Crystallography Open Database
Search results
Result: there are 21609 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching year of publication is 2017
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
---|---|---|---|---|---|---|
1544761 | CIF | C142 H160 Er5 F90 N47 O100 S30 | P c a 21 | 17.2096; 31.3584; 50.5444 90; 90; 90 | 27277.1 | Prodius, D.; Smetana, V.; Steinberg, S.; Wilk-Kozubek, M.; Mudryk, Y.; Pecharsky, V. K.; Mudring, A.-V. Breaking the paradigm: record quindecim charged magnetic ionic liquids Mater. Horiz., 2017, 4, 217 |
1544776 | CIF | C41 H52 Cl8 N8 O6 Ru2 S2 | C 1 2/c 1 | 31.425; 9.0156; 34.41 90; 147.193; 90 | 5282 | Su, Wei; Younus, Hussein A.; Zhou, Kui; Khattak, Zafar A. K.; Chaemcheun, Somboon; Chen, Cheng; Verpoort, Francis Chemical and photochemical water oxidation catalyzed by novel ruthenium complexes comprising a negatively charged NCNHCO ligand Catal. Sci. Technol., 2017, 7, 387 |
1544780 | CIF | C16 H32.72 N4 O12.36 Zr | P 4 c c | 13.0201; 13.0201; 13.1802 90; 90; 90 | 2234.3 | Pandya, Darpan N.; Bhatt, Nikunj; Yuan, Hong; Day, Cynthia S.; Ehrmann, Brandie M.; Wright, Marcus; Bierbach, Ulrich; Wadas, Thaddeus J. Zirconium tetraazamacrocycle complexes display extraordinary stability and provide a new strategy for zirconium-89-based radiopharmaceutical development. Chemical science, 2017, 8, 2309-2314 |
1544782 | CIF | C30 H30 N4 O2 S2 Zn | F d d 2 | 36.662; 37.055; 5.1092 90; 90; 90 | 6940.9 | Mulijanto, Caroline Evania; Quah, Hong Sheng; Tan, Geok Kheng; Donnadieu, Bruno; Vittal, Jagadese J. Curved crystal morphology, photoreactivity and photosalient behaviour of mononuclear Zn(II) complexes IUCrJ, 2017, 4 |
1544783 | CIF | C28 H26 F2 N4 O6 S2 Zn | P 1 2/n 1 | 14.871; 4.9627; 20.315 90; 93.183; 90 | 1496.9 | Mulijanto, Caroline Evania; Quah, Hong Sheng; Tan, Geok Kheng; Donnadieu, Bruno; Vittal, Jagadese J. Curved crystal morphology, photoreactivity and photosalient behaviour of mononuclear Zn(II) complexes IUCrJ, 2017, 4 |
1544784 | CIF | C28 H20 F2 N4 S2 Zn | P 1 21/c 1 | 10.3095; 12.2083; 20.7566 90; 96.68; 90 | 2594.72 | Mulijanto, Caroline Evania; Quah, Hong Sheng; Tan, Geok Kheng; Donnadieu, Bruno; Vittal, Jagadese J. Curved crystal morphology, photoreactivity and photosalient behaviour of mononuclear Zn(II) complexes IUCrJ, 2017, 4 |
1544785 | CIF | C28 H20 F2 N4 S2 Zn | P n m a | 8.276; 24.824; 12.523 90; 90; 90 | 2573 | Mulijanto, Caroline Evania; Quah, Hong Sheng; Tan, Geok Kheng; Donnadieu, Bruno; Vittal, Jagadese J. Curved crystal morphology, photoreactivity and photosalient behaviour of mononuclear Zn(II) complexes IUCrJ, 2017, 4 |
1544786 | CIF | C8 H16 Cl2 N4 O5 Pt | P 1 21/c 1 | 12.2584; 10.9135; 21.9058 90; 104.66; 90 | 2835.2 | Mayr, Josef; Heffeter, Petra; Groza, Diana; Galvez, Luis; Koellensperger, Gunda; Roller, Alexander; Alte, Beatrix; Haider, Melanie; Berger, Walter; Kowol, Christian R.; Keppler, Bernhard K. An albumin-based tumor-targeted oxaliplatin prodrug with distinctly improved anticancer activity in vivo Chem. Sci., 2017, 8, 2241 |
1544787 | CIF | C9 H20 Cl2 N4 O7 Pt | C 1 2/c 1 | 27.345; 10.1753; 12.3345 90; 101.328; 90 | 3365.1 | Mayr, Josef; Heffeter, Petra; Groza, Diana; Galvez, Luis; Koellensperger, Gunda; Roller, Alexander; Alte, Beatrix; Haider, Melanie; Berger, Walter; Kowol, Christian R.; Keppler, Bernhard K. An albumin-based tumor-targeted oxaliplatin prodrug with distinctly improved anticancer activity in vivo Chem. Sci., 2017, 8, 2241 |
1544788 | CIF | C697 H897 Ag115 P12 S81 | P -1 | 29.4745; 35.8121; 48.4263 86.379; 75.637; 74.164 | 47638.4 | Bestgen, Sebastian; Fuhr, Olaf; Breitung, Ben; Kiran Chakravadhanula, Venkata Sei; Guthausen, Gisela; Hennrich, Frank; Yu, Wen; Kappes, Manfred M.; Roesky, Peter W.; Fenske, Dieter [Ag115S34(SCH2C6H4tBu)47(dpph)6]: synthesis, crystal structure and NMR investigations of a soluble silver chalcogenide nanocluster Chem. Sci., 2017, 8, 2235 |
1544795 | CIF | C16 H19 Mo N O6 | P 1 21/n 1 | 6.9126; 7.6578; 31.895 90; 92.22; 90 | 1687.1 | Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions New J. Chem., 2017, 41, 594 |
1544796 | CIF | C16 H19 Mo N O6 | P -1 | 8.7538; 10.0269; 10.7193 97.063; 111.466; 95.831 | 857.95 | Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions New J. Chem., 2017, 41, 594 |
1544797 | CIF | C17 H21 Mo N O7 | P 1 21/c 1 | 19.61; 7.5974; 12.7835 90; 102.179; 90 | 1861.68 | Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions New J. Chem., 2017, 41, 594 |
1544798 | CIF | C18 H15 Mo N O5 | P -1 | 7.6444; 9.9107; 11.0535 72.13; 82.196; 88.111 | 789.61 | Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions New J. Chem., 2017, 41, 594 |
1544799 | CIF | C20 H21 Mo N O6 | P 1 21/c 1 | 7.9476; 14.9809; 16.765 90; 96.268; 90 | 1984.1 | Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions New J. Chem., 2017, 41, 594 |
1544802 | CIF | C35 H32 B2 Cl F18 N3 | P 1 21/n 1 | 11.379; 22.2822; 16.4411 90; 107.567; 90 | 3974.2 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544803 | CIF | C46 H51 B2 F18 N5 | C 1 2/c 1 | 12.936; 18.7832; 41.0326 90; 94.5442; 90 | 9938.7 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544804 | CIF | C31 H39.5 B F3.5 N5 O3 S | P -1 | 9.3972; 12.2337; 16.8072 73.1735; 77.1382; 68.1258 | 1701.94 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544805 | CIF | C12 H21 B F3 N5 O3 S | C m c 21 | 13.5787; 12.2769; 11.1774 90; 90; 90 | 1863.32 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544806 | CIF | C54 H53 B2 F24 N7 | P 21 21 21 | 12.6084; 19.7795; 24.1204 90; 90; 90 | 6015.3 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544807 | CIF | C35.38 H33.75 B2 Cl0.75 F18 N3 | I 1 2/a 1 | 25.1883; 12.192; 26.4276 90; 98.253; 90 | 8031.8 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544808 | CIF | C38.5 H35 B2 F18 N3 | P 1 21/n 1 | 12.2423; 22.642; 14.6138 90; 92.7542; 90 | 4046.12 | Swarnakar, Anindya K.; Hering-Junghans, Christian; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Reactivity of a coordinated inorganic acetylene unit, HBNH, and the azidoborane cation [HB(N3)](). Chemical science, 2017, 8, 2337-2343 |
1544809 | CIF | C14 H24 F6 Fe N24 O6 S2 | P -1 | 7.543; 11.336; 11.424 63.483; 89.755; 88.763 | 873.9 | Urtizberea, A.; Roubeau, O. Switchable slow relaxation of magnetization in the native low temperature phase of a cooperative spin-crossover compound. Chemical science, 2017, 8, 2290-2295 |
1544810 | CIF | C14 H24 F6 Fe N24 O6 S2 | R -3 :H | 19.724; 19.724; 45.031 90; 90; 120 | 15172 | Urtizberea, A.; Roubeau, O. Switchable slow relaxation of magnetization in the native low temperature phase of a cooperative spin-crossover compound. Chemical science, 2017, 8, 2290-2295 |
1544811 | CIF | C14 H6 Br2 F4 | P 1 21/c 1 | 10.453; 4.7776; 12.787 90; 91.545; 90 | 638.4 | Zhang, Weifeng; Mao, Zupan; Chen, Zhihui; Huang, Jianyao; Wei, Congyuan; Gao, Dong; Lin, Zuzhang; Li, Hao; Wang, Liping; Yu, Gui Ambipolar tetrafluorodiphenylethene-based donor‒acceptor copolymers: synthesis, properties, backbone conformation and fluorine-induced conformational locks Polym. Chem., 2017, 8, 879 |
1544812 | CIF | C22 H12 F4 S2 | C 1 2 1 | 18.983; 6.635; 28.718 90; 101.14; 90 | 3549 | Zhang, Weifeng; Mao, Zupan; Chen, Zhihui; Huang, Jianyao; Wei, Congyuan; Gao, Dong; Lin, Zuzhang; Li, Hao; Wang, Liping; Yu, Gui Ambipolar tetrafluorodiphenylethene-based donor‒acceptor copolymers: synthesis, properties, backbone conformation and fluorine-induced conformational locks Polym. Chem., 2017, 8, 879 |
1544813 | CIF | C33 H18 F6 S3 | P 1 21/n 1 | 6.538; 22.32; 17.876 90; 95.624; 90 | 2596.1 | Zhang, Weifeng; Mao, Zupan; Chen, Zhihui; Huang, Jianyao; Wei, Congyuan; Gao, Dong; Lin, Zuzhang; Li, Hao; Wang, Liping; Yu, Gui Ambipolar tetrafluorodiphenylethene-based donor‒acceptor copolymers: synthesis, properties, backbone conformation and fluorine-induced conformational locks Polym. Chem., 2017, 8, 879 |
1544814 | CIF | C15 H18 O5 | P 1 21 1 | 10.2447; 8.1822; 16.059 90; 100.634; 90 | 1323.01 | Li, Hong-Lei; Li, Xiao-Ming; Li, Xin; Wang, Chen-Yin; Liu, Hui; Kassack, Matthias U.; Meng, Ling-Hong; Wang, Bin-Gui Antioxidant Hydroanthraquinones from the Marine Algal-Derived Endophytic Fungus Talaromyces islandicus EN-501. Journal of natural products, 2017, 80, 162-168 |
1544815 | CIF | C17 H18 O6 | P 21 21 21 | 6.1006; 15.0443; 16.0425 90; 90; 90 | 1472.37 | Luo, Qi; Wei, Xiao-Yi; Yang, Jing; Luo, Jin-Feng; Liang, Rui; Tu, Zheng-Chao; Cheng, Yong-Xian Spiro Meroterpenoids from Ganoderma applanatum. Journal of natural products, 2017, 80, 61-70 |
1544822 | CIF | C14 H10 N2 O2 | P b c a | 8.2; 12.4012; 21.182 90; 90; 90 | 2154 | Barsu, Nagaraju; Bolli, Shyam Kumar; Sundararaju, Basker Cobalt catalyzed carbonylation of unactivated C(sp(3))-H bonds. Chemical science, 2017, 8, 2431-2435 |
1544823 | CIF | C15 H14 N2 O2 | P 1 21/n 1 | 8.73; 13.396; 11.372 90; 101.968; 90 | 1301 | Barsu, Nagaraju; Bolli, Shyam Kumar; Sundararaju, Basker Cobalt catalyzed carbonylation of unactivated C(sp(3))-H bonds. Chemical science, 2017, 8, 2431-2435 |
1544824 | CIF | C66 H52 Cl12 N2 O4 | P 43 | 13.9364; 13.9364; 34.5285 90; 90; 90 | 6706.24 | Nagarajan, Kalaivanan; Mallia, Ajith R.; Muraleedharan, Keerthi; Hariharan, Mahesh Enhanced intersystem crossing in core-twisted aromatics Chem. Sci., 2017, 8, 1776 |
1544825 | CIF | C104 H86 N2 O4 | P -1 | 11.4627; 11.8704; 15.645 76.067; 89.834; 72.77 | 1968.03 | Nagarajan, Kalaivanan; Mallia, Ajith R.; Muraleedharan, Keerthi; Hariharan, Mahesh Enhanced intersystem crossing in core-twisted aromatics Chem. Sci., 2017, 8, 1776 |
1544826 | CIF | C17 H17 N O | P 1 21/n 1 | 6.3989; 11.27072; 19.0731 90; 92.0107; 90 | 1374.71 | Kim, Jungwon; Hong, Soon Hyeok Organocatalytic activation of isocyanides: N-heterocyclic carbene-catalyzed enaminone synthesis from ketones. Chemical science, 2017, 8, 2401-2406 |
1544839 | CIF | C36 H42 N Na O9 S | P -1 | 9.6525; 10.0128; 20.198 94.526; 92.174; 117.703 | 1716.78 | Chen, Changjuan; Cui, Yaqin; Mao, Xiaoyang; Pan, Xiaobo; Wu, Jincai Suppressing Cyclic Polymerization for Isoselective Synthesis of High-Molecular-Weight Linear Polylactide Catalyzed by Sodium/Potassium Sulfonamidate Complexes Macromolecules, 2017, 50, 83 |
1544840 | CIF | C54.5 H80 N Na O7 S | P -1 | 10.6133; 15.1843; 17.364 107.939; 92.806; 93.558 | 2650.3 | Chen, Changjuan; Cui, Yaqin; Mao, Xiaoyang; Pan, Xiaobo; Wu, Jincai Suppressing Cyclic Polymerization for Isoselective Synthesis of High-Molecular-Weight Linear Polylactide Catalyzed by Sodium/Potassium Sulfonamidate Complexes Macromolecules, 2017, 50, 83 |
1544841 | CIF | C47 H63 K N O9 S | P -1 | 10.9876; 12.4673; 18.4805 76.475; 86.282; 88.815 | 2456.1 | Chen, Changjuan; Cui, Yaqin; Mao, Xiaoyang; Pan, Xiaobo; Wu, Jincai Suppressing Cyclic Polymerization for Isoselective Synthesis of High-Molecular-Weight Linear Polylactide Catalyzed by Sodium/Potassium Sulfonamidate Complexes Macromolecules, 2017, 50, 83 |
1544842 | CIF | C29 H32 N2 Na O10 S | P 1 21/n 1 | 10.7318; 16.846; 16.1244 90; 91.924; 90 | 2913.5 | Chen, Changjuan; Cui, Yaqin; Mao, Xiaoyang; Pan, Xiaobo; Wu, Jincai Suppressing Cyclic Polymerization for Isoselective Synthesis of High-Molecular-Weight Linear Polylactide Catalyzed by Sodium/Potassium Sulfonamidate Complexes Macromolecules, 2017, 50, 83 |
1544843 | CIF | C35 H28 N4 O | P 1 21/n 1 | 9.359; 10.6693; 27.872 90; 93.525; 90 | 2777.9 | Gao, Meng; Su, Huifang; Lin, Yuhan; Ling, Xia; Li, Shiwu; Qin, Anjun; Tang, Ben Zhong Photoactivatable aggregation-induced emission probes for lipid droplets-specific live cell imaging Chem. Sci., 2017, 8, 1763 |
1544851 | CIF | C24 H28 N2 O10 | P 1 21/c 1 | 6.241; 27.3263; 6.9456 90; 99.4148; 90 | 1168.57 | Sui, Qi; Ren, Xiang-Ting; Dai, Yu-Xiang; Wang, Kai; Li, Wen-Tao; Gong, Teng; Fang, Jia-Jia; Zou, Bo; Gao, En-Qing; Wang, Lin Piezochromism and hydrochromism through electron transfer: new stories for viologen materials Chem. Sci., 2017, 8, 2758 |
1544903 | CIF | C29 H31 N3 O3 Pd | P 41 21 2 | 9.1556; 9.1556; 66.051 90; 90; 90 | 5536.7 | Huang, Yingda; He, Jianyun; Liu, Zhanxiong; Cai, Guilong; Zhang, Shaowen; Li, Xiaofang A highly active chiral (S,S)-bis(oxazoline) Pd(ii) alkyl complex/activator catalytic system for vinyl polymerization of norbornene in air and water Polym. Chem., 2017, 8, 1217 |
1544914 | CIF | C36 H54 O5 | P 21 21 21 | 10.5654; 12.0671; 25.9946 90; 90; 90 | 3314.1 | Yang, Xing-Wei; Yang, Jing; Xu, Gang Skeleton Reassignment of Type C Polycyclic Polyprenylated Acylphloroglucinols. Journal of natural products, 2017, 80, 108-113 |
1544922 | CIF | C16 H14 O6 | P 1 21 1 | 7.1535; 11.5439; 9.2553 90; 110.398; 90 | 716.37 | Nyandoro, Stephen S.; Munissi, Joan J. E.; Gruhonjic, Amra; Duffy, Sandra; Pan, Fangfang; Puttreddy, Rakesh; Holleran, John P.; Fitzpatrick, Paul A.; Pelletier, Jerry; Avery, Vicky M.; Rissanen, Kari; Erdélyi, Máté Polyoxygenated Cyclohexenes and Other Constituents of Cleistochlamys kirkii Leaves. Journal of natural products, 2017, 80, 114-125 |
1544924 | CIF | C20 H34 O4 | P 1 21 1 | 7.098; 11.005; 12.116 90; 98.904; 90 | 935 | Wang, Jianbin; Duan, Hongquan; Wang, Yi; Pan, Bowen; Gao, Chun; Gai, Chunyan; Wu, Qiong; Fu, Hongzheng ent-Strobane and ent-Pimarane Diterpenoids from Siegesbeckia pubescens. Journal of natural products, 2017, 80, 19-29 |
1544925 | CIF | C20 H34 O4 | P 1 21 1 | 7.342; 15.348; 8.002 90; 98.622; 90 | 891.5 | Wang, Jianbin; Duan, Hongquan; Wang, Yi; Pan, Bowen; Gao, Chun; Gai, Chunyan; Wu, Qiong; Fu, Hongzheng ent-Strobane and ent-Pimarane Diterpenoids from Siegesbeckia pubescens. Journal of natural products, 2017, 80, 19-29 |
1544926 | CIF | C24 H10 Al F15 O2 | P b c a | 18.8274; 12.704; 19.8612 90; 90; 90 | 4750.5 | Wang, Qianyi; Zhao, Wuchao; He, Jianghua; Zhang, Yuetao; Chen, Eugene Y.-X. Living Ring-Opening Polymerization of Lactones by N-Heterocyclic Olefin/Al(C6F5)3 Lewis Pairs: Structures of Intermediates, Kinetics, and Mechanism Macromolecules, 2017, 50, 123 |
1544928 | CIF | C38 H26 O2 | P 1 21/n 1 | 15.308; 18.011; 18.454 90; 90.22; 90 | 5088 | Yamano, Ryota; Hara, Jun; Murayama, Koichi; Sugiyama, Haruki; Teraoka, Kota; Uekusa, Hidehiro; Kawauchi, Susumu; Shibata, Yu; Tanaka, Ken Rh-Mediated Enantioselective Synthesis, Crystal Structures, and Photophysical/Chiroptical Properties of Phenanthrenol-Based [9]Helicene-like Molecules. Organic letters, 2017, 19, 42-45 |
1544929 | CIF | C33 H25 N3 O4 S | C 1 c 1 | 10.6286; 25.115; 10.7465 90; 104.224; 90 | 2780.7 | Wang, Gaonan; You, Xu; Gan, Yi; Liu, Yuanhong Synthesis of δ- and α-Carbolines via Nickel-Catalyzed [2 + 2 + 2] Cycloaddition of Functionalized Alkyne-Nitriles with Alkynes. Organic letters, 2017, 19, 110-113 |
1544930 | CIF | C30 H22 N2 O2 S | P -1 | 9.003; 10.963; 12.428 72.805; 85.559; 79.074 | 1150.3 | Wang, Gaonan; You, Xu; Gan, Yi; Liu, Yuanhong Synthesis of δ- and α-Carbolines via Nickel-Catalyzed [2 + 2 + 2] Cycloaddition of Functionalized Alkyne-Nitriles with Alkynes. Organic letters, 2017, 19, 110-113 |
1544933 | CIF | C20 H22 Cl N O2 | P 1 21/n 1 | 10.83; 9.6753; 16.09 90; 92.076; 90 | 1684.9 | Katamura, Tomohiro; Shimizu, Tomoaki; Mutoh, Yuichiro; Saito, Shinichi Synthesis of Tricyclic Benzazocines by Aza-Prins Reaction. Organic letters, 2017, 19, 266-269 |
1544934 | CIF | C12 H11 N3 O | P 1 21/c 1 | 8.798; 17.333; 7.162 90; 99.138; 90 | 1078.3 | Phatake, Ravindra S.; Mullapudi, Venkannababu; Wakchaure, Vivek C.; Ramana, Chepuri V. Fluoride-Mediated Dephosphonylation of α-Diazo-β-carbonyl Phosphonates. Organic letters, 2017, 19, 372-375 |
1544935 | CIF | C22 H21 N3 O2 | P 1 21/c 1 | 11.1909; 21.865; 8.6529 90; 112.255; 90 | 1959.5 | Phatake, Ravindra S.; Mullapudi, Venkannababu; Wakchaure, Vivek C.; Ramana, Chepuri V. Fluoride-Mediated Dephosphonylation of α-Diazo-β-carbonyl Phosphonates. Organic letters, 2017, 19, 372-375 |
1544936 | CIF | C58 H59 Cl4 N5 | P 1 21/c 1 | 21.1993; 8.9364; 27.249 90; 108.488; 90 | 4895.8 | Díaz-Moscoso, Alejandro; Hernández-Alonso, Daniel; Escobar, Luis; Arroyave, Frank A.; Ballester, Pablo Stereoselective Synthesis of Lower and Upper Rim Functionalized Tetra-α Isomers of Calix[4]pyrroles. Organic letters, 2017, 19, 226-229 |
1544937 | CIF | C60 H58 Br4 Cl4 N6 | P 4/n :2 | 14.2293; 14.2293; 14.5334 90; 90; 90 | 2942.62 | Díaz-Moscoso, Alejandro; Hernández-Alonso, Daniel; Escobar, Luis; Arroyave, Frank A.; Ballester, Pablo Stereoselective Synthesis of Lower and Upper Rim Functionalized Tetra-α Isomers of Calix[4]pyrroles. Organic letters, 2017, 19, 226-229 |
1544938 | CIF | C32 H37 N3 O8 S | P 1 21/c 1 | 8.89; 31.1842; 11.2873 90; 90.258; 90 | 3129.12 | Gao, Nadia Yuqian; Banwell, Martin G.; Willis, Anthony C. Biomimetic Total Synthesis of the Pentacyclic Amaryllidaceae Alkaloid Derivative Gracilamine. Organic letters, 2017, 19, 162-165 |
1544939 | CIF | C32 H41 N O7 S Si | P c a 21 | 25.6854; 8.0217; 15.3789 90; 90; 90 | 3168.68 | Gao, Nadia Yuqian; Banwell, Martin G.; Willis, Anthony C. Biomimetic Total Synthesis of the Pentacyclic Amaryllidaceae Alkaloid Derivative Gracilamine. Organic letters, 2017, 19, 162-165 |
1544940 | CIF | C37 H52 N2 O8 S Si | P -1 | 10.6659; 12.3; 29.9835 78.5156; 86.0516; 75.7746 | 3735.77 | Gao, Nadia Yuqian; Banwell, Martin G.; Willis, Anthony C. Biomimetic Total Synthesis of the Pentacyclic Amaryllidaceae Alkaloid Derivative Gracilamine. Organic letters, 2017, 19, 162-165 |
1544941 | CIF | C26 H28 Cl2 O8 S2 | P 1 | 7.5065; 8.2625; 12.1071 93.086; 105.999; 96.045 | 715.11 | Wallbaum, Jan; Garve, Lennart K. B.; Jones, Peter G.; Werz, Daniel B. Ring-Opening 1,3-Halochalcogenation of Cyclopropane Dicarboxylates. Organic letters, 2017, 19, 98-101 |
1544943 | CIF | C28 H24 N2 O2 | P 1 21/c 1 | 18.542; 8.149; 16.428 90; 112.296; 90 | 2296.7 | Mangina, N. S. V. M. Rao; Kadiyala, Veerabhushanam; Guduru, Ravinder; Goutham, Kommuru; Sridhar, Balasubramanian; Karunakar, Galla V. Gold-Catalyzed Intramolecular Regioselective 7-exo-dig Cyclization To Access 3-Methylene-3,4-dihydrobenzo[b]oxepinones. Organic letters, 2017, 19, 282-285 |
1544944 | CIF | C26 H31 N3 O7 | P 21 21 21 | 8.4235; 17.6443; 17.7369 90; 90; 90 | 2636.2 | Yarlagadda, Suresh; Ramesh, B.; Ravikumar Reddy, C.; Srinivas, L.; Sridhar, B.; Subba Reddy, B. V. Organocatalytic Enantioselective Amination of 2-Substituted Indolin-3-ones: A Strategy for the Synthesis of Chiral α-Hydrazino Esters. Organic letters, 2017, 19, 170-173 |
1544945 | CIF | C23 H17 Cl2 N O | P 21 21 21 | 8.0323; 11.0444; 21.437 90; 90; 90 | 1901.7 | Tiwari, Virendra Kumar; Kamal, Neha; Kapur, Manmohan One Substrate, Two Modes of C-H Functionalization: A Metal-Controlled Site-Selectivity Switch in C-H Arylation Reactions. Organic letters, 2017, 19, 262-265 |
1544947 | CIF | C20 H26 Br N O4 | P 1 21 1 | 9.3929; 6.4813; 17.376 90; 101.247; 90 | 1037.5 | Sagawa, Naoya; Sato, Haruka; Hosokawa, Seijiro Remote Asymmetric Induction Using Acetate-Type Vinylketene Silyl N,O-Acetals. Organic letters, 2017, 19, 198-201 |
1544948 | CIF | C28 H29 N | P 1 21/n 1 | 15.7589; 10.4662; 26.8462 90; 102.139; 90 | 4328.9 | Yin, Jianhao; Ye, Qingyu; Hao, Wei; Du, Shuaijing; Gu, Yucheng; Zhang, Wen-Xiong; Xi, Zhenfeng Formation of Cyclopenta[c]pyridine Derivatives from 2,5-Disubstituted Pyrroles and 1,4-Dibromo-1,3-butadienes via Pyrrole-Ring One-Carbon Expansion. Organic letters, 2017, 19, 138-141 |
1544952 | CIF | C25 H23 N3 O3 S | P -1 | 8.4034; 9.8773; 14.6579 101.168; 101.636; 102.436 | 1127.36 | Zhou, Wei; Zhang, Min; Li, Hanhui; Chen, Wanzhi One-Pot Three-Component Synthesis of Enamine-Functionalized 1,2,3-Triazoles via Cu-Catalytic Azide-Alkyne Click (CuAAC) and Cu-Catalyzed Vinyl Nitrene Transfer Sequence. Organic letters, 2017, 19, 10-13 |
1544953 | CIF | C17 H22 N2 O3 | P 1 21 1 | 8.3665; 10.0146; 10.4237 90; 108.862; 90 | 826.47 | Royal, Titouan; Baumgartner, Yann; Baudoin, Olivier Enantioselective α-Arylation of O-Carbamates via Sparteine-Mediated Lithiation and Negishi Cross-Coupling. Organic letters, 2017, 19, 166-169 |
1544963 | CIF | C16 H27 N O4 | P 1 21 1 | 7.8462; 11.066; 10.6654 90; 112.684; 90 | 854.4 | Sagawa, Naoya; Moriya, Hiroki; Hosokawa, Seijiro Syn Selective Vinylogous Mukaiyama Aldol Reaction Using Z,E-Vinylketene N,O-Acetal with Acetals. Organic letters, 2017, 19, 250-253 |
1544965 | CIF | C8 H12 Cl7 F6 S2 Sb | C 1 c 1 | 17.3672; 12.098; 10.2133 90; 97.836; 90 | 2125.9 | Schevenels, Florian T.; Shen, Minxing; Snyder, Scott A. Alkyldisulfanium Salts: Isolable, Electrophilic Sulfur Reagents Competent for Polyene Cyclizations. Organic letters, 2017, 19, 2-5 |
1544966 | CIF | C16 H17 N O2 S | P 21 21 21 | 9.0793; 10.4132; 15.2584 90; 90; 90 | 1442.6 | An, Qianjin; Liu, Delong; Shen, Jiefeng; Liu, Yangang; Zhang, Wanbin The Construction of Chiral Fused Azabicycles Using a Pd-Catalyzed Allylic Substitution Cascade and Asymmetric Desymmetrization Strategy. Organic letters, 2017, 19, 238-241 |
1544967 | CIF | C20 H21 N O2 S | P 21 21 21 | 6.3817; 9.423; 28.5737 90; 90; 90 | 1718.27 | An, Qianjin; Liu, Delong; Shen, Jiefeng; Liu, Yangang; Zhang, Wanbin The Construction of Chiral Fused Azabicycles Using a Pd-Catalyzed Allylic Substitution Cascade and Asymmetric Desymmetrization Strategy. Organic letters, 2017, 19, 238-241 |
1544969 | CIF | C42 H50 F12 N10 O7 P2 Ru | C 1 2/c 1 | 21.9093; 15.8193; 19.1282 90; 130.884; 90 | 5012.2 | Smith, Nichola A.; Zhang, Pingyu; Greenough, Simon E.; Horbury, Michael D.; Clarkson, Guy J.; McFeely, Daniel; Habtemariam, Abraha; Salassa, Luca; Stavros, Vasilios G.; Dowson, Christopher G.; Sadler, Peter J. Combatting AMR: photoactivatable ruthenium(ii)-isoniazid complex exhibits rapid selective antimycobacterial activity. Chemical science, 2017, 8, 395-404 |
1544970 | CIF | C20 H19 Fe N S2 | P 32 | 10.9404; 10.9404; 13.0885 90; 90; 120 | 1356.71 | Sánchez-Rodríguez, E P; Hochberger-Roa, F; Corona-Sánchez, R; Barquera-Lozada, J E; Toscano, R. A.; Urrutigoïty, M; Gouygou, M.; Ortega-Alfaro, M C; López-Cortés, J G Chiral bidentate [N,S]-ferrocene ligands based on a thiazoline framework. Synthesis and use in palladium-catalyzed asymmetric allylic alkylation. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1510-1519 |
1544971 | CIF | C14 H17 Fe N O S | P 21 21 21 | 7.6132; 10.3234; 17.0932 90; 90; 90 | 1343.4 | Sánchez-Rodríguez, E P; Hochberger-Roa, F; Corona-Sánchez, R; Barquera-Lozada, J E; Toscano, R. A.; Urrutigoïty, M; Gouygou, M.; Ortega-Alfaro, M C; López-Cortés, J G Chiral bidentate [N,S]-ferrocene ligands based on a thiazoline framework. Synthesis and use in palladium-catalyzed asymmetric allylic alkylation. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1510-1519 |
1544972 | CIF | C14 H15 Fe N S | P 21 21 21 | 10.2026; 15.2374; 8.0026 90; 90; 90 | 1244.09 | Sánchez-Rodríguez, E P; Hochberger-Roa, F; Corona-Sánchez, R; Barquera-Lozada, J E; Toscano, R. A.; Urrutigoïty, M; Gouygou, M.; Ortega-Alfaro, M C; López-Cortés, J G Chiral bidentate [N,S]-ferrocene ligands based on a thiazoline framework. Synthesis and use in palladium-catalyzed asymmetric allylic alkylation. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1510-1519 |
1544973 | CIF | C34 H54 Cl F3 Ga N3 O3 S Si2 | P 1 21/n 1 | 11.1905; 22.586; 16.2428 90; 91.695; 90 | 4103.55 | Swarnakar, Anindya K.; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Azido- and amido-substituted gallium hydrides supported by N-heterocyclic carbenes. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1406-1412 |
1544974 | CIF | C27 H43.85 Cl0.15 Ga N3 Si2 | P -1 | 9.3467; 9.991; 18.9915 81.5099; 79.0123; 62.4631 | 1540.13 | Swarnakar, Anindya K.; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Azido- and amido-substituted gallium hydrides supported by N-heterocyclic carbenes. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1406-1412 |
1544975 | CIF | C23 H25 F6 Ga N2 O6 S2 | P 1 21/c 1 | 12.2187; 15.2841; 15.7675 90; 102.522; 90 | 2874.6 | Swarnakar, Anindya K.; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Azido- and amido-substituted gallium hydrides supported by N-heterocyclic carbenes. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1406-1412 |
1544976 | CIF | C40 H71.5 Cl2 Ga N3 O1.75 Si2 | P 1 21/c 1 | 12.2392; 36.3301; 11.934 90; 117.532; 90 | 4705.51 | Swarnakar, Anindya K.; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Azido- and amido-substituted gallium hydrides supported by N-heterocyclic carbenes. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1406-1412 |
1544977 | CIF | C24.5 H30 Ga N5 | P 1 21/c 1 | 18.7477; 8.4344; 15.3559 90; 95.0657; 90 | 2418.68 | Swarnakar, Anindya K.; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric Azido- and amido-substituted gallium hydrides supported by N-heterocyclic carbenes. Dalton transactions (Cambridge, England : 2003), 2017, 46, 1406-1412 |
1544978 | CIF | C29 H26 N2 O2 S | P 1 21/c 1 | 9.6591; 15.8903; 16.1514 90; 91.983; 90 | 2477.5 | Chen, Wei; Bai, Ya-Li; Luo, Yong-Chun; Xu, Peng-Fei Rh(II) Catalyzed High Order Cycloadditions of 8-Azaheptafulvenes with N-Sulfonyl 1,2,3-Triazloes or α-Oxo Diazocompounds. Organic letters, 2017, 19, 364-367 |
1544979 | CIF | C24 H27 N3 O5 | P 1 21/c 1 | 8.6521; 31.6804; 8.7706 90; 106.944; 90 | 2299.68 | Dey, Raghunath; Banerjee, Prabal Lewis Acid Catalyzed Diastereoselective Cycloaddition Reactions of Donor-Acceptor Cyclopropanes and Vinyl Azides: Synthesis of Functionalized Azidocyclopentane and Tetrahydropyridine Derivatives. Organic letters, 2017, 19, 304-307 |
1544980 | CIF | C24 H19 Br O6 | P 1 21/n 1 | 15.3377; 7.8683; 16.5282 90; 100.698; 90 | 1959.98 | Kawamura, Moe; Kamo, Shogo; Azuma, Shuhei; Kubo, Konomi; Sasamori, Takahiro; Tokitoh, Norihiro; Kuramochi, Kouji; Tsubaki, Kazunori Skeletal Rearrangements of Polycyclic α-Ketols. Organic letters, 2017, 19, 301-303 |
1544981 | CIF | C22 H13 Br O3 | P -1 | 6.9248; 10.1578; 12.5321 75.761; 75.876; 79.427 | 821.43 | Kawamura, Moe; Kamo, Shogo; Azuma, Shuhei; Kubo, Konomi; Sasamori, Takahiro; Tokitoh, Norihiro; Kuramochi, Kouji; Tsubaki, Kazunori Skeletal Rearrangements of Polycyclic α-Ketols. Organic letters, 2017, 19, 301-303 |
1544982 | CIF | C40 H89 Ga O13 Si3 | P -1 | 18.0886; 25.2724; 26.1157 62.983; 89.953; 89.655 | 10635.5 | Searles, Keith; Siddiqi, Georges; Safonova, Olga V.; Copéret, Christophe Silica-supported isolated gallium sites as highly active, selective and stable propane dehydrogenation catalysts Chem. Sci., 2017, 8, 2661 |
1544983 | CIF | C34 H30 Cu4 I4 N6 S4 | P 1 21/n 1 | 14.003; 8.7535; 16.9635 90; 93.969; 90 | 2074.32 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544984 | CIF | C34 H30 Cu4 I4 N6 S4 | P -1 | 8.811; 10.0997; 12.544 101.523; 102.995; 104.283 | 1014.82 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544985 | CIF | C35 H32 Cl2 Cu4 I4 N6 S4 | C 1 2/c 1 | 28.265; 16.1159; 10.1658 90; 109.463; 90 | 4366.1 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544986 | CIF | C36 H34 Cl4 Cu4 I4 N6 S4 | C 1 2/c 1 | 25.9718; 10.2757; 17.5936 90; 90.94; 90 | 4694.72 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544987 | CIF | C17 H15 Cu N5 O6 S2 | C 1 2/c 1 | 17.889; 12.2339; 20.7705 90; 101.703; 90 | 4451.18 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544988 | CIF | C34 H30 Cu2 I2 N6 S4 | P 1 21/n 1 | 10.1355; 8.3969; 21.0712 90; 95.58; 90 | 1784.8 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544989 | CIF | C17 H15 N3 S2 | P 1 21/n 1 | 10.5537; 9.2526; 16.335 90; 107.345; 90 | 1522.57 | Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation Chem. Sci., 2017, 8, 2592 |
1544990 | CIF | C30 H22 N2 O2 | P 1 21/c 1 | 8.878; 12.26; 21.373 90; 95.593; 90 | 2315.3 | Zhang, Jingjing; Wu, Xia; Gao, Qinghe; Geng, Xiao; Zhao, Peng; Wu, Yan-Dong; Wu, Anxin Diamination/Oxidative Cross-Coupling/Bicyclization of Anilines and Methyl Ketones: Direct I2-Promoted Synthesis of 1,2-Fused Oxindoles. Organic letters, 2017, 19, 408-411 |
1544991 | CIF | C18 H17 F3 O2 S2 | P c a 21 | 11.2567; 11.6409; 27.0758 90; 90; 90 | 3548 | Li, Haoyu; Shan, Cuicui; Tung, Chen-Ho; Xu, Zhenghu Dual gold and photoredox catalysis: visible light-mediated intermolecular atom transfer thiosulfonylation of alkenes Chem. Sci., 2017, 8, 2610 |
1544992 | CIF | C12 H13 F3 O2 S2 | P -1 | 5.6786; 8.4547; 15.2755 95.353; 96.231; 102.129 | 707.68 | Li, Haoyu; Shan, Cuicui; Tung, Chen-Ho; Xu, Zhenghu Dual gold and photoredox catalysis: visible light-mediated intermolecular atom transfer thiosulfonylation of alkenes Chem. Sci., 2017, 8, 2610 |
1544993 | CIF | C49 H32 B2 F22 N O2 P | P 1 21/n 1 | 12.2342; 24.232; 18.5607 90; 100.311; 90 | 5413.6 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1544994 | CIF | C30 H23 B F15 N | P 1 21 1 | 9.1176; 16.071; 19.36 90; 98.211; 90 | 2807.7 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1544995 | CIF | C24 H24 B F10 N | P -1 | 9.6021; 9.8581; 13.16 73.124; 77.164; 81.941 | 1158.44 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1544996 | CIF | C38 H25 B2 F20 N O2 | P 1 21/n 1 | 14.4987; 11.0883; 23.6041 90; 106.503; 90 | 3638.4 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1544997 | CIF | C44 H24 B2 F25 N O2 | P 1 21/n 1 | 11.0648; 22.0848; 20.1904 90; 102.354; 90 | 4819.56 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1544998 | CIF | C24 H24 B F10 N3 O2 | P 1 21/n 1 | 7.0432; 18.5654; 19.9939 90; 98.022; 90 | 2588.82 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1544999 | CIF | C26 H28 B F10 N3 O2 | P 1 21/c 1 | 11.4759; 11.5926; 20.7695 90; 95.877; 90 | 2748.6 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1545000 | CIF | C32 H30 B F10 N | P -1 | 10.9697; 11.2538; 13.9662 93.564; 101.334; 106.008 | 1612.53 | Erker, Gerhard; Wang, Tongdao; Wang, Long; Daniliuc, Constantin Gabriel; Samigullin, Kamil; Wagner, Matthias; Kehr, Gerald CO/CO and NO/NO Coupling at a Hidden Frustrated Lewis Pair Template Chem. Sci., 2017 |
1545003 | CIF | C59 H90 N8 O15 | P 21 21 21 | 11.152; 16.7802; 35.226 90; 90; 90 | 6591.9 | Jang, Jun-Pil; Nogawa, Toshihiko; Futamura, Yushi; Shimizu, Takeshi; Hashizume, Daisuke; Takahashi, Shunji; Jang, Jae-Hyuk; Ahn, Jong Seog; Osada, Hiroyuki Octaminomycins A and B, Cyclic Octadepsipeptides Active against Plasmodium falciparum. Journal of natural products, 2017, 80, 134-140 |
1545005 | CIF | C301 H348 N8 O17 Zn | P 1 c 1 | 31.7209; 19.3373; 50.4748 90; 96.0619; 90 | 30787.9 | Kohn, Daniel R.; Movsisyan, Levon D.; Thompson, Amber L.; Anderson, Harry L. Porphyrin-Polyyne [3]- and [5]Rotaxanes. Organic letters, 2017, 19, 348-351 |
1545006 | CIF | C252 H330 Ag28 P4 Pt S18 | C 1 2/c 1 | 50.8135; 29.3497; 49.1614 90; 110.274; 90 | 68775 | Kang, Xi; Zhou, Meng; Wang, Shuxin; Jin, Shan; Sun, Guodong; Zhu, Manzhou; Jin, Rongchao The tetrahedral structure and luminescence properties of Bi-metallic Pt1Ag28(SR)18(PPh3)4 nanocluster Chem. Sci., 2017, 8, 2581 |
1545007 | CIF | C52 H96 Cl2 Mg N4 O30 | P 4 | 14.1242; 14.1242; 16.617 90; 90; 90 | 3314.98 | Barker, Emily C.; Martin, Adam D.; Garvey, Christopher J.; Goh, Ching Yong; Jones, Franca; Mocerino, Mauro; Skelton, Brian W.; Ogden, Mark I.; Becker, Thomas Thermal annealing behaviour and gel to crystal transition of a low molecular weight hydrogelator. Soft matter, 2017, 13, 1006-1011 |
1545008 | CIF | C15 H18 O9 | P 21 21 21 | 5.1645; 13.0453; 22.127 90; 90; 90 | 1490.75 | Verastegui-Omaña, Brisa; Rebollar-Ramos, Daniela; Pérez-Vásquez, Araceli; Martínez, Ana Laura; Madariaga-Mazón, Abraham; Flores-Bocanegra, Laura; Mata, Rachel α-Glucosidase Inhibitors from Malbranchea flavorosea. Journal of natural products, 2017, 80, 190-195 |
1545009 | CIF | C11 H13 O5.5 | C 1 2 1 | 20.881; 7.2139; 7.1436 90; 95.201; 90 | 1071.6 | Verastegui-Omaña, Brisa; Rebollar-Ramos, Daniela; Pérez-Vásquez, Araceli; Martínez, Ana Laura; Madariaga-Mazón, Abraham; Flores-Bocanegra, Laura; Mata, Rachel α-Glucosidase Inhibitors from Malbranchea flavorosea. Journal of natural products, 2017, 80, 190-195 |
1545010 | CIF | C72 H50 F12 | C 1 2/c 1 | 21.1206; 21.8158; 15.5581 90; 111.402; 90 | 6674.3 | Byun, Yearin; Cho, Moses; Kim, Daeok; Jung, Yousung; Coskun, Ali Edge-Functionalized Graphene Nanoribbon Frameworks for the Capture and Separation of Greenhouse Gases Macromolecules, 2017 |
1545011 | CIF HKL Paper | C12 H9 Br N2 O2 S | P 1 21/c 1 | 9.12236; 18.7734; 7.70271 90; 108.576; 90 | 1250.42 | Sheikh, Md. Chanmiya; Yoshimura, Toshiaki; Fujii, Takayoshi; Miyatake, Ryuta <i>N</i>-Bromo-<i>S</i>-(4-nitrophenyl)-<i>S</i>-phenylsulfimide IUCrData, 2017, 2, x162033 |
1545012 | CIF HKL Paper | C18 H25 N O4 | P 1 21/c 1 | 10.3476; 10.7877; 16.922 90; 106.214; 90 | 1813.8 | Janzen, Daron E.; Majerle, Rita S.; Novosad, Katie L. <i>N</i>,<i>N</i>-Dibutylanilinium hydrogen squarate IUCrData, 2017, 2, x162065 |
1545013 | CIF HKL | C14 H12 I N O3 S | P -1 | 11.0543; 12.1612; 12.3464 119.14; 94.668; 93.182 | 1436.2 | Naveen, S.; Suresha, E.; Sudha, A. G.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M. 4-Iodo-<i>N</i>-(<i>o</i>-tolylsulfonyl)benzamide IUCrData, 2017, 2, x162030 |
1545014 | CIF HKL Paper | C19 H20 N4 O S | P 1 21/c 1 | 10.4024; 17.797; 10.2829 90; 112.908; 90 | 1753.5 | Xu, Jianchao; Wang, Hewen 3-(4-Amino-3-ethyl-5-sulfanylidene-4,5-dihydro-1<i>H</i>-1,2,4-triazol-1-yl)-1,3-diphenylpropan-1-one IUCrData, 2017, 2, x162001 |
1545015 | CIF HKL Paper | C10 H10 Co F12 O8 | P 1 21/c 1 | 11.139; 6.979; 12.546 90; 102.221; 90 | 953.2 | Tominaga, Takumi; Mochida, Tomoyuki <i>trans</i>-Diaquabis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(II) dihydrate IUCrData, 2017, 2, x170002 |
1545016 | CIF HKL Paper | C14 H18 Cl N3 O S | P -1 | 5.9923; 11.0704; 12.1128 107.981; 91.3414; 97.2061 | 756.6 | Arafath, Md. Azharul; Adam, Farook; Razali, Mohd. R. (<i>E</i>)-2-(5-Chloro-2-hydroxybenzylidene)-<i>N</i>-cyclohexylhydrazine-1-carbothioamide IUCrData, 2017, 2, x161997 |
1545017 | CIF HKL Paper | C15 H16 F N O2 S2 | P -1 | 7.1284; 12.2818; 18.3709 75.625; 88.538; 86.553 | 1555.1 | El-Khatatneh, Nasseem; Chandra; Rajesh, B. M.; Kumar, Shamantha; Doreswamy, B. H.; Mahendra, M. (6-Fluoro-2-oxo-2<i>H</i>-chromen-4-yl)methyl diethylcarbamodithioate IUCrData, 2017, 2, x162069 |
1545018 | CIF HKL Paper | C17 H16 N2 S | P 21 21 21 | 8.4001; 9.6239; 18.0037 90; 90; 90 | 1455.5 | El Ghayati, Lhoussaine; Hamou Ahabchane, Noureddine; Lamine Doumbia, Mohamadou; Sebbar, Nada Kheira; Essassi, El Mokhtar; Mague, Joel T. 1-Ethyl-4-phenyl-1,5-benzodiazepine-2-thione IUCrData, 2017, 2, x161998 |
1545019 | CIF HKL Paper | C14 H14 N2 O | P c a 21 | 23.44; 4.6307; 10.6408 90; 90; 90 | 1155 | Arafath, Md. Azharul; Adam, Farook; Razali, Mohd. R. (<i>E</i>)-2-Methyl-6-{[(5-methylpyridin-2-yl)imino]methyl}phenol IUCrData, 2017, 2, x162009 |
1545020 | CIF | C22 H22 O5 | P 1 | 5.5512; 8.9374; 19.4754 102.143; 93.557; 90.362 | 942.61 | Fu, Kai; Zhang, Jingchuan; Lin, Lili; Li, Jun; Liu, Xiaohua; Feng, Xiaoming Chiral N,N′-Dioxide/Lanthanide(III) Complex Catalyzed Asymmetric Bisvinylogous Mukaiyama Aldol Reactions Organic Letters, 2017 |
1545021 | CIF HKL | C21 H21 O3 P Se | P 1 21/n 1 | 8.351; 27.156; 8.545 90; 99.414; 90 | 1911.7 | Raymundo, Melina; Padgett, Clifford W.; Lynch, Will E. Tris(2-methoxyphenyl)phosphine selenide IUCrData, 2017, 2, x170009 |
1545025 | CIF | C45 H26 Cl N4 S2 | C 1 2/c 1 | 30.0933; 8.439; 26.6268 90; 95.566; 90 | 6730.2 | Okazaki, Masato; Takeda, Youhei; Data, Przemyslaw; Pander, Piotr; Higginbotham, Heather; Monkman, Andrew P.; Minakata, Satoshi Thermally activated delayed fluorescent phenothiazine‒dibenzo[a,j]phenazine‒phenothiazine triads exhibiting tricolor-changing mechanochromic luminescence Chem. Sci., 2017, 8, 2677 |
1545026 | CIF | C10 H8 S2 | P 1 21/c 1 | 5.81321; 7.5432; 10.2777 90; 93.249; 90 | 449.95 | Viglianti, Lucia; Leung, Nelson L. C.; Xie, Ni; Gu, Xinggui; Sung, Herman H. Y.; Miao, Qian; Williams, Ian D.; Licandro, Emanuela; Tang, Ben Zhong Aggregation-induced emission: mechanistic study of the clusteroluminescence of tetrathienylethene Chem. Sci., 2017, 8, 2629 |
1545027 | CIF | C18 H10 S4 | P 1 21/n 1 | 10.91901; 8.76755; 15.8755 90; 93.1272; 90 | 1517.55 | Viglianti, Lucia; Leung, Nelson L. C.; Xie, Ni; Gu, Xinggui; Sung, Herman H. Y.; Miao, Qian; Williams, Ian D.; Licandro, Emanuela; Tang, Ben Zhong Aggregation-induced emission: mechanistic study of the clusteroluminescence of tetrathienylethene Chem. Sci., 2017, 8, 2629 |
1545028 | CIF | C18 H12 S4 | P 1 21/n 1 | 9.316; 9.10329; 9.6346 90; 110.853; 90 | 763.55 | Viglianti, Lucia; Leung, Nelson L. C.; Xie, Ni; Gu, Xinggui; Sung, Herman H. Y.; Miao, Qian; Williams, Ian D.; Licandro, Emanuela; Tang, Ben Zhong Aggregation-induced emission: mechanistic study of the clusteroluminescence of tetrathienylethene Chem. Sci., 2017, 8, 2629 |
1545029 | CIF | C20 H24 N O5.5 P | P 1 | 8.8456; 13.4959; 17.587 92.181; 98.685; 106.652 | 1981.1 | Suneja, Arun; Unhale, Rajshekhar A.; Singh, Vinod K. Enantioselective Hydrophosphonylation of in Situ Generated N-Acyl Ketimines Catalyzed by BINOL-Derived Phosphoric Acid. Organic letters, 2017, 19, 476-479 |
1545030 | CIF | C11 H10 Cl N O2 S | P -1 | 5.6654; 8.296; 13.194 83.624; 85.285; 79.966 | 605.6 | Modi, Anju; Ali, Wajid; Patel, Bhisma K. Organocatalytic Regioselective Concomitant Thiocyanation and Acylation of Oxiranes Using Aroyl Isothiocyanates. Organic letters, 2017 |
1545031 | CIF | C17 H15 N O2 S | P 1 21/n 1 | 8.2271; 10.0704; 19.1028 90; 98.364; 90 | 1565.84 | Modi, Anju; Ali, Wajid; Patel, Bhisma K. Organocatalytic Regioselective Concomitant Thiocyanation and Acylation of Oxiranes Using Aroyl Isothiocyanates. Organic letters, 2017 |
1545033 | CIF HKL Paper | C18 H18 N2 O5 | P 1 21/c 1 | 10.1622; 19.1448; 8.4373 90; 102.425; 90 | 1603.06 | Ranjani, T. Siva; Poomathi, N.; Vimala, G.; Perumal, Paramasivam T.; Murugesan, K. Sakthi 1-Cyclohexyl-5-(2-hydroxybenzoyl)-3-nitropyridin-2(1<i>H</i>)-one IUCrData, 2017, 2, x170004 |
1545034 | CIF HKL Paper | C9 H7 N O2 | P 1 21/n 1 | 9.9869; 5.3008; 13.9874 90; 93.106; 90 | 739.39 | Essaghouani, Abdelhanine; Boulhaoua, Mohammed; El Ouasif, Latifa; Sebbar, Nada Kheira; Essassi, El Mokhtar; Mague, Joel T. 3-Phenylisoxazolin-5-one: a redetermination IUCrData, 2017, 2, x170032 |
1545035 | CIF HKL Paper | C29 H24 N2 O S | P -1 | 8.7383; 14.1443; 19.2405 90.732; 92.181; 91.394 | 2375.4 | Akrad, Rachida; Mague, Joel T.; Guerrab, Walid; Taoufik, Jamal; Ansar, Mhamed; Ramli, Youssef 1-Benzyl-2-benzylsulfanyl-4,4-diphenyl-4,5-dihydro-1<i>H</i>-imidazol-5-one IUCrData, 2017, 2, x170033 |
1545036 | CIF HKL Paper | C26 H23 N5 O5 S | P 1 21/n 1 | 13.2381; 9.9265; 19.0348 90; 100.693; 90 | 2457.89 | Seethalakshmi, P.; Palanivel, C. 1-Allyl-3'-phenyl-6'<i>H</i>-spiro[indoline-3,4'-isoxazolo[4',5':5,6]pyrido[2,3-<i>d</i>]pyrimidine]-2,5',7'(8'<i>H</i>,9'<i>H</i>)-trione dimethyl sulfoxide monosolvate IUCrData, 2017, 2, x162044 |
1545037 | CIF HKL Paper | C14 H21 N5 S | P 1 21/c 1 | 20.7954; 6.2107; 11.7871 90; 90.653; 90 | 1522.25 | Mague, Joel T.; Mohamed, Shaaban K.; Akkurt, Mehmet; Marzouk, Adel A.; Abdel-Rahman, Hamdy M.; Hawaiz, Farouq E. 4-Cyclohexyl-3-[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)methyl]-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione IUCrData, 2017, 2, x170020 |
1545038 | CIF HKL | C33 H35 Mo O3 P | P -1 | 10.9903; 11.2364; 14.1608 89.737; 78.229; 60.997 | 1488.2 | Whited, Matthew T.; Ruffer, Eli J.; Zhang, Jia; Rabaey, Dominique J.; Janzen, Daron E. <i>trans</i>-Acetyldicarbonyl(η^5^-cyclopentadienyl)[tris(3,5-dimethylphenyl)phosphane-κ<i>P</i>]molybdenum(II) IUCrData, 2017, 2, x170042 |
1545039 | CIF HKL | C13 H9 Cl I N O3 S | C 1 2/c 1 | 18.1163; 13.3947; 12.3002 90; 104.223; 90 | 2893.3 | Naveen, S.; Sudha, A. G.; Suresha, E.; Lokanath, N. K.; Suchetan, P. A.; Warad, Ismail <i>N</i>-(4-Chlorophenylsulfonyl)-4-iodobenzamide IUCrData, 2017, 2, x170025 |
1545040 | CIF HKL Paper | C17 H12 Cl2 O2 S | C 1 2/c 1 | 19.3473; 9.9623; 18.5845 90; 116.194; 90 | 3214.2 | Ravi, A. J.; Vinayaka, A. C.; Roopashree, K. R.; Sadashiva, M. P.; Devarajegowda., H. C. (<i>Z</i>)-1,4-Bis(2-chlorophenyl)-2-(methylsulfanyl)but-2-ene-1,4-dione IUCrData, 2017, 2, x162047 |
1545041 | CIF HKL Paper | C16 H17 Cl O4 | P 1 21/c 1 | 10.4412; 7.6959; 20.2651 90; 102.311; 90 | 1590.95 | Sharmila, N.; Sundar, T. V.; Sakthivel, P.; Venkatesan, P. Ethyl 6-(4-chlorophenyl)-2,2-dimethyl-4-oxo-3,4-dihydro-2<i>H</i>-pyran-5-carboxylate IUCrData, 2017, 2, x170034 |
1545042 | CIF HKL Paper | C16 H11 F N2 O | P 1 21/c 1 | 13.211; 13.685; 6.858 90; 92.971; 90 | 1238.2 | Bougueria, Hassiba; Chetioui, Souheyla; Mili, Assia; eddine Bouaoud, Salah; Merazig, Hocine (<i>E</i>)-1-(4-Fluorophenyl)-2-(2-oxidonaphthalen-1-yl)diazen-1-ium IUCrData, 2017, 2, x170039 |
1545043 | CIF HKL Paper | C11 H13 Cl2 N O | C 1 c 1 | 14.7725; 9.3588; 9.8079 90; 116.308; 90 | 1215.53 | Seethalakshmi, P.; Palanivel, C. 4-[Bis(2-chloroethyl)amino]benzaldehyde IUCrData, 2017, 2, x162043 |
1545044 | CIF HKL Paper | C11 H8 F N O2 | P n a 21 | 31.531; 4.2752; 14.108 90; 90; 90 | 1901.8 | Qachchachi, Fatim-Zahrae; Mague, Joel T.; Kandri Rodi, Youssef; Haoudi, Amal; Ouzidan, Younes; Essassi, El Mokhtar 5-Fluoro-1-(prop-2-en-1-yl)-2,3-dihydro-1<i>H</i>-indole-2,3-dione IUCrData, 2017, 2, x170028 |
1545045 | CIF | C55 H23 Co F28 N4 O9 P3 Yb | C 1 2/c 1 | 24.588; 10.147; 24.582 90; 92.11; 90 | 6129 | Hu, Ji-Yun; Ning, Yingying; Meng, Yin-Shan; Zhang, Jing; Wu, Zhuo-Yan; Gao, Song; Zhang, Jun-Long Highly near-IR emissive ytterbium(iii) complexes with unprecedented quantum yields Chem. Sci., 2017, 8, 2702 |
1545046 | CIF | C57 H34 Cl5 Co F20 N4 O11 P3 Yb | C m c m | 15.8901; 19.2041; 22.9477 90; 90; 90 | 7002.6 | Hu, Ji-Yun; Ning, Yingying; Meng, Yin-Shan; Zhang, Jing; Wu, Zhuo-Yan; Gao, Song; Zhang, Jun-Long Highly near-IR emissive ytterbium(iii) complexes with unprecedented quantum yields Chem. Sci., 2017, 8, 2702 |
1545047 | CIF | C55 H25 Co D18 F8 N4 O9 P3 Yb | P -1 | 12.2948; 14.0793; 16.6204 72.8693; 73.873; 77.72 | 2614.22 | Hu, Ji-Yun; Ning, Yingying; Meng, Yin-Shan; Zhang, Jing; Wu, Zhuo-Yan; Gao, Song; Zhang, Jun-Long Highly near-IR emissive ytterbium(iii) complexes with unprecedented quantum yields Chem. Sci., 2017, 8, 2702 |
1545050 | CIF | C49 H42 F24 N8 O4 P4 | P 1 21/n 1 | 10.6431; 41.576; 13.8546 90; 110.763; 90 | 5732.5 | Wang, Yuping; Sun, Junling; Liu, Zhichang; Nassar, Majed S.; Botros, Youssry Y.; Stoddart, J. Fraser Radically promoted formation of a molecular lasso Chem. Sci., 2017, 8, 2562 |
1545055 | CIF | C18 H18 N2 O4 | P 1 21 1 | 15.1202; 5.6812; 19.0459 90; 97.578; 90 | 1621.77 | Berthet, Mathéo; Legrand, Baptiste; Martinez, Jean; Parrot, Isabelle A General Approach to the Aza-Diketomorpholine Scaffold Organic Letters, 2017 |
1545056 | CIF HKL Paper | C30 H16 Hg2 N6 S4 | P 1 21/c 1 | 6.9175; 17.6267; 12.0029 90; 91.017; 90 | 1463.32 | Tan, Shuzhi; Liu, Leili; Du, Yongli <i>catena</i>-Poly[[μ~2~-4,4'-bis(pyridin-3-ylethynyl)-1,1'-biphenyl-κ^2^<i>N</i>:<i>N</i>']bis(μ~2~-thiocyanato-κ^2^<i>N</i>:<i>S</i>)bis(thiocyanato-κ<i>S</i>)dimercury(II)] IUCrData, 2017, 2, x170059 |
1545057 | CIF HKL | C15 H15 F O3 | P 1 21/c 1 | 7.0373; 20.7068; 8.4725 90; 92.088; 90 | 1233.79 | Ayswariya, I.; Rajalakshmi, P.; Krishnakumar, R.V.; Srinivasan, N. 9-Fluoro-2,4,4a,6-tetrahydrospiro[benzo[<i>c</i>]chromene-3,2'-[1,3]dioxolane] IUCrData, 2017, 2, x170045 |
1545066 | CIF | C14 H17 N O4 | P 1 21 1 | 9.3634; 5.3559; 13.9632 90; 107.183; 90 | 668.99 | Lee, Melissa; Sanford, Melanie S. Remote C(sp(3))-H Oxygenation of Protonated Aliphatic Amines with Potassium Persulfate. Organic letters, 2017, 19, 572-575 |
1545067 | CIF | C16 H18 Cl N3 O | P 21 21 21 | 8.5445; 9.1514; 19.7296 90; 90; 90 | 1542.74 | Maury, Julien; Zawodny, Wojciech; Clayden, Jonathan Stereospecific Intramolecular Arylation of 2- and 3-Pyridyl Substituted Alkylamines via Configurationally Stable α-Pyridyl Organolithiums. Organic letters, 2017, 19, 472-475 |
1545073 | CIF | Ag Ca O4 V | P n m a | 7.03255; 5.86684; 9.3856 90; 90; 90 | 387.239 | PANalytical AgCaVO4 : structure solution from a benchtop X-ray powder diffractometer Aeris Research Edition, 2017, 1, 1-2 |
1545087 | CIF | C36 H31 N O | P 1 21/c 1 | 11.0097; 13.4734; 18.182 90; 97.777; 90 | 2672.28 | Tang, Junbin; Li, Shiqing; Liu, Zheng; Zhao, Yinsong; She, Zhijie; Kadam, Vilas D.; Gao, Ge; Lan, Jingbo; You, Jingsong Cascade C-H Annulation of Aldoximes with Alkynes Using O2 as the Sole Oxidant: One-Pot Access to Multisubstituted Protoberberine Skeletons. Organic letters, 2017, 19, 604-607 |
1545090 | CIF | C22 H29 F N3 O9 P | P 21 21 21 | 11.355; 13.612; 16.835 90; 90; 90 | 2602.1 | McCabe Dunn, Jamie M.; Reibarkh, Mikhail; Sherer, Edward C.; Orr, Robert K.; Ruck, Rebecca T.; Simmons, Bryon; Bellomo, Ana The protecting-group free selective 3′-functionalization of nucleosides Chem. Sci., 2017, 8, 2804 |
1545091 | CIF | C18 H17 F5 N O5 P | P 1 | 5.2533; 12.0015; 16.3874 74.879; 84.088; 80.148 | 980.85 | McCabe Dunn, Jamie M.; Reibarkh, Mikhail; Sherer, Edward C.; Orr, Robert K.; Ruck, Rebecca T.; Simmons, Bryon; Bellomo, Ana The protecting-group free selective 3′-functionalization of nucleosides Chem. Sci., 2017, 8, 2804 |
1545092 | CIF | C16 H15 Br O2 | C 1 2 1 | 19.2401; 7.48163; 19.9656 90; 104.461; 90 | 2782.94 | Kossler, D.; Cramer, N. Neutral chiral cyclopentadienyl Ru(ii)Cl catalysts enable enantioselective [2+2]-cycloadditions Chem. Sci., 2017, 8, 1862 |
1545093 | CIF | C54 H51 Cl O2 Ru | P 1 | 10.9092; 12.5543; 15.2599 86.71; 83.989; 89.249 | 2074.99 | Kossler, D.; Cramer, N. Neutral chiral cyclopentadienyl Ru(ii)Cl catalysts enable enantioselective [2+2]-cycloadditions Chem. Sci., 2017, 8, 1862 |
1545094 | CIF | C46 H50 Br Cl2 N3 O2 P2 Pd | P 21 21 21 | 12.7416; 15.3629; 22.5851 90; 90; 90 | 4420.99 | Ji, Yining; Li, Hongming; Hyde, Alan M.; Chen, Qinghao; Belyk, Kevin M.; Lexa, Katrina W.; Yin, Jingjun; Sherer, Edward C.; Williamson, R. Thomas; Brunskill, Andrew; Ren, Sumei; Campeau, Louis-Charles; Davies, Ian W.; Ruck, Rebecca T. A rational pre-catalyst design for bis-phosphine mono-oxide palladium catalyzed reactions Chem. Sci., 2017, 8, 2841 |
1545095 | CIF | C18 H28 Br2 N2 P2 Pd | P 21 21 21 | 7.6802; 15.4523; 18.383 90; 90; 90 | 2181.63 | Ji, Yining; Li, Hongming; Hyde, Alan M.; Chen, Qinghao; Belyk, Kevin M.; Lexa, Katrina W.; Yin, Jingjun; Sherer, Edward C.; Williamson, R. Thomas; Brunskill, Andrew; Ren, Sumei; Campeau, Louis-Charles; Davies, Ian W.; Ruck, Rebecca T. A rational pre-catalyst design for bis-phosphine mono-oxide palladium catalyzed reactions Chem. Sci., 2017, 8, 2841 |
1545096 | CIF | C25 H32 Br N3 O P2 Pd | C 1 2 1 | 23.434; 10.7208; 10.6091 90; 95.3448; 90 | 2653.7 | Ji, Yining; Li, Hongming; Hyde, Alan M.; Chen, Qinghao; Belyk, Kevin M.; Lexa, Katrina W.; Yin, Jingjun; Sherer, Edward C.; Williamson, R. Thomas; Brunskill, Andrew; Ren, Sumei; Campeau, Louis-Charles; Davies, Ian W.; Ruck, Rebecca T. A rational pre-catalyst design for bis-phosphine mono-oxide palladium catalyzed reactions Chem. Sci., 2017, 8, 2841 |
1545097 | CIF | C26 H24 N2 O6 S2 | P 21 21 21 | 8.7715; 15.9157; 36.3389 90; 90; 90 | 5073.1 | Liu, Ren-Rong; Hu, Jiang-Ping; Hong, Jian-Jun; Lu, Chuan-Jun; Gao, Jian-Rong; Jia, Yi-Xia Enantioselective [2 + 2] cycloaddition of N-allenamides with cyclic N-sulfonylketimines: access to polysubstituted azetidines bearing quaternary stereocenters Chem. Sci., 2017, 8, 2811 |
1545098 | CIF | C17 H14 S2 | C 1 c 1 | 15.2642; 15.1883; 6.0321 90; 96.7418; 90 | 1388.8 | Minemawari, Hiromi; Tanaka, Mutsuo; Tsuzuki, Seiji; Inoue, Satoru; Yamada, Toshikazu; Kumai, Reiji; Shimoi, Yukihiro; Hasegawa, Tatsuo Enhanced Layered-Herringbone Packing due to Long Alkyl Chain Substitution in Solution-Processable Organic Semiconductors Chemistry of Materials, 2017, 29, 1245 |
1545099 | CIF | C16 H12 S2 | P 1 21 1 | 9.1532; 6.0178; 11.7576 90; 94.1913; 90 | 645.9 | Minemawari, Hiromi; Tanaka, Mutsuo; Tsuzuki, Seiji; Inoue, Satoru; Yamada, Toshikazu; Kumai, Reiji; Shimoi, Yukihiro; Hasegawa, Tatsuo Enhanced Layered-Herringbone Packing due to Long Alkyl Chain Substitution in Solution-Processable Organic Semiconductors Chemistry of Materials, 2017, 29, 1245 |
1545100 | CIF | C50 H58 N2 O4 Zn2 | P 1 21/c 1 | 11.954; 9.072; 19.907 90; 101.38; 90 | 2116.4 | Jędrzkiewicz, Dawid; Adamus, Grażyna; Kwiecień, Michał; John, Łukasz; Ejfler, Jolanta Lactide as the Playmaker of the ROP Game: Theoretical and Experimental Investigation of Ring-Opening Polymerization of Lactide Initiated by Aminonaphtholate Zinc Complexes. Inorganic chemistry, 2017, 56, 1349-1365 |
1545101 | CIF | C59 H70 N2 O4 Zn2 | C 1 2/c 1 | 23.384; 13.614; 16.424 90; 105.23; 90 | 5045 | Jędrzkiewicz, Dawid; Adamus, Grażyna; Kwiecień, Michał; John, Łukasz; Ejfler, Jolanta Lactide as the Playmaker of the ROP Game: Theoretical and Experimental Investigation of Ring-Opening Polymerization of Lactide Initiated by Aminonaphtholate Zinc Complexes. Inorganic chemistry, 2017, 56, 1349-1365 |
1545102 | CIF | C36 H44 N2 O2 Zn | P b c a | 14.482; 15.42; 27.296 90; 90; 90 | 6096 | Jędrzkiewicz, Dawid; Adamus, Grażyna; Kwiecień, Michał; John, Łukasz; Ejfler, Jolanta Lactide as the Playmaker of the ROP Game: Theoretical and Experimental Investigation of Ring-Opening Polymerization of Lactide Initiated by Aminonaphtholate Zinc Complexes. Inorganic chemistry, 2017, 56, 1349-1365 |
1545103 | CIF | C36 H56 N2 O2 Zn | P -1 | 5.986; 12.333; 23.801 102.2; 96.27; 96.31 | 1691.1 | Jędrzkiewicz, Dawid; Adamus, Grażyna; Kwiecień, Michał; John, Łukasz; Ejfler, Jolanta Lactide as the Playmaker of the ROP Game: Theoretical and Experimental Investigation of Ring-Opening Polymerization of Lactide Initiated by Aminonaphtholate Zinc Complexes. Inorganic chemistry, 2017, 56, 1349-1365 |
1545104 | CIF | C20.33 H40.67 B6 Cl0.67 Ir2 | P -1 | 12.7437; 15.8667; 21.9272 74.729; 86.099; 68.806 | 3986 | Borthakur, Rosmita; Kar, Sourav; Barik, Subrat Kumar; Bhattacharya, Somnath; Kundu, Gargi; Varghese, Babu; Ghosh, Sundargopal Synthesis, Chemistry, and Electronic Structures of Group 9 Metallaboranes. Inorganic chemistry, 2017, 56, 1524-1533 |
1545105 | CIF | C30 H49 B5 Cl Ir3 | P b c n | 18.0776; 23.0282; 16.1926 90; 90; 90 | 6740.9 | Borthakur, Rosmita; Kar, Sourav; Barik, Subrat Kumar; Bhattacharya, Somnath; Kundu, Gargi; Varghese, Babu; Ghosh, Sundargopal Synthesis, Chemistry, and Electronic Structures of Group 9 Metallaboranes. Inorganic chemistry, 2017, 56, 1524-1533 |
1545106 | CIF | C41 H82 B20 Cl2 Ir4 | C 1 2/c 1 | 33.2362; 10.6642; 16.7899 90; 111.793; 90 | 5525.7 | Borthakur, Rosmita; Kar, Sourav; Barik, Subrat Kumar; Bhattacharya, Somnath; Kundu, Gargi; Varghese, Babu; Ghosh, Sundargopal Synthesis, Chemistry, and Electronic Structures of Group 9 Metallaboranes. Inorganic chemistry, 2017, 56, 1524-1533 |
1545107 | CIF | C20 H38 B10 Ir2 O2 | P n m a | 16.6847; 14.6954; 10.9866 90; 90; 90 | 2693.79 | Borthakur, Rosmita; Kar, Sourav; Barik, Subrat Kumar; Bhattacharya, Somnath; Kundu, Gargi; Varghese, Babu; Ghosh, Sundargopal Synthesis, Chemistry, and Electronic Structures of Group 9 Metallaboranes. Inorganic chemistry, 2017, 56, 1524-1533 |
1545108 | CIF | C38 H54 Au B6 Co2 P | P 1 21/c 1 | 19.911; 12.631; 17.268 90; 103.586; 90 | 4221.3 | Borthakur, Rosmita; Kar, Sourav; Barik, Subrat Kumar; Bhattacharya, Somnath; Kundu, Gargi; Varghese, Babu; Ghosh, Sundargopal Synthesis, Chemistry, and Electronic Structures of Group 9 Metallaboranes. Inorganic chemistry, 2017, 56, 1524-1533 |
1545109 | CIF | C15 H16 N4 O4 S | P -1 | 7.9986; 10.37; 11.701 106.83; 106.02; 104.49 | 833.4 | Chen, Lai; Zhu, Yu-Jie; Fan, Zhijin; Guo, Xiao-Feng; Zhang, Zhi-Ming; Xu, Jing-Hua; Song, Ying-Qi; Morzherin, Yury Yurievich; Belskaya, Nataliya P.; Bakulev, Vasiliy A. Synthesis of 1,2,3-Thiadizole and Thiazole Based Strobilurins as Potent Fungicide Candidates. Journal of agricultural and food chemistry, 2017 |
1545110 | CIF | C27 H29 N2 O4 S | P -1 | 9.7966; 10.1428; 13.7518 106.645; 99.595; 109.141 | 1184.44 | Lu, Yandong; Yuan, Haosen; Zhou, Shijie; Luo, Tuoping Total Syntheses of (-)-Hibiscone C and Lysergine: A Cyclization/Fragmentation Strategy. Organic letters, 2017, 19, 620-623 |
1545111 | CIF | Ba | P 21/b 1 1 | 11.608; 11.634; 4.634 90; 90; 90 | 625.81 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
1545112 | CIF | Ba | P 21/b 1 1 | 11.6146; 11.6256; 4.6341 90; 90; 90 | 625.727 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
1545113 | CIF | Ba | P 21/b 1 1 | 11.5313; 11.6527; 4.6109 90; 90; 90 | 619.57 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
1545114 | CIF | Ba | P 21/b 1 1 | 11.5457; 11.5882; 4.599 90; 90; 90 | 615.318 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
1545115 | CIF | Ba | P 21/b 1 1 | 11.4996; 11.5527; 4.6035 90; 90; 90 | 611.582 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
1545116 | CIF | Ba | P 21/b 1 1 | 11.439; 11.53; 4.5937 90; 90; 90 | 605.9 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
1545117 | CIF HKL | C20 H14 Br2 N2 O2 | P b c a | 7.4379; 18.736; 25.4469 90; 90; 90 | 3546.2 | Dekar, Souad; Bendia, Sabrina; Ouari, Kamel 2,2'-[(1<i>E</i>,1'<i>E</i>)-1,2-Phenylenebis(azanylylidene)bis(methanylylidene)]bis(4-bromophenol) IUCrData, 2017, 2, x170077 |
1545118 | CIF HKL Paper | C25 H15 Br N2 S | P 1 21/n 1 | 9.2966; 23.0723; 9.8089 90; 109.663; 90 | 1981.26 | Kavitha, T.; Mayakrishnan, Sivakalai; Perumal, T. Paramasivam; Suvasini, Chandramouleeswaran; Lakshmi, Srinivasakannan 2-(5-Bromothiophen-2-yl)-1-phenyl-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole IUCrData, 2017, 2, x170089 |
1545119 | CIF | C132 H242 Au34 S22 | P b c n | 26.0266; 27.9405; 28.5247 90; 90; 90 | 20743.1 | Dong, Hongwei; Liao, Lingwen; Zhuang, Shengli; Yao, Chuanhao; Chen, Jishi; Tian, Shubo; Zhu, Min; Liu, Xu; Li, Lingling; Wu, Zhikun A novel double-helical-kernel evolution pattern of gold nanoclusters: alternate single-stranded growth at both ends. Nanoscale, 2017, 9, 3742-3746 |
1545120 | CIF | C156 H286 Au42 S26 | P -1 | 20.6257; 20.7452; 30.3877 78.427; 80.789; 62.667 | 11281.4 | Dong, Hongwei; Liao, Lingwen; Zhuang, Shengli; Yao, Chuanhao; Chen, Jishi; Tian, Shubo; Zhu, Min; Liu, Xu; Li, Lingling; Wu, Zhikun A novel double-helical-kernel evolution pattern of gold nanoclusters: alternate single-stranded growth at both ends. Nanoscale, 2017, 9, 3742-3746 |
1545126 | CIF | C19 H18 O6 | P 1 21/c 1 | 11.8767; 9.3428; 16.2435 90; 113.85; 90 | 1648.49 | Nyandoro, Stephen S.; Munissi, Joan J. E.; Kombo, Msim; Mgina, Clarence A.; Pan, Fangfang; Gruhonjic, Amra; Fitzpatrick, Paul; Lu, Yu; Wang, Bin; Rissanen, Kari; Erdélyi, Máté Flavonoids from Erythrina schliebenii. Journal of natural products, 2017, 80, 377-383 |
1545127 | CIF | C19 H20 O6 | C 1 c 1 | 13.1824; 15.15072; 8.32489 90; 98.5002; 90 | 1644.41 | Nyandoro, Stephen S.; Munissi, Joan J. E.; Kombo, Msim; Mgina, Clarence A.; Pan, Fangfang; Gruhonjic, Amra; Fitzpatrick, Paul; Lu, Yu; Wang, Bin; Rissanen, Kari; Erdélyi, Máté Flavonoids from Erythrina schliebenii. Journal of natural products, 2017, 80, 377-383 |
1545128 | CIF | C21 H20 O5 | P -1 | 8.5769; 9.1101; 11.523 78.724; 76.207; 81.728 | 853.04 | Nyandoro, Stephen S.; Munissi, Joan J. E.; Kombo, Msim; Mgina, Clarence A.; Pan, Fangfang; Gruhonjic, Amra; Fitzpatrick, Paul; Lu, Yu; Wang, Bin; Rissanen, Kari; Erdélyi, Máté Flavonoids from Erythrina schliebenii. Journal of natural products, 2017, 80, 377-383 |
1545129 | CIF | C26 H30 O5 | P 21 21 21 | 5.18734; 20.1639; 21.6358 90; 90; 90 | 2263.04 | Nyandoro, Stephen S.; Munissi, Joan J. E.; Kombo, Msim; Mgina, Clarence A.; Pan, Fangfang; Gruhonjic, Amra; Fitzpatrick, Paul; Lu, Yu; Wang, Bin; Rissanen, Kari; Erdélyi, Máté Flavonoids from Erythrina schliebenii. Journal of natural products, 2017, 80, 377-383 |
1545136 | CIF | C11 H6 Br F3 O3 S | P 41 21 2 | 13.9189; 13.9189; 12.9169 90; 90; 90 | 2502.47 | Li, Minghao; Petersen, Jeffrey L.; Hoover, Jessica M. Silver-Mediated Oxidative Decarboxylative Trifluoromethylthiolation of Coumarin-3-carboxylic Acids. Organic letters, 2017, 19, 638-641 |
1545137 | CIF | C60.5 H43 Cl F15 N4 | P -1 | 14.8431; 15.2118; 15.2461 119.302; 106.276; 96.536 | 2749.1 | Kong, Jiahui; Shao, Jiewei; Li, Chengjie; Qi, Dongdong; Li, Minzhi; Liang, Xu; Zhu, Weihua; Jiang, Jianzhuang; Xie, Yongshu Neo-N-confused Phlorins and Phlorinone: Rational Synthesis and Tunable Properties. Organic letters, 2017, 19, 650-653 |
1545138 | CIF | C59 H39 F15 N4 | P -1 | 13.8688; 15.3205; 15.3261 119.469; 93.117; 105.428 | 2665.6 | Kong, Jiahui; Shao, Jiewei; Li, Chengjie; Qi, Dongdong; Li, Minzhi; Liang, Xu; Zhu, Weihua; Jiang, Jianzhuang; Xie, Yongshu Neo-N-confused Phlorins and Phlorinone: Rational Synthesis and Tunable Properties. Organic letters, 2017, 19, 650-653 |
1545139 | CIF | C52 H24.5 Cl0.5 F15 N4 O | P -1 | 12.5205; 14.7808; 15.1296 111.361; 106.737; 99.702 | 2376.9 | Kong, Jiahui; Shao, Jiewei; Li, Chengjie; Qi, Dongdong; Li, Minzhi; Liang, Xu; Zhu, Weihua; Jiang, Jianzhuang; Xie, Yongshu Neo-N-confused Phlorins and Phlorinone: Rational Synthesis and Tunable Properties. Organic letters, 2017, 19, 650-653 |
1545140 | CIF | C28 H21 Br F N4 O4.5 | P 1 21/c 1 | 12.8025; 25.114; 15.641 90; 105.965; 90 | 4835 | Wang, Xiao; Yang, Peng; Zhang, Yong; Tang, Chao-Zhe; Tian, Fang; Peng, Lin; Wang, Li-Xin Isatin N,N'-Cyclic Azomethine Imine 1,3-Dipole and Abnormal [3 + 2]-Cycloaddition with Maleimide in the Presence of 1,4-Diazabicyclo[2.2.2]octane. Organic letters, 2017, 19, 646-649 |
1545141 | CIF | C18 H14 Br N3 O2 | P -1 | 8.2891; 10.319; 10.7253 62.243; 79.445; 71.467 | 769.05 | Wang, Xiao; Yang, Peng; Zhang, Yong; Tang, Chao-Zhe; Tian, Fang; Peng, Lin; Wang, Li-Xin Isatin N,N'-Cyclic Azomethine Imine 1,3-Dipole and Abnormal [3 + 2]-Cycloaddition with Maleimide in the Presence of 1,4-Diazabicyclo[2.2.2]octane. Organic letters, 2017, 19, 646-649 |
1545142 | CIF | C51 H39 N3 | P 1 21/c 1 | 6.5882; 19.6254; 14.7997 90; 94.733; 90 | 1907.02 | Zhang, Zhenhao; Pi, Chao; Tong, Heng; Cui, Xiuling; Wu, Yangjie Iodine-Catalyzed Direct C‒H Alkenylation of Azaheterocycle N-Oxides with Alkenes Organic Letters, 2017 |
1545143 | CIF | C31 H28 O2 | P 21 21 21 | 5.8387; 15.6232; 25.7309 90; 90; 90 | 2347.15 | Guo, Rui; Zheng, Xinxin; Zhang, Dayong; Zhang, Guozhu Rhodium(i)-catalyzed stereoselective [4+2] cycloaddition of oxetanols with alkynes through C(sp(3))-C(sp(3)) bond cleavage. Chemical science, 2017, 8, 3002-3006 |
1545144 | CIF | C26 H26 O3 | P 1 21 1 | 12.8937; 6.0514; 14.068 90; 107.517; 90 | 1046.75 | Guo, Rui; Zheng, Xinxin; Zhang, Dayong; Zhang, Guozhu Rhodium(i)-catalyzed stereoselective [4+2] cycloaddition of oxetanols with alkynes through C(sp(3))-C(sp(3)) bond cleavage. Chemical science, 2017, 8, 3002-3006 |
1545147 | CIF | C27 H37 N3 O6 | P 21 21 21 | 10.831; 14.3307; 16.615 90; 90; 90 | 2578.9 | Zhang, Dewu; Zhao, Lili; Wang, Lining; Fang, Xiaomei; Zhao, Jianyuan; Wang, Xinwei; Li, Li; Liu, Hongyu; Wei, Yuzhen; You, Xuefu; Cen, Shan; Yu, Liyan Griseofulvin Derivative and Indole Alkaloids from Penicillium griseofulvum CPCC 400528. Journal of natural products, 2017, 80, 371-376 |
1545148 | CIF | C44 H52 O8 | P 1 21/c 1 | 4.7766; 41.019; 12.2047 90; 94.6748; 90 | 2383.33 | Heo, Jung-Moo; Kim, Youngmee; Han, Seulki; Joung, Joonyoung F.; Lee, Sang-hwa; Han, Sejin; Noh, Jaegeun; Kim, Jaeyong; Park, Sungnam; Lee, Haiwon; Choi, Yoon Mi; Jung, Young-Sik; Kim, Jong-Man Chromogenic Tubular Polydiacetylenes from Topochemical Polymerization of Self-Assembled Macrocyclic Diacetylenes Macromolecules, 2017, 50, 900 |
1545160 | CIF | C17 H14 O | P 1 21/n 1 | 12.0468; 6.2442; 16.9384 90; 109.936; 90 | 1197.8 | Garkhedkar, Amol Milind; Senadi, Gopal Chandru; Wang, Jeh-Jeng ZnBr2-Mediated Cascade Reaction of o-Alkoxy Alkynols: Synthesis of Indeno[1,2-c]chromenes. Organic letters, 2017, 19, 488-491 |
1545161 | CIF | C19 H16 O2 | P -1 | 5.0158; 12.9738; 21.6829 93.089; 94.326; 93.543 | 1401.85 | Garkhedkar, Amol Milind; Senadi, Gopal Chandru; Wang, Jeh-Jeng ZnBr2-Mediated Cascade Reaction of o-Alkoxy Alkynols: Synthesis of Indeno[1,2-c]chromenes. Organic letters, 2017, 19, 488-491 |
1545162 | CIF | C53 H90 N10 O11 | P 1 | 9.302; 9.7698; 16.9249 84.505; 86.765; 71.597 | 1452.19 | Tomsett, Michael; Maffucci, Irene; Le Bailly, Bryden A. F.; Byrne, Liam; Bijvoets, Stefan M.; Lizio, M. Giovanna; Raftery, James; Butts, Craig P.; Webb, Simon J.; Contini, Alessandro; Clayden, Jonathan A tendril perversion in a helical oligomer: trapping and characterizing a mobile screw-sense reversal. Chemical science, 2017, 8, 3007-3018 |
1545163 | CIF | C55 H93 N11 O11 | P 1 21 1 | 13.6336; 14.6369; 33.2755 90; 89.215; 90 | 6639.6 | Tomsett, Michael; Maffucci, Irene; Le Bailly, Bryden A. F.; Byrne, Liam; Bijvoets, Stefan M.; Lizio, M. Giovanna; Raftery, James; Butts, Craig P.; Webb, Simon J.; Contini, Alessandro; Clayden, Jonathan A tendril perversion in a helical oligomer: trapping and characterizing a mobile screw-sense reversal. Chemical science, 2017, 8, 3007-3018 |
1545164 | CIF | C19 H20 O5 | C 1 2 1 | 18.9838; 9.0762; 9.3006 90; 97.114; 90 | 1590.16 | Li, Tian-Ze; Geng, Chang-An; Yin, Xiu-Juan; Yang, Tong-Hua; Chen, Xing-Long; Huang, Xiao-Yan; Ma, Yun-Bao; Zhang, Xue-Mei; Chen, Ji-Jun Catalytic Asymmetric Total Synthesis of (+)- and (−)-Paeoveitol via a Hetero-Diels‒Alder Reaction Organic Letters, 2017 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!