegke, Markus; Platts, Lucy N.; Lamfsus, Carlos Alvarez; Maron, Laurent; Natrajan, Louise S.; Sproules, Stephen; Arnold, Polly L.; Love, Jason B. Inner-sphere vs. outer-sphere reduction of uranyl supported by a redox-active, donor-expanded dipyrrin. Chemical science, 2017, 8, 108-116 |
| 1544406 | CIF | C37 H38 Cl Co F5 N4 O2.5 U | P 1 21/c 1 | 16.0945; 28.2241; 19.2594 90; 105.247; 90 | 8440.7 | Pankhurst, James R.; Bell, Nicola L.; Zegke, Markus; Platts, Lucy N.; Lamfsus, Carlos Alvarez; Maron, Laurent; Natrajan, Louise S.; Sproules, Stephen; Arnold, Polly L.; Love, Jason B. Inner-sphere vs. outer-sphere reduction of uranyl supported by a redox-active, donor-expanded dipyrrin. Chemical science, 2017, 8, 108-116 |
| 1544443 | CIF | C24 H16 O2 S2 | P 1 21/n 1 | 9.6533; 13.2733; 15.1062 90; 90.485; 90 | 1935.51 | Xu, Bingjia; Wu, Haozhong; Chen, Junru; Yang, Zhan; Yang, Zhiyong; Wu, Yuan-Chun; Zhang, Yi; Jin, Chongjun; Lu, Po-Yen; Chi, Zhenguo; Liu, Siwei; Xu, Jiarui; Aldred, Matthew White-light emission from a single heavy atom-free molecule with room temperature phosphorescence, mechanochromism and thermochromism Chem. Sci., 2017, 8, 1909 |
| 1544444 | CIF | C37 H24 Cl2 O2 S3 | C 1 2/c 1 | 9.3865; 12.1945; 26.4154 90; 94.268; 90 | 3015.22 | Xu, Bingjia; Wu, Haozhong; Chen, Junru; Yang, Zhan; Yang, Zhiyong; Wu, Yuan-Chun; Zhang, Yi; Jin, Chongjun; Lu, Po-Yen; Chi, Zhenguo; Liu, Siwei; Xu, Jiarui; Aldred, Matthew White-light emission from a single heavy atom-free molecule with room temperature phosphorescence, mechanochromism and thermochromism Chem. Sci., 2017, 8, 1909 |
| 1544458 | CIF | C11 H11 Cl N2 O5 | P 1 21/c 1 | 6.98145; 21.3099; 8.10016 90; 97.9679; 90 | 1193.46 | Liang, Jun; Chen, Rui-Ping; Wang, Xiu-Yun; Liu, Tao-Tao; Wang, Xu-Sheng; Huang, Yuan-Biao; Cao, Rong Postsynthetic ionization of an imidazole-containing metal-organic framework for the cycloaddition of carbon dioxide and epoxides. Chemical science, 2017, 8, 1570-1575 |
| 1544462 | CIF | C27 H32 N2 O7 | P -1 | 9.067; 9.572; 14.08 89.833; 82.205; 85.541 | 1207 | Yang, Shouliang; Sankar, Kuppusamy; Skepper, Colin K.; Barker, Timothy J.; Lukesh, 3rd, John C; Brody, Daniel M.; Brütsch, Manuela M; Boger, Dale L. Total synthesis of a key series of vinblastines modified at C4 that define the importance and surprising trends in activity. Chemical science, 2017, 8, 1560-1569 |
| 1544463 | CIF | C25 H32 Cl2 N2 O6 | P 21 21 21 | 7.8529; 15.3187; 20.944 90; 90; 90 | 2519.5 | Yang, Shouliang; Sankar, Kuppusamy; Skepper, Colin K.; Barker, Timothy J.; Lukesh, 3rd, John C; Brody, Daniel M.; Brütsch, Manuela M; Boger, Dale L. Total synthesis of a key series of vinblastines modified at C4 that define the importance and surprising trends in activity. Chemical science, 2017, 8, 1560-1569 |
| 1544464 | CIF | C31 H38 N2 O5 | I 4 | 27.2685; 27.2685; 7.6863 90; 90; 90 | 5715.3 | Yang, Shouliang; Sankar, Kuppusamy; Skepper, Colin K.; Barker, Timothy J.; Lukesh, 3rd, John C; Brody, Daniel M.; Brütsch, Manuela M; Boger, Dale L. Total synthesis of a key series of vinblastines modified at C4 that define the importance and surprising trends in activity. Chemical science, 2017, 8, 1560-1569 |
| 1544465 | CIF | C25 H30 N2 O7 | P 21 21 21 | 8.9658; 14.5779; 17.7311 90; 90; 90 | 2317.5 | Yang, Shouliang; Sankar, Kuppusamy; Skepper, Colin K.; Barker, Timothy J.; Lukesh, 3rd, John C; Brody, Daniel M.; Brütsch, Manuela M; Boger, Dale L. Total synthesis of a key series of vinblastines modified at C4 that define the importance and surprising trends in activity. Chemical science, 2017, 8, 1560-1569 |
| 1544481 | CIF | C20 H15 Br Cl2 O S | P 1 21/c 1 | 5.0603; 21.361; 17.169 90; 96.419; 90 | 1844.2 | Chen, Dengfeng; Feng, Qingyuan; Yang, Yunqin; Cai, Xu-Min; Wang, Fei; Huang, Shenlin Metal-free O-H/C-H difunctionalization of phenols by o-hydroxyarylsulfonium salts in water. Chemical science, 2017, 8, 1601-1606 |
| 1544482 | CIF | C24 H16 Cl N O3 S | P 1 21/c 1 | 18.742; 15.6215; 13.97 90; 98.216; 90 | 4048.1 | Chen, Dengfeng; Feng, Qingyuan; Yang, Yunqin; Cai, Xu-Min; Wang, Fei; Huang, Shenlin Metal-free O-H/C-H difunctionalization of phenols by o-hydroxyarylsulfonium salts in water. Chemical science, 2017, 8, 1601-1606 |
| 1544483 | CIF | C11 H8.5 F1.5 O2 S | P 1 21/c 1 | 6.0792; 14.673; 23.976 90; 91.386; 90 | 2138 | Chen, Dengfeng; Feng, Qingyuan; Yang, Yunqin; Cai, Xu-Min; Wang, Fei; Huang, Shenlin Metal-free O-H/C-H difunctionalization of phenols by o-hydroxyarylsulfonium salts in water. Chemical science, 2017, 8, 1601-1606 |
| 1544510 | CIF | C16 H20 Cl2 Ir N2 O2 | P -1 | 7.8768; 8.0811; 8.6738 68.1; 66.086; 61.433 | 432.1 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544511 | CIF | C16 H20 Cl2 Ir N2 O2 | I 41/a | 16.9129; 16.9129; 25.3688 90; 90; 90 | 7256.6 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544512 | CIF | C16 H23 Cl2 Ir N2 O3 | P -1 | 8.8884; 9.6675; 12.5862 95.132; 109.482; 110.349 | 929.79 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544513 | CIF | C18 H24 Cl2 Ir N2 O3 | P 1 21/n 1 | 7.9001; 18.4626; 14.3136 90; 95.04; 90 | 2079.66 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544514 | CIF | C17 H22 Cl4 Ir N2 O2 | P 1 21/n 1 | 8.7599; 15.6388; 15.6017 90; 98.373; 90 | 2114.56 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544515 | CIF | C33 H48 Cl6 Ir2 N4 O6 | P 1 21/c 1 | 9.044; 13.823; 17.039 90; 95.227; 90 | 2121 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544516 | CIF | C8 H15 Cl4 Ir N Na O3.5 | P -1 | 8.4303; 13.4446; 14.3559 74.431; 85.859; 81.771 | 1550.31 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544517 | CIF | C33 H42 Cl6 Ir2 N4 O4 | P b c a | 14.9782; 15.0278; 17.4463 90; 90; 90 | 3927 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
| 1544536 | CIF | C24 H18 Br N O3 | P 21 21 21 | 8.8078; 9.5713; 23.675 90; 90; 90 | 1995.9 | Chen, Xiang-Yu; Chen, Kun-Quan; Sun, De-Qun; Ye, Song N-Heterocyclic carbene-catalyzed oxidative [3 + 2] annulation of dioxindoles and enals: cross coupling of homoenolate and enolate. Chemical science, 2017, 8, 1936-1941 |
| 1544553 | CIF | C46 H32 O5 | P 21 21 21 | 9.6965; 17.3653; 19.2464 90; 90; 90 | 3240.8 | Samoilichenko, Yuri; Kondratenko, Veronica; Ezernitskaya, Mariam; Lyssenko, Konstantin; Peregudov, Alexander; Khrustalev, Victor; Maleev, Victor; Moskalenko, Margarita; North, Michael; Tsaloev, Alan; Gugkaeva, Zalina T.; Belokon, Yuri A mechanistic study of the Lewis acid‒Brønsted base‒Brønsted acid catalysed asymmetric Michael addition of diethyl malonate to cyclohexenone Catal. Sci. Technol., 2017, 7, 90 |
| 1544554 | CIF | C25 H32 Si2 | P b c a | 6.657; 34.537; 19.811 90; 90; 90 | 4555 | Takahashi, Keisuke; Ito, Shingo; Shintani, Ryo; Nozaki, Kyoko Selective synthesis of unsymmetric dibenzo[a,e]pentalenes by a rhodium-catalysed stitching reaction. Chemical science, 2017, 8, 101-107 |
| 1544555 | CIF | C29 H34 Si2 | P 1 21/c 1 | 15.291; 11.701; 14.17 90; 93.057; 90 | 2532 | Takahashi, Keisuke; Ito, Shingo; Shintani, Ryo; Nozaki, Kyoko Selective synthesis of unsymmetric dibenzo[a,e]pentalenes by a rhodium-catalysed stitching reaction. Chemical science, 2017, 8, 101-107 |
| 1544556 | CIF | C27 H36 N2 O2 Si2 | P -1 | 7.221; 11.79; 16.389 110.915; 93.663; 94.99 | 1291.6 | Takahashi, Keisuke; Ito, Shingo; Shintani, Ryo; Nozaki, Kyoko Selective synthesis of unsymmetric dibenzo[a,e]pentalenes by a rhodium-catalysed stitching reaction. Chemical science, 2017, 8, 101-107 |
| 1544557 | CIF | C23 H11 F8 N3 O | P 1 21/c 1 | 6.5595; 41.849; 6.9922 90; 94.939; 90 | 1912.3 | Lin, Heyang; Chang, Xueping; Yan, Dongpeng; Fang, Wei-Hai; Cui, Ganglong Tuning excited-state-intramolecular-proton-transfer (ESIPT) process and emission by cocrystal formation: a combined experimental and theoretical study. Chemical science, 2017, 8, 2086-2090 |
| 1544558 | CIF | C32 H22 F4 I2 N6 O2 | P 1 21/c 1 | 15.842; 5.698; 16.7517 90; 94.72; 90 | 1507 | Lin, Heyang; Chang, Xueping; Yan, Dongpeng; Fang, Wei-Hai; Cui, Ganglong Tuning excited-state-intramolecular-proton-transfer (ESIPT) process and emission by cocrystal formation: a combined experimental and theoretical study. Chemical science, 2017, 8, 2086-2090 |
| 1544592 | CIF | C30 H36 S4 | P -1 | 9.0286; 9.0591; 9.4956 81.785; 73.648; 66.336 | 682.18 | Dong, Xin; Tian, Hongkun; Xie, Zhiyuan; Geng, Yanhou; Wang, Fosong Donor‒acceptor conjugated polymers based on two-dimensional thiophene derivatives for bulk heterojunction solar cells Polym. Chem., 2017, 8, 421 |
| 1544602 | CIF | C56 H72 F12 N4 O2 Si2 Zn2 | P 1 21/c 1 | 11.3281; 24.0698; 13.5639 90; 110.91; 90 | 3454.8 | Reiter, M.; Vagin, S.; Kronast, A.; Jandl, C.; Rieger, B. A Lewis acid β-diiminato-zinc-complex as all-rounder for co- and terpolymerisation of various epoxides with carbon dioxide Chem. Sci., 2017, 8, 1876 |
| 1544603 | CIF | C31 H45 F6 N3 Si2 Zn | P -1 | 10.5225; 11.8495; 16.4988 91.643; 107.641; 115.266 | 1742.8 | Reiter, M.; Vagin, S.; Kronast, A.; Jandl, C.; Rieger, B. A Lewis acid β-diiminato-zinc-complex as all-rounder for co- and terpolymerisation of various epoxides with carbon dioxide Chem. Sci., 2017, 8, 1876 |
| 1544629 | CIF | C56 H68 B4 Cl8 Fe2 N14 O12 | P 1 21/c 1 | 19.4453; 15.7177; 23.5873 90; 109.174; 90 | 6809.2 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544630 | CIF | C43 H54 B4 Cl6 Fe2 N14 O12 | P -1 | 8.4174; 19.6607; 20.1792 60.961; 79.048; 87.787 | 2860.9 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544631 | CIF | C226 H267 B20 F16 Fe8 N65 O48 Pd2 | P -1 | 20.2193; 20.6255; 21.5175 63.61; 76.958; 85.618 | 7828.1 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544632 | CIF | C160 H192 B20 F16 Fe8 N56 O48 Pd2 | P 1 2/c 1 | 41.2884; 14.0841; 54.0058 90; 97.789; 90 | 31115.2 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544633 | CIF | C262 H304 B20 F16 Fe8 N64 O50 Pd2 S0.5 | P -1 | 21.3764; 21.4422; 23.5362 105.44; 91.132; 90.267 | 10396.1 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544634 | CIF | C244 H264 B20 F16 Fe8 N56 O56 Pd2 | P -1 | 20.6996; 21.9894; 23.0916 96.416; 91.4; 109.195 | 9843.2 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544635 | CIF | C264 H306 B20 F16 Fe8 N62 O56 Pd2 | P 4/m n c | 17.5471; 17.5471; 62.6742 90; 90; 90 | 19297.4 | Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci., 2017, 8, 1901 |
| 1544644 | CIF | C70 H83 Sb4 Y3 | C 1 c 1 | 14.8643; 19.384; 24.2728 90; 107.004; 90 | 6688 | Pugh, Thomas; Chilton, Nicholas F.; Layfield, Richard A. Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling. Chemical science, 2017, 8, 2073-2080 |
| 1544645 | CIF | C70 H83 Dy3 Sb4 | C 1 c 1 | 14.8968; 19.3308; 24.2616 90; 106.568; 90 | 6696.5 | Pugh, Thomas; Chilton, Nicholas F.; Layfield, Richard A. Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling. Chemical science, 2017, 8, 2073-2080 |
| 1544646 | CIF | C70 H83 Dy3 Sb3 | C 1 c 1 | 15.113; 18.7437; 24.0965 90; 103.339; 90 | 6641.75 | Pugh, Thomas; Chilton, Nicholas F.; Layfield, Richard A. Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling. Chemical science, 2017, 8, 2073-2080 |
| 1544647 | CIF | C70 H83 Sb3 Y3 | C 1 c 1 | 15.1052; 18.7715; 24.1263 90; 103.437; 90 | 6653.68 | Pugh, Thomas; Chilton, Nicholas F.; Layfield, Richard A. Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling. Chemical science, 2017, 8, 2073-2080 |
| 1544648 | CIF | C18 H24 Sb2 | P -1 | 5.174; 7.9835; 11.2694 88.921; 79.679; 73.714 | 439.35 | Pugh, Thomas; Chilton, Nicholas F.; Layfield, Richard A. Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling. Chemical science, 2017, 8, 2073-2080 |
| 1544649 | CIF | C19 H35 N3 O7 | P 65 | 19.7793; 19.7793; 11.2095 90; 90; 120 | 3797.9 | Paikar, Arpita; Pramanik, Apurba; Das, Tanmay; Haldar, Debasish A self-assembled peptide mimetic of a tubular host and a supramolecular polymer Polym. Chem., 2017, 8, 396 |
| 1544655 | CIF | C90 H121 F6 N7 O18 P | P 1 21/c 1 | 22.63; 23.529; 19.425 90; 112.979; 90 | 9522 | Li, Xiaowei; Yuan, Xiangyang; Deng, Pengchi; Chen, Lixi; Ren, Yi; Wang, Chengyuan; Wu, Lixin; Feng, Wen; Gong, Bing; Yuan, Lihua Macrocyclic shape-persistency of cyclo[6]aramide results in enhanced multipoint recognition for the highly efficient template-directed synthesis of rotaxanes. Chemical science, 2017, 8, 2091-2100 |
| 1544656 | CIF | C216 H292 F12 N20 O36 P2 | P 1 21/n 1 | 22.928; 25.6042; 23.2131 90; 111.03; 90 | 12719.6 | Li, Xiaowei; Yuan, Xiangyang; Deng, Pengchi; Chen, Lixi; Ren, Yi; Wang, Chengyuan; Wu, Lixin; Feng, Wen; Gong, Bing; Yuan, Lihua Macrocyclic shape-persistency of cyclo[6]aramide results in enhanced multipoint recognition for the highly efficient template-directed synthesis of rotaxanes. Chemical science, 2017, 8, 2091-2100 |
| 1544657 | CIF | C12 H30 I6 N2 Pb | P b c a | 9.0651; 8.8852; 33.617 90; 90; 90 | 2707.7 | Smith, Matthew D.; Pedesseau, Laurent; Kepenekian, Mikaël; Smith, Ian C.; Katan, Claudine; Even, Jacky; Karunadasa, Hemamala I. Decreasing the electronic confinement in layered perovskites through intercalation. Chemical science, 2017, 8, 1960-1968 |
| 1544658 | CIF | C39 H36 Cl2 Ir O2 P | C 1 2 1 | 19.385; 16.22; 10.9215 90; 107.035; 90 | 3283.3 | Yang, Shuang; Che, Wen; Wu, Hui-Ling; Zhu, Shou-Fei; Zhou, Qi-Lin Neutral iridium catalysts with chiral phosphine-carboxy ligands for asymmetric hydrogenation of unsaturated carboxylic acids. Chemical science, 2017, 8, 1977-1980 |
| 1544659 | CIF | C22 H12 I N6 O3 Re | P 1 21/n 1 | 7.0191; 18.0476; 16.9652 90; 99.85; 90 | 2117.44 | Wedding, J. L.; Harris, H. H.; Bader, C. A.; Plush, S. E.; Mak, R.; Massi, M.; Brooks, D. A.; Lai, B.; Vogt, S.; Werrett, M. V.; Simpson, P. V.; Skelton, B. W.; Stagni, S. Intracellular distribution and stability of a luminescent rhenium(i) tricarbonyl tetrazolato complex using epifluorescence microscopy in conjunction with X-ray fluorescence imaging. Metallomics : integrated biometal science, 2017, 9, 382-390 |
| 1544660 | CIF | C45 H43 Cl11 N O P Pd | P 21 21 21 | 13.7983; 18.7174; 19.3028 90; 90; 90 | 4985.3 | Race, Nicholas J.; Faulkner, Adele; Fumagalli, Gabriele; Yamauchi, Takayuki; Scott, James S.; Rydén-Landergren, Marie; Sparkes, Hazel A.; Bower, John F. Enantioselective Narasaka-Heck cyclizations: synthesis of tetrasubstituted nitrogen-bearing stereocenters. Chemical science, 2017, 8, 1981-1985 |
| 1544661 | CIF | C17 H17 N | P 21 21 21 | 6.077; 7.7665; 27.619 90; 90; 90 | 1303.5 | Race, Nicholas J.; Faulkner, Adele; Fumagalli, Gabriele; Yamauchi, Takayuki; Scott, James S.; Rydén-Landergren, Marie; Sparkes, Hazel A.; Bower, John F. Enantioselective Narasaka-Heck cyclizations: synthesis of tetrasubstituted nitrogen-bearing stereocenters. Chemical science, 2017, 8, 1981-1985 |
| 1544701 | CIF | C81.75 H139 F6 N17 O9.75 P | P 21 21 21 | 20.2513; 20.7166; 21.07611 90; 90; 90 | 8842.23 | Kaabel, Sandra; Adamson, Jasper; Topić, Filip; Kiesilä, Anniina; Kalenius, Elina; Öeren, Mario; Reimund, Mart; Prigorchenko, Elena; Lõokene, Aivar; Reich, Hans J.; Rissanen, Kari; Aav, Riina Chiral hemicucurbit[8]uril as an anion receptor: selectivity to size, shape and charge distribution Chem. Sci., 2017, 8, 2184 |
| 1544702 | CIF | C82 H140 F6 N16 O10 P Sb | P 1 21 1 | 20.20836; 21.378; 20.70075 90; 90.0578; 90 | 8943.02 | Kaabel, Sandra; Adamson, Jasper; Topić, Filip; Kiesilä, Anniina; Kalenius, Elina; Öeren, Mario; Reimund, Mart; Prigorchenko, Elena; Lõokene, Aivar; Reich, Hans J.; Rissanen, Kari; Aav, Riina Chiral hemicucurbit[8]uril as an anion receptor: selectivity to size, shape and charge distribution Chem. Sci., 2017, 8, 2184 |
| 1544703 | CIF | C82 H140 B F4 N17 O10 | P 21 21 21 | 20.03081; 20.92663; 20.97159 90; 90; 90 | 8790.82 | Kaabel, Sandra; Adamson, Jasper; Topić, Filip; Kiesilä, Anniina; Kalenius, Elina; Öeren, Mario; Reimund, Mart; Prigorchenko, Elena; Lõokene, Aivar; Reich, Hans J.; Rissanen, Kari; Aav, Riina Chiral hemicucurbit[8]uril as an anion receptor: selectivity to size, shape and charge distribution Chem. Sci., 2017, 8, 2184 |
| 1544704 | CIF | C81.75 H139 N17 O13.75 Re | P 21 21 21 | 20.1641; 20.8019; 21.1254 90; 90; 90 | 8861.1 | Kaabel, Sandra; Adamson, Jasper; Topić, Filip; Kiesilä, Anniina; Kalenius, Elina; Öeren, Mario; Reimund, Mart; Prigorchenko, Elena; Lõokene, Aivar; Reich, Hans J.; Rissanen, Kari; Aav, Riina Chiral hemicucurbit[8]uril as an anion receptor: selectivity to size, shape and charge distribution Chem. Sci., 2017, 8, 2184 |
| 1544705 | CIF | C82 H140 I N16 O14 P | P 1 21 1 | 20.1263; 21.3089; 20.7811 90; 90.0371; 90 | 8912.4 | Kaabel, Sandra; Adamson, Jasper; Topić, Filip; Kiesilä, Anniina; Kalenius, Elina; Öeren, Mario; Reimund, Mart; Prigorchenko, Elena; Lõokene, Aivar; Reich, Hans J.; Rissanen, Kari; Aav, Riina Chiral hemicucurbit[8]uril as an anion receptor: selectivity to size, shape and charge distribution Chem. Sci., 2017, 8, 2184 |
| 1544706 | CIF | C83 H140 F3 N17 O13 S | P 21 21 21 | 20.27229; 20.7328; 21.02695 90; 90; 90 | 8837.66 | Kaabel, Sandra; Adamson, Jasper; Topić, Filip; Kiesilä, Anniina; Kalenius, Elina; Öeren, Mario; Reimund, Mart; Prigorchenko, Elena; Lõokene, Aivar; Reich, Hans J.; Rissanen, Kari; Aav, Riina Chiral hemicucurbit[8]uril as an anion receptor: selectivity to size, shape and charge distribution Chem. Sci., 2017, 8, 2184 |
| 1544707 | CIF | C13 H4 F10 N4 O | P 1 21/c 1 | 14.6959; 7.2819; 13.7456 90; 94.301; 90 | 1466.83 | Chowdhury, Additi Roy; Ghosh, Pritam; Paul, Suparna; Bhuyan, Samuzal; Bose K, Jagadeesh C.; Mukhopadhyay, Sudit; Banerjee, Priyabrata A novel ditopic chemosensor for cadmium and fluoride and its possible application as a pH sensor Anal. Methods, 2017, 9, 124 |
| 1544742 | CIF | C26 H38 Au N2 P S | P 1 21/c 1 | 12.4327; 15.7628; 12.9117 90; 97.2061; 90 | 2510.37 | Chan, Kaai Tung; Tong, Glenna So Ming; To, Wai-Pong; Yang, Chen; Du, Lili; Phillips, David Lee; Che, Chi-Ming The interplay between fluorescence and phosphorescence with luminescent gold(i) and gold(iii) complexes bearing heterocyclic arylacetylide ligands. Chemical science, 2017, 8, 2352-2364 |
| 1544743 | CIF | C32 H25 Au N2 O2 | P 1 21/c 1 | 11.4778; 20.461; 11.6734 90; 111.062; 90 | 2558.3 | Chan, Kaai Tung; Tong, Glenna So Ming; To, Wai-Pong; Yang, Chen; Du, Lili; Phillips, David Lee; Che, Chi-Ming The interplay between fluorescence and phosphorescence with luminescent gold(i) and gold(iii) complexes bearing heterocyclic arylacetylide ligands. Chemical science, 2017, 8, 2352-2364 |
| 1544744 | CIF | C39 H51 Au B F2 N2 P | P 1 21/n 1 | 10.9501; 25.1526; 13.6349 90; 102.556; 90 | 3665.6 | Chan, Kaai Tung; Tong, Glenna So Ming; To, Wai-Pong; Yang, Chen; Du, Lili; Phillips, David Lee; Che, Chi-Ming The interplay between fluorescence and phosphorescence with luminescent gold(i) and gold(iii) complexes bearing heterocyclic arylacetylide ligands. Chemical science, 2017, 8, 2352-2364 |
| 1544745 | CIF | C372 H446 Cd24 Eu8 N24 O142 | P -4 n 2 | 42.723; 42.723; 37.856 90; 90; 90 | 69097 | Yang, Xiaoping; Wang, Shiqing; Zhang, Lijie; Wang, Chenri; Zhu, Ting; Bo, Le; Huang, Shaoming Enhancement of the luminescence properties of high-nuclearity Cd-Ln (Ln = Eu and Nd) nanoclusters by the introduction of more energy transfer donors. Nanoscale, 2017, 9, 517-521 |
| 1544746 | CIF | C389 H512 Cd24 N24 Nd8 O173.5 | P -4 n 2 | 42.795; 42.795; 37.864 90; 90; 90 | 69345 | Yang, Xiaoping; Wang, Shiqing; Zhang, Lijie; Wang, Chenri; Zhu, Ting; Bo, Le; Huang, Shaoming Enhancement of the luminescence properties of high-nuclearity Cd-Ln (Ln = Eu and Nd) nanoclusters by the introduction of more energy transfer donors. Nanoscale, 2017, 9, 517-521 |
| 1544749 | CIF | C10 Cl8 | P 1 21/n 1 | 9.7188; 7.1598; 18.2787 90; 98.358; 90 | 1258.41 | Sarkar, Sounak; Row, Tayur N. Guru A heuristic approach to evaluate <i>peri</i> interactions <i>versus</i> intermolecular interactions in an overcrowded naphthalene IUCrJ, 2017, 4 |
| 1544751 | CIF | C35 H53 Fe N2 P3 Si | P c a 21 | 17.8087; 11.3207; 17.3127 90; 90; 90 | 3490.36 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544752 | CIF | C43 H65 Fe N3 Na O2 P3 Si | P 1 21/c 1 | 13.454; 10.208; 32.264 90; 90.86; 90 | 4431 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544753 | CIF | C69 H71 B F24 Fe N2 O0.5 P3 Si | P -1 | 13.2134; 16.5453; 19.1158 107.944; 103.367; 104.913 | 3616.2 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544754 | CIF | C45 H69 Fe N5 Na O3 P3 Si | P 1 21/c 1 | 16.278; 12.177; 24.314 90; 90.733; 90 | 4819.1 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544755 | CIF | C35 H53 Fe N3 P3 Si | P -1 | 10.4778; 17.2329; 20.001 92.885; 96.497; 98.431 | 3541.2 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544756 | CIF | C73 H82 B F24 Fe N3 O1.5 P3 Si | P -1 | 12.6269; 16.1557; 20.397 86.951; 77.672; 72.605 | 3878.8 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544757 | CIF | C45 H69 Fe N5 Na O3 P3 Si | P n m a | 24.918; 16.256; 12.349 90; 90; 90 | 5002 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544758 | CIF | C39 H51 Cl Fe N3 P3 Si | P n a 21 | 38.962; 11.0406; 18.1487 90; 90; 90 | 7806.9 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544759 | CIF | C33 H45 Cl0 Fe N5 P3 Si | P 1 21 1 | 10.6457; 19.2443; 16.2208 90; 91.27; 90 | 3322.3 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
| 1544760 | CIF | C69 H70 B F24 Fe N4 O P3 Si | P -1 | 17.5105; 20.6792; 22.9097 102.798; 94.824; 111.77 | 7385 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
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