Crystallography Open Database
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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 141
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4128777 | CIF | C23 H24 F3 N2 O3 P S | P 21 21 21 | 7.2319; 16.6606; 19.395 90; 90; 90 | 2336.9 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
4128778 | CIF | C27 H24 F3 N2 O3 P S | P 21 21 21 | 8.7349; 15.7636; 19.3258 90; 90; 90 | 2661 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
4128779 | CIF | C20 H17 F2 N O2 S | P 21 21 21 | 6.4655; 11.5138; 23.247 90; 90; 90 | 1730.6 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
4128780 | CIF | C23 H20 F3 N2 O3 P S3 | P 21 21 21 | 7.8209; 14.103; 22.253 90; 90; 90 | 2454.5 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
4128781 | CIF | C189 H268 Pb4 | P 1 21/n 1 | 18.3288; 23.6315; 20.2841 90; 104.271; 90 | 8514.7 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128782 | CIF | C84 H122 Br2 Pb2 | P 1 21/n 1 | 14.946; 19.052; 28.498 90; 98.929; 90 | 8016 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128783 | CIF | C60 H74 Pb2 | P -1 | 9.1688; 12.7083; 13.0164 64.295; 81.679; 69.572 | 1280.6 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128784 | CIF | C70 H100 O Pb2 Si2 | P 1 21/c 1 | 11.4812; 25.639; 12.8116 90; 114.588; 90 | 3429.3 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128785 | CIF | C66 H90 Br2 Pb2 Si2 | P -1 | 11.3682; 12.7595; 12.9493 94.563; 103.15; 114.102 | 1637.9 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128786 | CIF | C84 H122 Pb2 | C 1 2/c 1 | 20.3372; 18.4518; 38.674 90; 90.3948; 90 | 14512 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128787 | CIF | C84 H122 Br2 Pb2 | C 1 2/c 1 | 14.6489; 26.975; 22.733 90; 105.484; 90 | 8657 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
4128788 | CIF | C44 H96 Cr Li2 O13 Si4 | P 21 21 21 | 13.826; 20.1133; 20.2739 90; 90; 90 | 5637.9 | Wind, Marie-Louise; Hoof, Santina; Braun-Cula, Beatrice; Herwig, Christian; Limberg, Christian Switching from a Chromium(IV) Peroxide to a Chromium(III) Superoxide upon Coordination of a Donor in the trans Position. Journal of the American Chemical Society, 2019, 141, 14068-14072 |
4128789 | CIF | C20 H48 Cl3 Cr Li5 O9 Si4 | P 1 21/n 1 | 11.1725; 17.4237; 18.9652 90; 90.838; 90 | 3691.5 | Wind, Marie-Louise; Hoof, Santina; Braun-Cula, Beatrice; Herwig, Christian; Limberg, Christian Switching from a Chromium(IV) Peroxide to a Chromium(III) Superoxide upon Coordination of a Donor in the trans Position. Journal of the American Chemical Society, 2019, 141, 14068-14072 |
4128790 | CIF | C40 H88 Cr Li2 O10 Si4 | P b c a | 17.014; 16.181; 18.608 90; 90; 90 | 5122.8 | Wind, Marie-Louise; Hoof, Santina; Braun-Cula, Beatrice; Herwig, Christian; Limberg, Christian Switching from a Chromium(IV) Peroxide to a Chromium(III) Superoxide upon Coordination of a Donor in the trans Position. Journal of the American Chemical Society, 2019, 141, 14068-14072 |
4128791 | CIF | C21 H33 N3 O4.25 S Si | P 1 21 1 | 13.949; 9.712; 19.552 90; 110.621; 90 | 2479.1 | Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives. Journal of the American Chemical Society, 2019, 141, 14411-14420 |
4128792 | CIF | C34 H48 N4 O5 S Si | P 1 21 1 | 7.9317; 15.4939; 13.8939 90; 92.123; 90 | 1706.3 | Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives. Journal of the American Chemical Society, 2019, 141, 14411-14420 |
4128793 | CIF | C37 H48 N4 O4 S Si | P 21 21 21 | 7.8618; 17.7249; 27.6554 90; 90; 90 | 3853.77 | Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives. Journal of the American Chemical Society, 2019, 141, 14411-14420 |
4128794 | CIF | C39 H45 N3 O8 | P 21 21 21 | 8.1852; 30.4869; 31.5036 90; 90; 90 | 7861.5 | Boon, Byron A.; Boger, Dale L. Triarylaminium Radical Cation Promoted Coupling of Catharanthine with Vindoline: Diastereospecific Synthesis of Anhydrovinblastine and Reaction Scope. Journal of the American Chemical Society, 2019, 141, 14349-14355 |
4128795 | CIF | C39 H47 N3 O9 | P 1 21 1 | 10.6544; 15.3909; 10.7835 90; 96.457; 90 | 1757.07 | Boon, Byron A.; Boger, Dale L. Triarylaminium Radical Cation Promoted Coupling of Catharanthine with Vindoline: Diastereospecific Synthesis of Anhydrovinblastine and Reaction Scope. Journal of the American Chemical Society, 2019, 141, 14349-14355 |
4128796 | CIF | C19 H28 O3 | P -1 | 6.678; 9.4722; 13.577 72.958; 83.61; 77.293 | 799.99 | Boyko, Yaroslav D.; Huck, Christopher J.; Sarlah, David Total Synthesis of Isomalabaricane Triterpenoids. Journal of the American Chemical Society, 2019, 141, 14131-14135 |
4128797 | CIF | C31 H54 O3 Si | P 1 21/n 1 | 7.2188; 10.7692; 39.2149 90; 93.005; 90 | 3044.4 | Boyko, Yaroslav D.; Huck, Christopher J.; Sarlah, David Total Synthesis of Isomalabaricane Triterpenoids. Journal of the American Chemical Society, 2019, 141, 14131-14135 |
4128798 | CIF | Li2.33 P Si0.17 | F m -3 m | 5.93927; 5.93927; 5.93927 90; 90; 90 | 209.507 | Strangmüller, Stefan; Eickhoff, Henrik; Müller, David; Klein, Wilhelm; Raudaschl-Sieber, Gabriele; Kirchhain, Holger; Sedlmeier, Christian; Baran, Volodymyr; Senyshyn, Anatoliy; Deringer, Volker L.; van Wüllen, Leo; Gasteiger, Hubert A.; Fässler, Thomas F Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li<sub>14</sub>SiP<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 14200-14209 |
4128799 | CIF | Li2.33 P Si0.17 | F m -3 m | 5.9253; 5.9253; 5.9253 90; 90; 90 | 208.03 | Strangmüller, Stefan; Eickhoff, Henrik; Müller, David; Klein, Wilhelm; Raudaschl-Sieber, Gabriele; Kirchhain, Holger; Sedlmeier, Christian; Baran, Volodymyr; Senyshyn, Anatoliy; Deringer, Volker L.; van Wüllen, Leo; Gasteiger, Hubert A.; Fässler, Thomas F Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li<sub>14</sub>SiP<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 14200-14209 |
4128800 | CIF | Li2.33 P Si0.17 | F m -3 m | 5.91566; 5.91566; 5.91566 90; 90; 90 | 207.019 | Strangmüller, Stefan; Eickhoff, Henrik; Müller, David; Klein, Wilhelm; Raudaschl-Sieber, Gabriele; Kirchhain, Holger; Sedlmeier, Christian; Baran, Volodymyr; Senyshyn, Anatoliy; Deringer, Volker L.; van Wüllen, Leo; Gasteiger, Hubert A.; Fässler, Thomas F Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li<sub>14</sub>SiP<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 14200-14209 |
4128801 | CIF | C38 H32 Cl2 Fe N8 O12 | P 1 21/n 1 | 16.5756; 15.8984; 17.2953 90; 118.081; 90 | 4021.2 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
4128802 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.8192; 15.8059; 17.0759 90; 117.852; 90 | 4013.6 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
4128803 | CIF | C38 H32 Cl2 Fe N8 O12 | P 1 21/n 1 | 16.3409; 15.5665; 16.8955 90; 117.187; 90 | 3822.9 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
4128804 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.4896; 16.0053; 16.6301 90; 116.615; 90 | 3924 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
4128805 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.5677; 16.0511; 16.6587 90; 116.445; 90 | 3966.5 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
4128806 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.876; 16.172; 17.2329 90; 117.797; 90 | 4160.5 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
4128807 | CIF | C19 H17 N O3 | P 1 | 7.6636; 9.5929; 10.8499 86.249; 76.166; 79.11 | 760.39 | Spielmann, Kim; Xiang, Ming; Schwartz, Leyah A.; Krische, Michael J. Direct Conversion of Primary Alcohols to 1,2-Amino Alcohols: Enantioselective Iridium-Catalyzed Carbonyl Reductive Coupling of Phthalimido-Allene via Hydrogen Auto-Transfer. Journal of the American Chemical Society, 2019, 141, 14136-14141 |
4128808 | CIF | C16 H17 N O3 | P 1 21 1 | 8.3815; 22.425; 8.6781 90; 117.675; 90 | 1444.49 | Spielmann, Kim; Xiang, Ming; Schwartz, Leyah A.; Krische, Michael J. Direct Conversion of Primary Alcohols to 1,2-Amino Alcohols: Enantioselective Iridium-Catalyzed Carbonyl Reductive Coupling of Phthalimido-Allene via Hydrogen Auto-Transfer. Journal of the American Chemical Society, 2019, 141, 14136-14141 |
4128809 | CIF | C58 H55 Ir N2 O7 P2 | P 21 21 21 | 14.339; 17.764; 18.92 90; 90; 90 | 4819.3 | Spielmann, Kim; Xiang, Ming; Schwartz, Leyah A.; Krische, Michael J. Direct Conversion of Primary Alcohols to 1,2-Amino Alcohols: Enantioselective Iridium-Catalyzed Carbonyl Reductive Coupling of Phthalimido-Allene via Hydrogen Auto-Transfer. Journal of the American Chemical Society, 2019, 141, 14136-14141 |
4128810 | CIF | C176 H230 Au24 N Pt S18 | P -1 | 16.136; 17.35; 18.583 106.541; 105.313; 90.983 | 4786.1 | Suyama, Megumi; Takano, Shinjiro; Nakamura, Toshikazu; Tsukuda, Tatsuya Stoichiometric Formation of Open-Shell [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>-</sup> via Spontaneous Electron Proportionation between [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>2-</sup> and [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>0</sup>. Journal of the American Chemical Society, 2019, 141, 14048-14051 |
4128811 | CIF | C158 H178 Au24 Pt S18 | P -1 | 16.134; 17.69; 17.7811 65.139; 64.59; 81.463 | 4156 | Suyama, Megumi; Takano, Shinjiro; Nakamura, Toshikazu; Tsukuda, Tatsuya Stoichiometric Formation of Open-Shell [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>-</sup> via Spontaneous Electron Proportionation between [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>2-</sup> and [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>0</sup>. Journal of the American Chemical Society, 2019, 141, 14048-14051 |
4128812 | CIF | C208 H298 Au24 N2 Pt S18 | C 1 2/c 1 | 22.837; 34.096; 29.287 90; 90.867; 90 | 22802 | Suyama, Megumi; Takano, Shinjiro; Nakamura, Toshikazu; Tsukuda, Tatsuya Stoichiometric Formation of Open-Shell [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>-</sup> via Spontaneous Electron Proportionation between [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>2-</sup> and [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>0</sup>. Journal of the American Chemical Society, 2019, 141, 14048-14051 |
4128813 | CIF | C100 H120 B6 F24 N26 O6 Zn3 | P 21 21 2 | 52.6707; 18.785; 17.85193 90; 90; 90 | 17663 | Zhong, Jiankang; Zhang, Liang; August, David P.; Whitehead, George F. S.; Leigh, David A. Self-Sorting Assembly of Molecular Trefoil Knots of Single Handedness. Journal of the American Chemical Society, 2019, 141, 14249-14256 |
4128814 | CIF | C251 H287 B18 F72 N54 O18 Zn9 | P 21 21 2 | 51.9276; 18.8837; 18.2355 90; 90; 90 | 17881.5 | Zhong, Jiankang; Zhang, Liang; August, David P.; Whitehead, George F. S.; Leigh, David A. Self-Sorting Assembly of Molecular Trefoil Knots of Single Handedness. Journal of the American Chemical Society, 2019, 141, 14249-14256 |
4128815 | CIF | C98 H114 B3 Co3 F12 N22 O12 | C 1 2 1 | 17.4608; 20.0262; 17.657 90; 113.308; 90 | 5670.3 | Zhong, Jiankang; Zhang, Liang; August, David P.; Whitehead, George F. S.; Leigh, David A. Self-Sorting Assembly of Molecular Trefoil Knots of Single Handedness. Journal of the American Chemical Society, 2019, 141, 14249-14256 |
4128816 | CIF | C48 H24 O6 | P -1 | 13.0079; 14.5518; 18.7581 67.779; 76.113; 79.561 | 3174.7 | Martínez-Abadía, Marta; Stoppiello, Craig T.; Strutynski, Karol; Lerma-Berlanga, Belén; Martí-Gastaldo, Carlos; Saeki, Akinori; Melle-Franco, Manuel; Khlobystov, Andrei N.; Mateo-Alonso, Aurelio A Wavy Two-Dimensional Covalent Organic Framework from Core-Twisted Polycyclic Aromatic Hydrocarbons. Journal of the American Chemical Society, 2019, 141, 14403-14410 |
4128817 | CIF | C8 H4 Al O7.61 | I m m a | 16.188; 6.624; 13.52 90; 90; 90 | 1449.7 | Chen, Shoushun; Mukherjee, Soumya; Lucier, Bryan E. G.; Guo, Ying; Wong, Y. T. Angel; Terskikh, Victor V.; Zaworotko, Michael J.; Huang, Yining Cleaving Carboxyls: Understanding Thermally Triggered Hierarchical Pores in the Metal-Organic Framework MIL-121. Journal of the American Chemical Society, 2019, 141, 14257-14271 |
4128818 | CIF | Fe4 N0.42 Se4.48 | I 4/m m m | 3.8605; 3.8605; 15.8008 90; 90; 90 | 235.487 | Sun, Ruijin; Jin, Shifeng; Gu, Lin; Zhang, Qinghua; Huang, Qingzhen; Ying, Tianping; Peng, YiRan; Deng, Jun; Yin, Zhiping; Chen, Xiaolong Intercalating Anions between Terminated Anion Layers: Unusual Ionic S-Se Bonds and Hole-Doping Induced Superconductivity in S<sub>0.24</sub>(NH<sub>3</sub>)<sub>0.26</sub>Fe<sub>2</sub>Se<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 13849-13857 |
4128819 | CIF | Fe4 N0.48 S0.24 Se4 | I 4/m m m | 3.8528; 3.8528; 15.233 90; 90; 90 | 226.12 | Sun, Ruijin; Jin, Shifeng; Gu, Lin; Zhang, Qinghua; Huang, Qingzhen; Ying, Tianping; Peng, YiRan; Deng, Jun; Yin, Zhiping; Chen, Xiaolong Intercalating Anions between Terminated Anion Layers: Unusual Ionic S-Se Bonds and Hole-Doping Induced Superconductivity in S<sub>0.24</sub>(NH<sub>3</sub>)<sub>0.26</sub>Fe<sub>2</sub>Se<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 13849-13857 |
4128820 | CIF | C24 H33 N O4 | P 1 21/n 1 | 17.1722; 6.3329; 21.8632 90; 102.144; 90 | 2324.41 | Shu, Wei; García-Domínguez, Andrés; Quirós, M Teresa; Mondal, Rahul; Cárdenas, Diego J; Nevado, Cristina Ni-Catalyzed Reductive Dicarbofunctionalization of Nonactivated Alkenes: Scope and Mechanistic Insights. Journal of the American Chemical Society, 2019, 141, 13812-13821 |
4128821 | CIF | C35 H49 N O8 | P 1 n 1 | 16.03406; 5.88869; 18.24264 90; 91.1868; 90 | 1722.09 | Shu, Wei; García-Domínguez, Andrés; Quirós, M Teresa; Mondal, Rahul; Cárdenas, Diego J; Nevado, Cristina Ni-Catalyzed Reductive Dicarbofunctionalization of Nonactivated Alkenes: Scope and Mechanistic Insights. Journal of the American Chemical Society, 2019, 141, 13812-13821 |
4128822 | CIF | C77.88 H69.7 B2 Cl N4 | P -1 | 12.0361; 15.2317; 16.9141 94.8002; 102.961; 92.4223 | 3005.3 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128823 | CIF | C66 H55 B2 Cl F4 N4 | P 1 21/c 1 | 19.5364; 16.2465; 18.3739 90; 110.386; 90 | 5466.6 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128824 | CIF | C60 H50 B2 Cl F3 N4 | P -1 | 7.9791; 13.3099; 24.0035 88.605; 82.443; 87.184 | 2523.59 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128825 | CIF | C74 H77 B2 Cl2 N5 | P -1 | 14.2653; 15.3826; 15.3931 96.7682; 99.396; 107.461 | 3128.59 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128826 | CIF | C83.5 H75 B2 Cl N4 | P -1 | 11.6604; 15.3379; 19.2293 72.822; 81.704; 86.546 | 3250.7 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128827 | CIF | C66 H59 B2 Cl F6 N4 O | P 1 21/n 1 | 19.6907; 14.3623; 19.9646 90; 98.5582; 90 | 5583.2 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128828 | CIF | C61 H50 B2 Cl3 F5 N4 | P 1 21/c 1 | 19.0799; 16.0622; 18.6758 90; 110.76; 90 | 5351.9 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128829 | CIF | C60 H51 B2 Cl2 F N4 | P -1 | 7.9297; 13.2859; 23.9485 88.5324; 82.9959; 87.8142 | 2501.84 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128830 | CIF | C60 H53 B2 Cl N4 | P 1 21/n 1 | 11.7205; 28.0408; 15.0652 90; 93.355; 90 | 4942.7 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128831 | CIF | C70.85 H62.7 B2 Cl N4 | P -1 | 12.0725; 15.2456; 15.3727 102.786; 91.599; 93.628 | 2751.1 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128832 | CIF | C61 H50 B2 Cl4 F4 N4 | P 1 21/c 1 | 19.3413; 16.1624; 18.4816 90; 111.136; 90 | 5388.7 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128833 | CIF | C61 H64 B N5 | P -1 | 11.9887; 13.3305; 16.2603 90.7115; 100.257; 101.531 | 2502.4 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128834 | CIF | C54 H47 B2 Cl N4 | P -1 | 13.1184; 13.2082; 25.291 87.7958; 87.8829; 89.479 | 4375.8 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128835 | CIF | C82.5 H71 B2 Cl N4 | P -1 | 12.2016; 15.2052; 17.0465 96.263; 97.224; 92.9468 | 3112 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128836 | CIF | C61 H55 B2 Cl3 N4 | P 1 21/n 1 | 16.2643; 18.3466; 17.5397 90; 99.7639; 90 | 5157.9 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
4128837 | CIF | C42 H28 N2 O2 | P 1 21/n 1 | 6.1503; 12.927; 21.54 90; 90.01; 90 | 1712.5 | Li, Yusen; Chen, Qing; Xu, Tiantian; Xie, Zhen; Liu, Jingjuan; Yu, Xiang; Ma, Shengqian; Qin, Tianshi; Chen, Long De Novo Design and Facile Synthesis of 2D Covalent Organic Frameworks: A Two-in-One Strategy. Journal of the American Chemical Society, 2019, 141, 13822-13828 |
4128838 | CIF | C28 H35 N O4 | P 1 21/n 1 | 12.73; 8.7313; 20.2583 90; 94.11; 90 | 2245.9 | Owens, Kyle R.; McCowen, Shelby V.; Blackford, Katherine A.; Ueno, Sohei; Hirooka, Yasuo; Weber, Manuel; Sarpong, Richmond Total Synthesis of the Diterpenoid Alkaloid Arcutinidine Using a Strategy Inspired by Chemical Network Analysis. Journal of the American Chemical Society, 2019, 141, 13713-13717 |
4128839 | CIF | C22 H19 N5 O | P 1 21/n 1 | 19.4305; 11.3245; 9.1511 90; 95.302; 90 | 2005 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128840 | CIF | C22 H19 N5 O | P -1 | 8.2116; 11.5104; 11.8746 102.001; 105.368; 102.349 | 1014.6 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128841 | CIF | C22 H19 N5 O | P -1 | 7.7119; 8.9111; 14.617 81.906; 78.799; 75.258 | 948.5 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128842 | CIF | C22 H19 N5 O | P 1 21/n 1 | 18.9981; 9.8532; 21.8829 90; 113.219; 90 | 3764.5 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128843 | CIF | C22 H19 N5 O | P 1 21/c 1 | 8.2599; 19.6072; 12.6913 90; 116.545; 90 | 1838.73 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128844 | CIF | C22 H19 N5 O | P 1 21/n 1 | 10.727; 14.4711; 12.705 90; 107.112; 90 | 1884.91 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128845 | CIF | C22 H19 N5 O | P -1 | 8.134; 12.62; 18.059 86.707; 100.094; 83.303 | 1806.9 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128846 | CIF | C22 H19 N5 O | P -1 | 8.5537; 11.3718; 11.5674 65.784; 105.495; 77.315 | 916.89 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128847 | CIF | C22 H19 N5 O | P 1 21/c 1 | 11.3011; 20.8473; 8.10637 90; 98.879; 90 | 1886.95 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128848 | CIF | C22 H19 N5 O | C 1 2/c 1 | 27.938; 8.0817; 22.004 90; 133.55; 90 | 3601 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128849 | CIF | C22 H19 N5 O | C 1 2/c 1 | 27.654; 8.108; 21.934 90; 133.41; 90 | 3573 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128850 | CIF | C23 H23 N5 O2 | P 1 21/n 1 | 8.0458; 22.6024; 11.2097 90; 106.274; 90 | 1956.85 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128851 | CIF | C24 H25 N5 O2 | P -1 | 8.082; 9.258; 15.525 73.338; 89.974; 84.594 | 1107.48 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128852 | CIF | C22 H21 N5 O2 | P 1 21/n 1 | 9.0505; 11.3624; 19.1323 90; 94.954; 90 | 1960.1 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128853 | CIF | C25 H27 N5 O2 | P -1 | 7.772; 11.8319; 12.8267 89.03; 74.293; 82.225 | 1124.8 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128854 | CIF | C26 H29 N5 O2 | P -1 | 8.1145; 12.0611; 12.5401 88.454; 79.842; 76.813 | 1176.1 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128855 | CIF | C26 H29 N5 O2 | P 1 | 8.1676; 11.9112; 12.7014 89.4745; 81.236; 75.9211 | 1184.05 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128856 | CIF | C27 H31 N5 O2 | P -1 | 8.0879; 12.3578; 12.8909 85.722; 77.875; 74.707 | 1214.83 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128857 | CIF | C30 H35 N5 O5 | P -1 | 10.6011; 11.6654; 12.5667 69.035; 86.603; 81.573 | 1435.49 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128858 | CIF | C24 H25 N5 O3 | P -1 | 7.7332; 11.4956; 12.1986 85.299; 84.505; 85.518 | 1073.11 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128859 | CIF | C26 H28 N6 O2 | P -1 | 8.6946; 10.964; 12.9344 77.737; 88.5612; 79.1558 | 1183.21 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128860 | CIF | C26 H27 N5 O2 | P -1 | 8.3929; 11.7452; 12.0347 92.483; 106.415; 97.071 | 1125.52 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128861 | CIF | C23 H21 Cl2 N5 O | P -1 | 8.4961; 10.3766; 12.7043 103.239; 91.904; 94.505 | 1085.37 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128862 | CIF | C26 H27 N5 O2 | P -1 | 9.8533; 11.2079; 11.5743 101.869; 105.813; 105.56 | 1129.91 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128863 | CIF | C26 H29 N5 O2 | P -1 | 8.184; 12.0219; 12.6533 89.543; 81.238; 75.349 | 1189.8 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128864 | CIF | C24 H25 N5 O2 | P -1 | 8.11; 11.6569; 12.7599 90.026; 99.248; 101.238 | 1167.15 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128865 | CIF | C24 H23 N5 O3 | P -1 | 9.5331; 10.9792; 11.6291 66.668; 65.944; 78.915 | 1019.9 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128866 | CIF | C25 H27 N5 O2 | P -1 | 8.048; 11.4825; 12.8727 89.28; 80.416; 79.313 | 1152.4 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128867 | CIF | C27 H28 N5 O2 | P -1 | 8.5823; 11.0257; 12.7778 101.925; 92.429; 97.579 | 1169.7 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128868 | CIF | C26 H27 N5 O2 | P 1 21/c 1 | 12.1495; 8.4511; 20.111 90; 93.551; 90 | 2061 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128869 | CIF | C27 H28 N6 O2 | P 1 21/c 1 | 9.966; 33.73; 7.3404 90; 106.892; 90 | 2361 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
4128870 | CIF | C25 H35 N O3 | P 21 21 21 | 7.2979; 12.0524; 23.9963 90; 90; 90 | 2110.65 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
4128871 | CIF | C25 H35 N O3 | P 21 21 21 | 11.5553; 21.4201; 26.2735 90; 90; 90 | 6503.1 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
4128872 | CIF | C19 H28 O4 | P 21 21 21 | 7.1018; 13.3284; 17.4801 90; 90; 90 | 1654.59 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
4128873 | CIF | C24 H33 N O3 | P 21 21 21 | 7.3364; 11.6884; 23.7649 90; 90; 90 | 2037.86 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
4128874 | CIF | C18 H22 O4 | P 21 21 21 | 7.644; 13.4193; 14.4712 90; 90; 90 | 1484.41 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
4128875 | CIF | C20 H28 N O2.5 | C 2 2 21 | 12.1921; 15.8104; 17.6415 90; 90; 90 | 3400.61 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
4128876 | CIF | C23.25 H20.5 F2 N2 O5 | P 1 21/c 1 | 12.9425; 8.5046; 19.818 90; 96.031; 90 | 2169.3 | Wang, Xin-Gang; Li, Yuke; Liu, Hong-Chao; Zhang, Bo-Sheng; Gou, Xue-Ya; Wang, Qiang; Ma, Jun-Wei; Liang, Yong-Min Three-Component Ruthenium-Catalyzed Direct <i>Meta-</i>Selective C-H Activation of Arenes: A New Approach to the Alkylarylation of Alkenes. Journal of the American Chemical Society, 2019, 141, 13914-13922 |
4128877 | CIF | C19 H38 N3 Sc | P n a 21 | 21.47; 12.655; 7.559 90; 90; 90 | 2053.8 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
4128878 | CIF | C19 H55 Al4 Sc3 | P 1 21/n 1 | 9.9815; 40.493; 15.7504 90; 91.391; 90 | 6364.1 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
4128879 | CIF | C24 H42 Al Sc | P -1 | 11.21; 14.35; 14.56 84.12; 89.11; 88.79 | 2329 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
4128880 | CIF | C18 H39 Al2 Sc | P 21 21 21 | 14.335; 16.914; 54.801 90; 90; 90 | 13287 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
4128881 | CIF | C15 H45 Al4 Sc | P 1 21/n 1 | 7.3336; 19.8137; 17.4587 90; 95.903; 90 | 2523.4 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
4128882 | CIF | C18 H20 O2 | P 21 21 21 | 7.43535; 12.70493; 15.2334 90; 90; 90 | 1439.03 | Ma, Dengke; Miao, Chun-Bao; Sun, Jianwei Catalytic Enantioselective House-Meinwald Rearrangement: Efficient Construction of All-Carbon Quaternary Stereocenters. Journal of the American Chemical Society, 2019, 141, 13783-13787 |
4128883 | CIF | C19 H17 F3 O2 | P 21 21 21 | 9.81945; 10.42071; 15.41623 90; 90; 90 | 1577.48 | Ma, Dengke; Miao, Chun-Bao; Sun, Jianwei Catalytic Enantioselective House-Meinwald Rearrangement: Efficient Construction of All-Carbon Quaternary Stereocenters. Journal of the American Chemical Society, 2019, 141, 13783-13787 |
4128884 | CIF | C312 H160 N20 O60 Zn21 | P m -3 m | 43.4917; 43.4917; 43.4917 90; 90; 90 | 82266 | Qiu, Yu-Chen; Yuan, Shuai; Li, Xiao-Xin; Du, Dong-Ying; Wang, Cong; Qin, Jun-Sheng; Drake, Hannah F.; Lan, Ya-Qian; Jiang, Lei; Zhou, Hong-Cai Face-Sharing Archimedean Solids Stacking for the Construction of Mixed-Ligand Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 13841-13848 |
4128885 | CIF | C128 H80 N4 O32 Zr6 | P m -3 m | 27.4034; 27.4034; 27.4034 90; 90; 90 | 20578.5 | Qiu, Yu-Chen; Yuan, Shuai; Li, Xiao-Xin; Du, Dong-Ying; Wang, Cong; Qin, Jun-Sheng; Drake, Hannah F.; Lan, Ya-Qian; Jiang, Lei; Zhou, Hong-Cai Face-Sharing Archimedean Solids Stacking for the Construction of Mixed-Ligand Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 13841-13848 |
4128886 | CIF | C27 H32 F N S | C 2 2 21 | 9.9111; 19.1719; 24.772 90; 90; 90 | 4707.04 | Roth, Aaron; Denmark, Scott E. Enantioselective, Lewis Base-Catalyzed, Intermolecular Sulfenoamination of Alkenes. Journal of the American Chemical Society, 2019, 141, 13767-13771 |
4128887 | CIF | C30 H102 Ba Cu6 N6 O56 S3 | P 63 | 17.9066; 17.9066; 13.218 90; 90; 120 | 3670.48 | Mon, Marta; Bruno, Rosaria; Tiburcio, Estefania; Viciano-Chumillas, Marta; Kalinke, Lucas H. G.; Ferrando-Soria, Jesús; Armentano, Donatella; Pardo, Emilio Multivariate Metal-Organic Frameworks for the Simultaneous Capture of Organic and Inorganic Contaminants from Water. Journal of the American Chemical Society, 2019, 141, 13601-13609 |
4128888 | CIF | C42 H70 Ca Cl3 Cu6 Hg N7 O30 S4 | P 63 | 17.969; 17.969; 12.949 90; 90; 120 | 3620.9 | Mon, Marta; Bruno, Rosaria; Tiburcio, Estefania; Viciano-Chumillas, Marta; Kalinke, Lucas H. G.; Ferrando-Soria, Jesús; Armentano, Donatella; Pardo, Emilio Multivariate Metal-Organic Frameworks for the Simultaneous Capture of Organic and Inorganic Contaminants from Water. Journal of the American Chemical Society, 2019, 141, 13601-13609 |
4128889 | CIF | C30 H100 Ca Cu6 N6 O55 S3 | P 63 | 17.7932; 17.7932; 12.7581 90; 90; 120 | 3498 | Mon, Marta; Bruno, Rosaria; Tiburcio, Estefania; Viciano-Chumillas, Marta; Kalinke, Lucas H. G.; Ferrando-Soria, Jesús; Armentano, Donatella; Pardo, Emilio Multivariate Metal-Organic Frameworks for the Simultaneous Capture of Organic and Inorganic Contaminants from Water. Journal of the American Chemical Society, 2019, 141, 13601-13609 |
4128890 | CIF | C15 H20 N4 O3 | P 1 21 1 | 10.1878; 7.9625; 19.59 90; 99.557; 90 | 1567.1 | Glachet, Thomas; Marzag, Hamid; Saraiva Rosa, Nathalie; Colell, Johannes F. P.; Zhang, Guannan; Warren, Warren S.; Franck, Xavier; Theis, Thomas; Reboul, Vincent Iodonitrene in Action: Direct Transformation of Amino Acids into Terminal Diazirines and <sup>15</sup>N<sub>2</sub>-Diazirines and Their Application as Hyperpolarized Markers. Journal of the American Chemical Society, 2019, 141, 13689-13696 |
4128891 | CIF | C125.82 H130.19 B Cl2.45 Fe4 N3 O1.27 P3 S4 | P 1 21/c 1 | 22.6783; 19.0664; 27.5418 90; 106.247; 90 | 11433.3 | Ye, Mengshan; Thompson, Niklas B.; Brown, Alexandra C.; Suess, Daniel L. M. A Synthetic Model of Enzymatic [Fe<sub>4</sub>S<sub>4</sub>]-Alkyl Intermediates. Journal of the American Chemical Society, 2019, 141, 13330-13335 |
4128892 | CIF | C130 H141 B Fe4 N3 O2 P3 S4 | P 1 21/n 1 | 16.597; 30.822; 22.933 90; 95.023; 90 | 11686 | Ye, Mengshan; Thompson, Niklas B.; Brown, Alexandra C.; Suess, Daniel L. M. A Synthetic Model of Enzymatic [Fe<sub>4</sub>S<sub>4</sub>]-Alkyl Intermediates. Journal of the American Chemical Society, 2019, 141, 13330-13335 |
4128893 | CIF | C80 H183 Mo2 N5 O60 Te W16 | R -3 :H | 44.713; 44.713; 47.217 90; 90; 120 | 81752 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128894 | CIF | C22 H119 Mo3 N11 Na O96 Se2 W21 | P n m a | 20.577; 21.446; 25.391 90; 90; 90 | 11205 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128895 | CIF | C20 H113 Mo3 N10 Na2 O96 P2 W21 | P n m a | 35.244; 21.9528; 15.0516 90; 90; 90 | 11645.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128896 | CIF | C22 H120 Mo3 N11 Na O96 P Te W21 | P n m a | 35.22; 22.1684; 15.0386 90; 90; 90 | 11741.7 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128897 | CIF | C14 H79 Mo2 N7 O70 Te W16 | R -3 m :H | 21.1678; 21.1678; 15.6954 90; 90; 120 | 6090.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128898 | CIF | C14 H79 Mo2 N7 O70 Se W16 | R -3 m :H | 21.169; 21.169; 15.8379 90; 90; 120 | 6146.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128899 | CIF | C20 H112 Mo2 N10 Na O96 P Se W22 | P a -3 | 22.557; 22.557; 22.557 90; 90; 90 | 11477.4 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128900 | CIF | C14 H90 Mo2 N7 O75 P W16 | R -3 m :H | 21.5987; 21.5987; 13.9195 90; 90; 120 | 5623.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128901 | CIF | C32 H161 Mo4 N16 O117 P3 W26 | C m c e | 21.7592; 26.906; 25.728 90; 90; 90 | 15063 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128902 | CIF | C60 H291 Mo4 N30 Na O251 Se7 W62 | P -1 | 17.7735; 20.1721; 22.3319 99.133; 102.654; 96.166 | 7628.6 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
4128903 | CIF | C33 H40 B F4 Fe O4 P | P -1 | 9.9636; 12.7003; 13.9821 80.831; 69.746; 70.594 | 1563.6 | Geeson, Michael B.; Transue, Wesley J.; Cummins, Christopher C. Organoiron- and Fluoride-Catalyzed Phosphinidene Transfer to Styrenic Olefins in a Stereoselective Synthesis of Unprotected Phosphiranes. Journal of the American Chemical Society, 2019, 141, 13336-13340 |
4128904 | CIF | C19 H22 B F4 Fe O2 P | P b c a | 13.826; 16.6549; 17.2897 90; 90; 90 | 3981.3 | Geeson, Michael B.; Transue, Wesley J.; Cummins, Christopher C. Organoiron- and Fluoride-Catalyzed Phosphinidene Transfer to Styrenic Olefins in a Stereoselective Synthesis of Unprotected Phosphiranes. Journal of the American Chemical Society, 2019, 141, 13336-13340 |
4128905 | CIF | C18 H21 N O6 | P 21 21 21 | 8.605; 19.697; 30.793 90; 90; 90 | 5219 | Zheng, Jian; Swords, Wesley B.; Jung, Hoimin; Skubi, Kazimer L.; Kidd, Jesse B.; Meyer, Gerald J.; Baik, Mu-Hyun; Yoon, Tehshik P. Enantioselective Intermolecular Excited-State Photoreactions Using a Chiral Ir Triplet Sensitizer: Separating Association from Energy Transfer in Asymmetric Photocatalysis. Journal of the American Chemical Society, 2019, 141, 13625-13634 |
4128906 | CIF | C16 H15 I N2 O4 | P 1 21 1 | 9.094; 7.248; 11.749 90; 96.62; 90 | 769.3 | Zheng, Jian; Swords, Wesley B.; Jung, Hoimin; Skubi, Kazimer L.; Kidd, Jesse B.; Meyer, Gerald J.; Baik, Mu-Hyun; Yoon, Tehshik P. Enantioselective Intermolecular Excited-State Photoreactions Using a Chiral Ir Triplet Sensitizer: Separating Association from Energy Transfer in Asymmetric Photocatalysis. Journal of the American Chemical Society, 2019, 141, 13625-13634 |
4128907 | CIF | C32 H16 N8 O16 Zr3 | P n n m | 30.977; 20.52; 22.213 90; 90; 90 | 14120 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
4128908 | CIF | C64 Cl22 N16 Ni14 O47 Zr6 | P n n m | 31.4535; 19.638; 21.9912 90; 90; 90 | 13583.6 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
4128909 | CIF | C32 H16 Br5 N8 Ni3 O26 Zr3 | P n n m | 31.698; 18.59; 22.055 90; 90; 90 | 12996 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
4128910 | CIF | C32 H16 N8 O16 Zr3 | P n n m | 31.368; 19.703; 22.4548 90; 90; 90 | 13878 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
4128911 | CIF | C87 H88 O11 | P 1 21/n 1 | 13.5456; 35.6442; 15.5089 90; 107.09; 90 | 7157.4 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
4128912 | CIF | C85 H80 O10 | P 1 21/n 1 | 13.7735; 34.9942; 15.597 90; 107.447; 90 | 7171.79 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
4128913 | CIF | C87 H86 O10 | P 1 21/n 1 | 13.9839; 35.7918; 15.4191 90; 108.881; 90 | 7302.1 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
4128914 | CIF | C81 H62 O10 | P b c a | 12.7437; 31.7874; 32.5089 90; 90; 90 | 13169 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
4128915 | CIF | C40 H76 O5 S Si3 | P 1 21 1 | 9.5103; 34.984; 21.4829 90; 101.519; 90 | 7003.6 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
4128916 | CIF | C14 H16 O4 S | P 1 21/n 1 | 7.048; 10.4797; 18.4167 90; 97.094; 90 | 1349.86 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
4128917 | CIF | C12 H18 O S | P 21 21 21 | 5.843; 10.9977; 17.5865 90; 90; 90 | 1130.1 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
4128918 | CIF | C16 H15 N O4 S | P -1 | 7.6475; 8.1332; 13.0597 105.357; 102.201; 97.465 | 750.56 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
4128919 | CIF | C23 H21 N O3 | P 21 21 21 | 8.6617; 9.6496; 22.5991 90; 90; 90 | 1888.88 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
4128920 | CIF | C5 H6 O3 | P 1 21/c 1 | 6.1911; 7.129; 12.2554 90; 104.026; 90 | 524.78 | McGuire, Thomas M.; Pérale, Cécile; Castaing, Rémi; Kociok-Köhn, Gabriele; Buchard, Antoine Divergent Catalytic Strategies for the <i>Cis</i>/<i>Trans</i> Stereoselective Ring-Opening Polymerization of a Dual Cyclic Carbonate/Olefin Monomer. Journal of the American Chemical Society, 2019, 141, 13301-13305 |
4128921 | CIF | C26 H32 Fe O6 | P 1 21 1 | 8.169; 23.029; 12.208 90; 91.379; 90 | 2296 | Burns, Alexander S.; Rychnovsky, Scott D. Total Synthesis and Structure Revision of (-)-Illisimonin A, a Neuroprotective Sesquiterpenoid from the Fruits of <i>Illicium simonsii</i>. Journal of the American Chemical Society, 2019, 141, 13295-13300 |
4128922 | CIF | Co4 K3.5 Li1.5 Na O126.5 P5 W30 | I m m a | 52.0499; 21.5528; 26.1891 90; 90; 90 | 29379.5 | Turo, Michael J.; Chen, Linfeng; Moore, Curtis E.; Schimpf, Alina M. Co<sup>2+</sup>-Linked [NaP<sub>5</sub>W<sub>30</sub>O<sub>110</sub>]<sup>14-</sup>: A Redox-Active Metal Oxide Framework with High Electron Density. Journal of the American Chemical Society, 2019, 141, 4553-4557 |
4128923 | CIF | Co4 K3.5 Li1.5 Na O126.5 P5 W30 | I m m a | 52.037; 21.5548; 26.1839 90; 90; 90 | 29369.1 | Turo, Michael J.; Chen, Linfeng; Moore, Curtis E.; Schimpf, Alina M. Co<sup>2+</sup>-Linked [NaP<sub>5</sub>W<sub>30</sub>O<sub>110</sub>]<sup>14-</sup>: A Redox-Active Metal Oxide Framework with High Electron Density. Journal of the American Chemical Society, 2019, 141, 4553-4557 |
4128924 | CIF | C35 H35 F12 N11 O0.25 P2 | P 1 21/m 1 | 8.5334; 16.264; 14.678 90; 100.31; 90 | 2004.2 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
4128925 | CIF | C35 H37 F12 N9 O2 P2 | P -1 | 8.8999; 11.193; 20.76 99.53; 90.06; 105.42 | 1963.9 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
4128926 | CIF | C37 H43 N9 O10 | P b c a | 11.481; 22.243; 29.998 90; 90; 90 | 7661 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
4128927 | CIF | C31 H48 N9 O15.5 P2 | P -1 | 12.547; 18.324; 18.364 114.49; 103.77; 91.72 | 3692.1 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
4128928 | CIF | C34 H35.5 N10.5 O8 S2 | P -1 | 8.2235; 13.8316; 16.8675 99.887; 90.596; 102.897 | 1840 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
4128929 | CIF | C31 H39 N9 O11 P2 | P 1 21/c 1 | 18.1882; 20.6048; 9.6072 90; 104.356; 90 | 3488 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
4128930 | CIF | C68 H87 Au2 F6 N5 O5 S3 | P -1 | 15.082; 17.405; 17.968 66.38; 80.662; 80.269 | 4235.9 | Mulks, Florian F.; Antoni, Patrick W.; Gross, Jürgen H; Graf, Jürgen; Rominger, Frank; Hashmi, A Stephen K 1,1-Digoldallylium Complexes: Diaurated Allylic Carbocations Indicate New Prospects of the Coordination Chemistry of Carbon. Journal of the American Chemical Society, 2019, 141, 4687-4695 |
4128931 | CIF | C20 H31 Co | P 1 21/n 1 | 8.07; 8.4605; 12.8684 90; 93.611; 90 | 876.86 | Chalkley, Matthew J.; Oyala, Paul H.; Peters, Jonas C. Cp* Noninnocence Leads to a Remarkably Weak C-H Bond via Metallocene Protonation. Journal of the American Chemical Society, 2019, 141, 4721-4729 |
4128932 | CIF | C21 H33 Co | P 1 21/c 1 | 12.8973; 9.6767; 15.1146 90; 92.956; 90 | 1883.84 | Chalkley, Matthew J.; Oyala, Paul H.; Peters, Jonas C. Cp* Noninnocence Leads to a Remarkably Weak C-H Bond via Metallocene Protonation. Journal of the American Chemical Society, 2019, 141, 4721-4729 |
4128933 | CIF | C33 H42 N2 O2 Si | P 1 21 1 | 25.919; 9.9765; 26.3509 90; 112.699; 90 | 6286.1 | Han, Ye-Qiang; Ding, Yi; Zhou, Tao; Yan, Sheng-Yi; Song, Hong; Shi, Bing-Feng Pd(II)-Catalyzed Enantioselective Alkynylation of Unbiased Methylene C(sp<sup>3</sup>)-H Bonds Using 3,3'-Fluorinated-BINOL as a Chiral Ligand. Journal of the American Chemical Society, 2019, 141, 4558-4563 |
4128934 | CIF | C123 H170 N21 O27 Zn4 | P -1 | 16.1706; 19.1783; 22.1386 89.034; 72.865; 80.624 | 6469.8 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
4128935 | CIF | C103 H127 N14 O19 Zn4 | P 1 2/n 1 | 21.5925; 12.2482; 41.9139 90; 96.438; 90 | 11015 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
4128936 | CIF | C246 H328 Co2 N38 O52 Zn8 | P 1 21/n 1 | 16.7237; 21.2669; 39.8228 90; 92.307; 90 | 14151.9 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
4128937 | CIF | C240 H334 N34 O44 Zn8 | P -1 | 15.7704; 19.0494; 22.544 67.594; 84.711; 76.268 | 6082.3 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
4128938 | CIF | C16 H22 Br4 N4 O4 Pb | P 1 21/c 1 | 21.2912; 19.4228; 11.7888 90; 97.29; 90 | 4835.7 | Tremblay, Marie-Hélène; Thouin, Félix; Leisen, Johannes; Bacsa, John; Srimath Kandada, Ajay Ram; Hoffman, Justin M.; Kanatzidis, Mercouri G.; Mohite, Aditya D.; Silva, Carlos; Barlow, Stephen; Marder, Seth R. (4NPEA)<sub>2</sub>PbI<sub>4</sub> (4NPEA = 4-Nitrophenylethylammonium): Structural, NMR, and Optical Properties of a 3 ×3 Corrugated 2D Hybrid Perovskite. Journal of the American Chemical Society, 2019, 141, 4521-4525 |
4128939 | CIF | C16 H22 I4 N4 O4 Pb | P 1 21/c 1 | 21.0976; 19.8255; 12.6149 90; 98.2252; 90 | 5222.16 | Tremblay, Marie-Hélène; Thouin, Félix; Leisen, Johannes; Bacsa, John; Srimath Kandada, Ajay Ram; Hoffman, Justin M.; Kanatzidis, Mercouri G.; Mohite, Aditya D.; Silva, Carlos; Barlow, Stephen; Marder, Seth R. (4NPEA)<sub>2</sub>PbI<sub>4</sub> (4NPEA = 4-Nitrophenylethylammonium): Structural, NMR, and Optical Properties of a 3 ×3 Corrugated 2D Hybrid Perovskite. Journal of the American Chemical Society, 2019, 141, 4521-4525 |
4128940 | CIF | C11 H14 Cl N O2 | P 1 21 1 | 10.848; 4.7553; 11.5172 90; 111.111; 90 | 554.25 | Gao, Tao-Tao; Zhang, Wen-Wen; Sun, Xin; Lu, Hou-Xiang; Li, Bi-Jie Stereodivergent Synthesis through Catalytic Asymmetric Reversed Hydroboration. Journal of the American Chemical Society, 2019, 141, 4670-4677 |
4128941 | CIF | C24 H19 Br2 N O2 | R -3 c :H | 17.3148; 17.3148; 37.394 90; 90; 120 | 9708.8 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
4128942 | CIF | C12 H8 Br2 | P 1 21/n 1 | 7.8747; 11.6377; 11.6249 90; 107.095; 90 | 1018.28 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
4128943 | CIF | C24 H22 Br N O2 | P -1 | 8.5392; 8.8043; 15.5739 74.124; 89.573; 65.84 | 1020.2 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
4128944 | CIF | C15 H11 Br2 N O2 | P 1 21 1 | 9.102; 6.967; 10.962 90; 91.026; 90 | 695 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
4128945 | CIF | C87 H62 Cl7 Ir N2 O5 P2 | P -1 | 11.7853; 14.6123; 22.8572 98.446; 92.842; 91.763 | 3885.88 | Isomura, Mayuko; Petrone, David A.; Carreira, Erick M. Coordination-Induced Stereocontrol over Carbocations: Asymmetric Reductive Deoxygenation of Racemic Tertiary Alcohols. Journal of the American Chemical Society, 2019, 141, 4738-4748 |
4128946 | CIF | C18 H15 Cl N2 O6 | P 1 | 9.9297; 13.7671; 14.1998 64.113; 87.206; 89.732 | 1744 | Isomura, Mayuko; Petrone, David A.; Carreira, Erick M. Coordination-Induced Stereocontrol over Carbocations: Asymmetric Reductive Deoxygenation of Racemic Tertiary Alcohols. Journal of the American Chemical Society, 2019, 141, 4738-4748 |
4128947 | CIF | C17 H27 N O4 | P 1 21/c 1 | 8.03546; 17.81899; 11.97478 90; 96.1556; 90 | 1704.71 | Isomura, Mayuko; Petrone, David A.; Carreira, Erick M. Coordination-Induced Stereocontrol over Carbocations: Asymmetric Reductive Deoxygenation of Racemic Tertiary Alcohols. Journal of the American Chemical Society, 2019, 141, 4738-4748 |
4128948 | CIF | C66 H50 F24 N16 O4 P4 Ru2 | P 1 21 1 | 12.4658; 16.2947; 21.744 90; 97.257; 90 | 4381.4 | Fairbanks, Simon D.; Robertson, Craig C.; Keene, F. Richard; Thomas, Jim A.; Williamson, Mike P. Structural Investigation into the Threading Intercalation of a Chiral Dinuclear Ruthenium(II) Polypyridyl Complex through a B-DNA Oligonucleotide. Journal of the American Chemical Society, 2019, 141, 4644-4652 |
4128949 | CIF | C64 H44 F24 N14 P4 Ru2 | P 1 21 1 | 12.5327; 16.3645; 21.809 90; 97.129; 90 | 4438.3 | Fairbanks, Simon D.; Robertson, Craig C.; Keene, F. Richard; Thomas, Jim A.; Williamson, Mike P. Structural Investigation into the Threading Intercalation of a Chiral Dinuclear Ruthenium(II) Polypyridyl Complex through a B-DNA Oligonucleotide. Journal of the American Chemical Society, 2019, 141, 4644-4652 |
4128950 | CIF | C64 H44 Cl4 N14 Ru2 | P -1 | 8.3032; 11.378; 18.25 95.542; 92.729; 95.095 | 1706.6 | Fairbanks, Simon D.; Robertson, Craig C.; Keene, F. Richard; Thomas, Jim A.; Williamson, Mike P. Structural Investigation into the Threading Intercalation of a Chiral Dinuclear Ruthenium(II) Polypyridyl Complex through a B-DNA Oligonucleotide. Journal of the American Chemical Society, 2019, 141, 4644-4652 |
4128951 | CIF | C12 H15 I O3 | P 1 21/c 1 | 8.4354; 9.8508; 14.8019 90; 99.955; 90 | 1211.45 | Yang, Ming; Yin, Fangjie; Fujino, Haruka; Snyder, Scott A. The Total Synthesis of Chalcitrin. Journal of the American Chemical Society, 2019, 141, 4515-4520 |
4128952 | CIF | C11 H8 Br I O3 | P 1 21/c 1 | 10.8432; 9.263; 11.9112 90; 108.277; 90 | 1136.01 | Yang, Ming; Yin, Fangjie; Fujino, Haruka; Snyder, Scott A. The Total Synthesis of Chalcitrin. Journal of the American Chemical Society, 2019, 141, 4515-4520 |
4128953 | CIF | C12 H8 Br I O4 | P 1 21/c 1 | 12.0937; 11.9771; 8.4124 90; 91.644; 90 | 1218.01 | Yang, Ming; Yin, Fangjie; Fujino, Haruka; Snyder, Scott A. The Total Synthesis of Chalcitrin. Journal of the American Chemical Society, 2019, 141, 4515-4520 |
4128954 | CIF | C43.5 H44.75 F18 Fe N8.25 O0.75 P2 | P 21 21 21 | 12.8763; 15.3531; 24.2529 90; 90; 90 | 4794.58 | Hong, Yubiao; Jarrige, Lucie; Harms, Klaus; Meggers, Eric Chiral-at-Iron Catalyst: Expanding the Chemical Space for Asymmetric Earth-Abundant Metal Catalysis. Journal of the American Chemical Society, 2019, 141, 4569-4572 |
4128955 | CIF | C108 H110 O4 | C 1 2/c 1 | 19.1455; 17.5082; 24.5014 90; 102.237; 90 | 8026.4 | Ikai, Tomoyuki; Yoshida, Takumu; Shinohara, Ken-Ichi; Taniguchi, Tsuyoshi; Wada, Yuya; Swager, Timothy M. Triptycene-Based Ladder Polymers with One-Handed Helical Geometry. Journal of the American Chemical Society, 2019, 141, 4696-4703 |
4128956 | CIF | C26.5 H26 Cl N5 O2 | P -1 | 10.9283; 13.7142; 17.0369 86.6245; 85.0011; 67.4709 | 2348.64 | Gallagher, Nolan; Zhang, Hui; Junghoefer, Tobias; Giangrisostomi, Erika; Ovsyannikov, Ruslan; Pink, Maren; Rajca, Suchada; Casu, Maria Benedetta; Rajca, Andrzej Thermally and Magnetically Robust Triplet Ground State Diradical. Journal of the American Chemical Society, 2019, 141, 4764-4774 |
4128957 | CIF | C17 H29 Cl2 N3 Ni S2 | P b c n | 14.5632; 12.3263; 23.3463 90; 90; 90 | 4190.9 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
4128958 | CIF | C17 H24 F3 N3 Ni S2 | P 1 21/c 1 | 12.698; 15.104; 10.542 90; 100.076; 90 | 1990.7 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
4128959 | CIF | C22 H32 B F4 Fe N3 Ni O3 S2 | P 1 21/c 1 | 19.8354; 9.975; 13.3013 90; 100.622; 90 | 2586.67 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
4128960 | CIF | C22 H28 B Cl2 F7 Fe N2 Ni O S2 | P 1 21/c 1 | 8.0122; 31.7923; 11.9134 90; 107.146; 90 | 2899.8 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
4128961 | CIF | C21.5 H29 B Cl4 F4 Fe N2 Ni O S2 | P c c n | 11.3768; 22.6888; 24.5582 90; 90; 90 | 6339.1 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
4128962 | CIF | C24 H24 Br2 O2 | P 1 21 1 | 11.3708; 4.6026; 20.5978 90; 94.029; 90 | 1075.33 | Parsutkar, Mahesh M.; Pagar, Vinayak Vishnu; RajanBabu, T. V. Catalytic Enantioselective Synthesis of Cyclobutenes from Alkynes and Alkenyl Derivatives. Journal of the American Chemical Society, 2019, 141, 15367-15377 |
4128963 | CIF | C27 H34 Br2 Co N O P | P 1 21 1 | 11.0641; 22.4546; 11.081 90; 99.705; 90 | 2713.6 | Parsutkar, Mahesh M.; Pagar, Vinayak Vishnu; RajanBabu, T. V. Catalytic Enantioselective Synthesis of Cyclobutenes from Alkynes and Alkenyl Derivatives. Journal of the American Chemical Society, 2019, 141, 15367-15377 |
4128964 | CIF | C19 H15 F6 N4 O2 P Ru | P 21 21 21 | 11.7237; 13.3153; 13.7472 90; 90; 90 | 2146 | Jung, Hoimin; Schrader, Malte; Kim, Dongwook; Baik, Mu-Hyun; Park, Yoonsu; Chang, Sukbok Harnessing Secondary Coordination Sphere Interactions That Enable the Selective Amidation of Benzylic C-H Bonds. Journal of the American Chemical Society, 2019, 141, 15356-15366 |
4128965 | CIF | C69 H90 Ag2 F6 O14 | P -1 | 12.1081; 14.8255; 21.7369 104.402; 94.961; 111.996 | 3433.43 | Hua, Bin; Shao, Li; Zhang, Zhihua; Liu, Jiyong; Huang, Feihe Cooperative Silver Ion-Pair Recognition by Peralkylated Pillar[5]arenes. Journal of the American Chemical Society, 2019, 141, 15008-15012 |
4128966 | CIF | C59 H70 Ag2 F6 O14 | P 1 21/n 1 | 16.5674; 20.0237; 17.998 90; 92.654; 90 | 5964.3 | Hua, Bin; Shao, Li; Zhang, Zhihua; Liu, Jiyong; Huang, Feihe Cooperative Silver Ion-Pair Recognition by Peralkylated Pillar[5]arenes. Journal of the American Chemical Society, 2019, 141, 15008-15012 |
4128967 | CIF | C18 H30 F12 Fe N6 Sb2 | P 1 21/n 1 | 19.573; 8.226; 19.595 90; 117.913; 90 | 2787.9 | Dantignana, Valeria; Serrano-Plana, Joan; Draksharapu, Apparao; Magallón, Carla; Banerjee, Saikat; Fan, Ruixi; Gamba, Ilaria; Guo, Yisong; Que, Jr, Lawrence; Costas, Miquel; Company, Anna Spectroscopic and Reactivity Comparisons between Nonheme Oxoiron(IV) and Oxoiron(V) Species Bearing the Same Ancillary Ligand. Journal of the American Chemical Society, 2019, 141, 15078-15091 |
4128968 | CIF | C28 H30 Cl17 Co N5 | P 1 21/c 1 | 13.6143; 18.8932; 18.3407 90; 109.406; 90 | 4449.5 | Ghosh, Chandrani; Kim, Suyeon; Mena, Matthew R.; Kim, Jun-Hyeong; Pal, Raja; Rock, Christopher L.; Groy, Thomas L.; Baik, Mu-Hyun; Trovitch, Ryan J. Efficient Cobalt Catalyst for Ambient-Temperature Nitrile Dihydroboration, the Elucidation of a Chelate-Assisted Borylation Mechanism, and a New Synthetic Route to Amides. Journal of the American Chemical Society, 2019, 141, 15327-15337 |
4128969 | CIF | C23 H26 Co N5 | P -1 | 8.6432; 11.3302; 11.4891 105.192; 92.884; 107.735 | 1023.8 | Ghosh, Chandrani; Kim, Suyeon; Mena, Matthew R.; Kim, Jun-Hyeong; Pal, Raja; Rock, Christopher L.; Groy, Thomas L.; Baik, Mu-Hyun; Trovitch, Ryan J. Efficient Cobalt Catalyst for Ambient-Temperature Nitrile Dihydroboration, the Elucidation of a Chelate-Assisted Borylation Mechanism, and a New Synthetic Route to Amides. Journal of the American Chemical Society, 2019, 141, 15327-15337 |
4128970 | CIF | C27 H40 Co F4 N P2 | P -1 | 8.2188; 11.2255; 16.4158 84.354; 76.854; 69.023 | 1376.85 | Pabst, Tyler P.; Obligacion, Jennifer V.; Rochette, Étienne; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed Borylation of Fluorinated Arenes: Thermodynamic Control of C(sp<sup>2</sup>)-H Oxidative Addition Results in <i>ortho</i>-to-Fluorine Selectivity. Journal of the American Chemical Society, 2019, 141, 15378-15389 |
4128971 | CIF | C27 H40 Co F4 N P2 | P 1 21/n 1 | 18.7044; 13.913; 23.4016 90; 98.928; 90 | 6016.1 | Pabst, Tyler P.; Obligacion, Jennifer V.; Rochette, Étienne; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed Borylation of Fluorinated Arenes: Thermodynamic Control of C(sp<sup>2</sup>)-H Oxidative Addition Results in <i>ortho</i>-to-Fluorine Selectivity. Journal of the American Chemical Society, 2019, 141, 15378-15389 |
4128972 | CIF | C96 H108 B2 Mn2 N10 O4 S2 | P -1 | 11.5009; 13.9207; 15.136 75.533; 75.25; 69.812 | 2164.2 | Yan Poon, Penny Chaau; Dedushko, Maksym A.; Sun, Xianru; Yang, Guang; Toledo, Santiago; Hayes, Ellen C.; Johansen, Audra; Piquette, Marc C.; Rees, Julian A.; Stoll, Stefan; Rybak-Akimova, Elena; Kovacs, Julie A. How Metal Ion Lewis Acidity and Steric Properties Influence the Barrier to Dioxygen Binding, Peroxo O-O Bond Cleavage, and Reactivity. Journal of the American Chemical Society, 2019, 141, 15046-15057 |
4128973 | CIF | C46 H64 F12 Mn2 N10 O5 P2 S2 | P 1 21/c 1 | 10.1676; 22.3787; 12.3719 90; 96.825; 90 | 2795.1 | Yan Poon, Penny Chaau; Dedushko, Maksym A.; Sun, Xianru; Yang, Guang; Toledo, Santiago; Hayes, Ellen C.; Johansen, Audra; Piquette, Marc C.; Rees, Julian A.; Stoll, Stefan; Rybak-Akimova, Elena; Kovacs, Julie A. How Metal Ion Lewis Acidity and Steric Properties Influence the Barrier to Dioxygen Binding, Peroxo O-O Bond Cleavage, and Reactivity. Journal of the American Chemical Society, 2019, 141, 15046-15057 |
4128974 | CIF | Cu2 I2 Se6 | R -3 m :H | 14.031; 14.031; 14.0046 90; 90; 120 | 2387.69 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128975 | CIF | Cu2 I2 Se6 | R -3 m :H | 13.766; 13.766; 13.2315 90; 90; 120 | 2171.48 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128976 | CIF | Cu2 I2 Se6 | R -3 m :H | 13.4668; 13.4668; 12.6496 90; 90; 120 | 1986.72 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128977 | CIF | Cu2 I2 Se6 | R -3 m :H | 13.3353; 13.3353; 12.4394 90; 90; 120 | 1915.74 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128978 | CIF | Cu2 I2 Se6 | R -3 m :H | 13.2862; 13.2862; 12.3717 90; 90; 120 | 1891.31 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128979 | CIF | Cu2 I2 Se6 | R -3 m :H | 12.9856; 12.9856; 12.4479 90; 90; 120 | 1817.82 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128980 | CIF | Cu2 I2 Se6 | R -3 m :H | 12.8911; 12.8911; 12.33 90; 90; 120 | 1774.49 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128981 | CIF | Cu2 I2 Se6 | R -3 m :H | 12.8125; 12.8125; 12.2065 90; 90; 120 | 1735.36 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128982 | CIF | Cu2 I2 Se6 | R -3 m :H | 13.0793; 13.0793; 11.1844 90; 90; 120 | 1656.96 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128983 | CIF | Cu2 I2 Se6 | R -3 m :H | 13.0111; 13.0111; 11.0956 90; 90; 120 | 1626.71 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128984 | CIF | Cu2 I2 Se6 | R -3 m :H | 12.939; 12.939; 10.9066 90; 90; 120 | 1581.3 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128985 | CIF | Cu2 I2 Se6 | R -3 m :H | 12.8949; 12.8949; 10.7489 90; 90; 120 | 1547.9 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128986 | CIF | Cu2 I2 Se6 | R -3 m :H | 12.7831; 12.7831; 10.596 90; 90; 120 | 1499.5 | Cai, Weizhao; Lin, Wenwen; Li, Long-Hua; Malliakas, Christos D.; Zhang, Rong; Groesbeck, Matthew; Bao, Jin-Ke; Zhang, Dongzhou; Sterer, Eran; Kanatzidis, Mercouri G.; Deemyad, Shanti Pressure-Induced Superconductivity and Flattened Se<sub>6</sub> Rings in the Wide Band Gap Semiconductor Cu<sub>2</sub>I<sub>2</sub>Se<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 15174-15182 |
4128987 | CIF | C21 H22 Br2 N2 Ni O2 | P 21 21 21 | 8.9454; 11.7746; 20.35 90; 90; 90 | 2143.4 | Yin, Haolin; Fu, Gregory C. Mechanistic Investigation of Enantioconvergent Kumada Reactions of Racemic α-Bromoketones Catalyzed by a Nickel/Bis(oxazoline) Complex. Journal of the American Chemical Society, 2019, 141, 15433-15440 |
4128988 | CIF | C21 H22 Br N2 Ni O2 | P 21 21 21 | 9.457; 13.597; 15.622 90; 90; 90 | 2008.8 | Yin, Haolin; Fu, Gregory C. Mechanistic Investigation of Enantioconvergent Kumada Reactions of Racemic α-Bromoketones Catalyzed by a Nickel/Bis(oxazoline) Complex. Journal of the American Chemical Society, 2019, 141, 15433-15440 |
4128989 | CIF | C55 H51 Br N2 Ni O3 | P 21 21 21 | 9.754; 17.1117; 26.83 90; 90; 90 | 4478.1 | Yin, Haolin; Fu, Gregory C. Mechanistic Investigation of Enantioconvergent Kumada Reactions of Racemic α-Bromoketones Catalyzed by a Nickel/Bis(oxazoline) Complex. Journal of the American Chemical Society, 2019, 141, 15433-15440 |
4128990 | CIF | C38 H55 Fe P3 Si | P 1 21/n 1 | 13.2918; 16.122; 17.053 90; 93.901; 90 | 3645.8 | Citek, Cooper; Oyala, Paul H.; Peters, Jonas C. Mononuclear Fe(I) and Fe(II) Acetylene Adducts and Their Reductive Protonation to Terminal Fe(IV) and Fe(V) Carbynes. Journal of the American Chemical Society, 2019, 141, 15211-15221 |
4128991 | CIF | C70 H68 B F24 Fe P3 Si | P 1 21/n 1 | 12.847; 38.23; 14.423 90; 92.285; 90 | 7078 | Citek, Cooper; Oyala, Paul H.; Peters, Jonas C. Mononuclear Fe(I) and Fe(II) Acetylene Adducts and Their Reductive Protonation to Terminal Fe(IV) and Fe(V) Carbynes. Journal of the American Chemical Society, 2019, 141, 15211-15221 |
4128992 | CIF | C37.83 H56.75 Cl0.08 Fe P3 Si | P 1 21/n 1 | 13.2971; 16.145; 17.0059 90; 92.999; 90 | 3645.9 | Citek, Cooper; Oyala, Paul H.; Peters, Jonas C. Mononuclear Fe(I) and Fe(II) Acetylene Adducts and Their Reductive Protonation to Terminal Fe(IV) and Fe(V) Carbynes. Journal of the American Chemical Society, 2019, 141, 15211-15221 |
4128993 | CIF | C39 H57 F3 Fe O3 P3 S Si | P 21 21 21 | 13.173; 15.284; 20.312 90; 90; 90 | 4090 | Citek, Cooper; Oyala, Paul H.; Peters, Jonas C. Mononuclear Fe(I) and Fe(II) Acetylene Adducts and Their Reductive Protonation to Terminal Fe(IV) and Fe(V) Carbynes. Journal of the American Chemical Society, 2019, 141, 15211-15221 |
4128994 | CIF | C39 H38 N14 O6 | P 1 21/c 1 | 11.6451; 21.3404; 14.8565 90; 95.918; 90 | 3672.33 | de Bettencourt-Dias, Ana; Beeler, Rose M.; Zimmerman, Joshua R. Anion-π and H-Bonding Interactions Supporting Encapsulation of [Ln(NO<sub>3</sub>)<sub>6/5</sub>]<sup>3-/2-</sup> (Ln = Nd, Er) with a Triazine-Based Ligand. Journal of the American Chemical Society, 2019, 141, 15102-15110 |
4128995 | CIF | C39 H36 N12 | C 1 2/c 1 | 41.1586; 11.1026; 14.8734 90; 98.864; 90 | 6715.49 | de Bettencourt-Dias, Ana; Beeler, Rose M.; Zimmerman, Joshua R. Anion-π and H-Bonding Interactions Supporting Encapsulation of [Ln(NO<sub>3</sub>)<sub>6/5</sub>]<sup>3-/2-</sup> (Ln = Nd, Er) with a Triazine-Based Ligand. Journal of the American Chemical Society, 2019, 141, 15102-15110 |
4128996 | CIF | C43 H42 N20 Nd O18 | P -1 | 12.163; 12.2694; 17.6357 94.394; 92.077; 95.134 | 2611.1 | de Bettencourt-Dias, Ana; Beeler, Rose M.; Zimmerman, Joshua R. Anion-π and H-Bonding Interactions Supporting Encapsulation of [Ln(NO<sub>3</sub>)<sub>6/5</sub>]<sup>3-/2-</sup> (Ln = Nd, Er) with a Triazine-Based Ligand. Journal of the American Chemical Society, 2019, 141, 15102-15110 |
4128997 | CIF | C86 H88 Er3 N43 O47 | P -1 | 14.3372; 17.1271; 25.2207 89.822; 74.953; 83.091 | 5934.7 | de Bettencourt-Dias, Ana; Beeler, Rose M.; Zimmerman, Joshua R. Anion-π and H-Bonding Interactions Supporting Encapsulation of [Ln(NO<sub>3</sub>)<sub>6/5</sub>]<sup>3-/2-</sup> (Ln = Nd, Er) with a Triazine-Based Ligand. Journal of the American Chemical Society, 2019, 141, 15102-15110 |
4128998 | CIF | C30 H53 Li2 N6 O P | P 21 21 21 | 10.77; 10.98; 28.973 90; 90; 90 | 3426 | Gladfelder, Joshua J.; Ghosh, Santanu; Podunavac, Maša; Cook, Andrew W.; Ma, Yun; Woltornist, Ryan A.; Keresztes, Ivan; Hayton, Trevor W.; Collum, David B.; Zakarian, Armen Enantioselective Alkylation of 2-Alkylpyridines Controlled by Organolithium Aggregation. Journal of the American Chemical Society, 2019, 141, 15024-15028 |
4128999 | CIF | C32 H57 Li2 N6 O2 P | P 21 21 21 | 14.958; 15.579; 30.593 90; 90; 90 | 7129 | Gladfelder, Joshua J.; Ghosh, Santanu; Podunavac, Maša; Cook, Andrew W.; Ma, Yun; Woltornist, Ryan A.; Keresztes, Ivan; Hayton, Trevor W.; Collum, David B.; Zakarian, Armen Enantioselective Alkylation of 2-Alkylpyridines Controlled by Organolithium Aggregation. Journal of the American Chemical Society, 2019, 141, 15024-15028 |
4129000 | CIF | C106 H111 Cl3 O8 | P 1 21/n 1 | 12.4631; 22.4492; 30.1 90; 91.654; 90 | 8418.1 | Nishigaki, Shuhei; Shibata, Yu; Nakajima, Atsuya; Okajima, Hajime; Masumoto, Yui; Osawa, Taisei; Muranaka, Atsuya; Sugiyama, Haruki; Horikawa, Ayano; Uekusa, Hidehiro; Koshino, Hiroyuki; Uchiyama, Masanobu; Sakamoto, Akira; Tanaka, Ken Synthesis of Belt- and Möbius-Shaped Cycloparaphenylenes by Rhodium-Catalyzed Alkyne Cyclotrimerization. Journal of the American Chemical Society, 2019, 141, 14955-14960 |
4129001 | CIF | C16 H19 N3 | P 21 21 21 | 6.2514; 7.289; 29.77 90; 90; 90 | 1356.5 | Halabi, Jad Mahmoud; Ahmed, Ejaz; Catalano, Luca; Karothu, Durga Prasad; Rezgui, Rachid; Naumov, Panče Spatial Photocontrol of the Optical Output from an Organic Crystal Waveguide. Journal of the American Chemical Society, 2019, 141, 14966-14970 |
4129002 | CIF | C47 H33 N3 S2 | P 1 21/c 1 | 9.2363; 8.7977; 45.59 90; 106.45; 90 | 3552.9 | Niu, Guangle; Zheng, Xiuli; Zhao, Zheng; Zhang, Haoke; Wang, Jianguo; He, Xuewen; Chen, Yuncong; Shi, Xiujuan; Ma, Chao; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Wong, Kam Sing; Wang, Pengfei; Tang, Ben Zhong Functionalized Acrylonitriles with Aggregation-Induced Emission: Structure Tuning by Simple Reaction-Condition Variation, Efficient Red Emission, and Two-Photon Bioimaging. Journal of the American Chemical Society, 2019, 141, 15111-15120 |
4129003 | CIF | C47 H64 Co N3 | P b c a | 17.4002; 20.7307; 23.4789 90; 90; 90 | 8469.3 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129004 | CIF | C37 H49 N O | P b c m | 10.9033; 12.0359; 25.14 90; 90; 90 | 3299.1 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129005 | CIF | C47 H64 Co I2 N | P c a 21 | 23.0483; 14.029; 27.3737 90; 90; 90 | 8851.1 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129006 | CIF | C53 H74 Co N | P 1 21/n 1 | 17.8319; 13.874; 19.914 90; 105.928; 90 | 4737.6 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129007 | CIF | C65 H79 Co N P | P 1 21/c 1 | 13.5984; 17.629; 23.0085 90; 90.367; 90 | 5515.6 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129008 | CIF | C47 H65 Co N O | P b c a | 17.3101; 20.4836; 23.4544 90; 90; 90 | 8316.3 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129009 | CIF | C47 H64 Co N3 O | P b c a | 17.4228; 20.6348; 23.3437 90; 90; 90 | 8392.4 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129010 | CIF | C60 H89 Co N2 O2 Si2 | P b c a | 18.4221; 17.1331; 36.3469 90; 90; 90 | 11472.1 | Mokhtarzadeh, Charles C.; Chan, Chinglin; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. Side-On Coordination of Nitrous Oxide to a Mononuclear Cobalt Center. Journal of the American Chemical Society, 2019, 141, 15003-15007 |
4129011 | CIF | C41 H39 Cl4 N O2 P2 Pt | P 1 21/c 1 | 13.5872; 13.3149; 22.6201 90; 103.353; 90 | 3981.62 | Kanbayashi, Naoya; Okamura, Taka-Aki; Onitsuka, Kiyotaka Living Cyclocopolymerization through Alternating Insertion of Isocyanide and Allene via Controlling the Reactivity of the Propagation Species: Detailed Mechanistic Investigation. Journal of the American Chemical Society, 2019, 141, 15307-15317 |
4129012 | CIF | C112 H138 B2 N10 Si4 | P b c n | 23.3425; 17.6797; 24.6828 90; 90; 90 | 10186.3 | Sun, Xiaofei; Simler, Thomas; Yadav, Ravi; Köppe, Ralf; Roesky, Peter W. A Stable Aromatic Tetrasilacyclobutadiene Dication. Journal of the American Chemical Society, 2019, 141, 14987-14990 |
4129013 | CIF | C113.34 H138.02 B2 N10 Si4 | P b c n | 23.0452; 17.8779; 25.1244 90; 90; 90 | 10351.2 | Sun, Xiaofei; Simler, Thomas; Yadav, Ravi; Köppe, Ralf; Roesky, Peter W. A Stable Aromatic Tetrasilacyclobutadiene Dication. Journal of the American Chemical Society, 2019, 141, 14987-14990 |
4129014 | CIF | C112 H140 B2 N8 O Si4 | P b c n | 23.2625; 17.5096; 24.5181 90; 90; 90 | 9986.6 | Sun, Xiaofei; Simler, Thomas; Yadav, Ravi; Köppe, Ralf; Roesky, Peter W. A Stable Aromatic Tetrasilacyclobutadiene Dication. Journal of the American Chemical Society, 2019, 141, 14987-14990 |
4129015 | CIF | C49 H41 Cu O3 P2 | P 1 21/c 1 | 13.1535; 18.2025; 17.8085 90; 107.602; 90 | 4064.2 | van Vliet, Kaj M.; Polak, Lara H.; Siegler, Maxime A.; van der Vlugt, Jarl Ivar; Guerra, Célia Fonseca; de Bruin, Bas Efficient Copper-Catalyzed Multicomponent Synthesis of <i>N-</i>Acyl Amidines via Acyl Nitrenes. Journal of the American Chemical Society, 2019, 141, 15240-15249 |
4129016 | CIF | C189 H162 Au13 Cl3 F12 N18 P2 | P -1 | 17.019; 19.261; 28.579 93.223; 100.749; 90.782 | 9187 | Narouz, Mina R.; Takano, Shinjiro; Lummis, Paul A.; Levchenko, Tetyana I.; Nazemi, Ali; Kaappa, Sami; Malola, Sami; Yousefalizadeh, Goonay; Calhoun, Larry A.; Stamplecoskie, Kevin G.; Häkkinen, Hannu; Tsukuda, Tatsuya; Crudden, Cathleen M. Robust, Highly Luminescent Au<sub>13</sub> Superatoms Protected by N-Heterocyclic Carbenes. Journal of the American Chemical Society, 2019, 141, 14997-15002 |
4129017 | CIF | C17 H23 Br N O7.5 | P n a 21 | 12.858; 10.2977; 29 90; 90; 90 | 3839.8 | Hu, Xiaoran; Zeng, Tian; Husic, Corey C.; Robb, Maxwell J. Mechanically Triggered Small Molecule Release from a Masked Furfuryl Carbonate. Journal of the American Chemical Society, 2019, 141, 15018-15023 |
4129018 | CIF | C27 H43 N3 Si3 V | P -1 | 10.8676; 12.3856; 12.9182 115.312; 95.615; 97.369 | 1536.12 | Zhang, Guoqi; Wu, Jing; Zheng, Shengping; Neary, Michelle C.; Mao, Jincheng; Flores, Marco; Trovitch, Ryan J.; Dub, Pavel A. Redox-Noninnocent Ligand-Supported Vanadium Catalysts for the Chemoselective Reduction of C═X (X = O, N) Functionalities. Journal of the American Chemical Society, 2019, 141, 15230-15239 |
4129019 | CIF | C27 H43.44 N3 Si3 V | P -1 | 10.8649; 12.4225; 13.0617 115.202; 96.239; 96.088 | 1562.8 | Zhang, Guoqi; Wu, Jing; Zheng, Shengping; Neary, Michelle C.; Mao, Jincheng; Flores, Marco; Trovitch, Ryan J.; Dub, Pavel A. Redox-Noninnocent Ligand-Supported Vanadium Catalysts for the Chemoselective Reduction of C═X (X = O, N) Functionalities. Journal of the American Chemical Society, 2019, 141, 15230-15239 |
4129020 | CIF | C29 H37 N3 Si2 V | P 1 21/c 1 | 15.9192; 9.2597; 19.7266 90; 91.164; 90 | 2907.2 | Zhang, Guoqi; Wu, Jing; Zheng, Shengping; Neary, Michelle C.; Mao, Jincheng; Flores, Marco; Trovitch, Ryan J.; Dub, Pavel A. Redox-Noninnocent Ligand-Supported Vanadium Catalysts for the Chemoselective Reduction of C═X (X = O, N) Functionalities. Journal of the American Chemical Society, 2019, 141, 15230-15239 |
4129021 | CIF | C8 H12 Cl N | P c a 21 | 17.5887; 5.0205; 10.2381 90; 90; 90 | 904.07 | Zhang, Guoqi; Wu, Jing; Zheng, Shengping; Neary, Michelle C.; Mao, Jincheng; Flores, Marco; Trovitch, Ryan J.; Dub, Pavel A. Redox-Noninnocent Ligand-Supported Vanadium Catalysts for the Chemoselective Reduction of C═X (X = O, N) Functionalities. Journal of the American Chemical Society, 2019, 141, 15230-15239 |
4129022 | CIF | C32 H61 Co3 O24 | P n n a | 28.714; 21.1265; 10.946 90; 90; 90 | 6640.1 | Qazvini, Omid T.; Babarao, Ravichandar; Shi, Zhao-Lin; Zhang, Yue-Biao; Telfer, Shane G. A Robust Ethane-Trapping Metal-Organic Framework with a High Capacity for Ethylene Purification. Journal of the American Chemical Society, 2019, 141, 5014-5020 |
4129023 | CIF | C19 H26 O5 | P 21 21 21 | 6.3267; 8.6439; 29.68 90; 90; 90 | 1623.12 | Khatri, Hem Raj; Bhattarai, Bijay; Kaplan, Will; Li, Zhongzheng; Curtis Long, Marcus John; Aye, Yimon; Nagorny, Pavel Modular Total Synthesis and Cell-Based Anticancer Activity Evaluation of Ouabagenin and Other Cardiotonic Steroids with Varying Degrees of Oxygenation. Journal of the American Chemical Society, 2019, 141, 4849-4860 |
4129024 | CIF | C23 H34 O7 | P 1 21 1 | 7.36657; 9.85708; 14.2852 90; 94.3143; 90 | 1034.35 | Khatri, Hem Raj; Bhattarai, Bijay; Kaplan, Will; Li, Zhongzheng; Curtis Long, Marcus John; Aye, Yimon; Nagorny, Pavel Modular Total Synthesis and Cell-Based Anticancer Activity Evaluation of Ouabagenin and Other Cardiotonic Steroids with Varying Degrees of Oxygenation. Journal of the American Chemical Society, 2019, 141, 4849-4860 |
4129025 | CIF | C24 H31 N O | P 1 21 1 | 10.883; 14.071; 13.651 90; 105.587; 90 | 2013.6 | Xu, Jiasu; Rawal, Viresh H. Total Synthesis of (-)-Ambiguine P. Journal of the American Chemical Society, 2019, 141, 4820-4823 |
4129026 | CIF | C95.44 H136.52 Cl0.37 N6 O5.82 P | P -1 | 16.1688; 18.0527; 18.8483 63.1338; 76.4813; 68.8934 | 4561.9 | Zhao, Wei; Qiao, Bo; Tropp, Joshua; Pink, Maren; Azoulay, Jason D.; Flood, Amar H. Linear Supramolecular Polymers Driven by Anion-Anion Dimerization of Difunctional Phosphonate Monomers Inside Cyanostar Macrocycles. Journal of the American Chemical Society, 2019, 141, 4980-4989 |
4129027 | CIF | C47 H45 Au Cl3 N4 Ni P | P -1 | 12.7696; 13.2248; 15.5398 98.656; 107.333; 113.731 | 2180.75 | Omori, Hiroto; Hiroto, Satoru; Takeda, Youhei; Fliegl, Heike; Minakata, Satoshi; Shinokubo, Hiroshi Ni(II) 10-Phosphacorrole: A Porphyrin Analogue Containing Phosphorus at the Meso Position. Journal of the American Chemical Society, 2019, 141, 4800-4805 |
4129028 | CIF | C48.5 H45 N4 Ni O P | P b c a | 16.4476; 24.3351; 40.0869 90; 90; 90 | 16044.9 | Omori, Hiroto; Hiroto, Satoru; Takeda, Youhei; Fliegl, Heike; Minakata, Satoshi; Shinokubo, Hiroshi Ni(II) 10-Phosphacorrole: A Porphyrin Analogue Containing Phosphorus at the Meso Position. Journal of the American Chemical Society, 2019, 141, 4800-4805 |
4129029 | CIF | C91 H83 Cl3 N8 Ni2 P2 | P -1 | 16.0007; 16.1997; 17.7476 100.329; 115.508; 101.094 | 3891.7 | Omori, Hiroto; Hiroto, Satoru; Takeda, Youhei; Fliegl, Heike; Minakata, Satoshi; Shinokubo, Hiroshi Ni(II) 10-Phosphacorrole: A Porphyrin Analogue Containing Phosphorus at the Meso Position. Journal of the American Chemical Society, 2019, 141, 4800-4805 |
4129030 | CIF | C23 H30 O4 | P 1 21 1 | 7.8235; 8.2819; 16.211 90; 96.355; 90 | 1043.91 | Wang, Yu; Ju, Wei; Tian, Hailong; Sun, Suyun; Li, Xinghui; Tian, Weisheng; Gui, Jinghan Facile Access to Bridged Ring Systems via Point-to-Planar Chirality Transfer: Unified Synthesis of Ten Cyclocitrinols. Journal of the American Chemical Society, 2019, 141, 5021-5033 |
4129031 | CIF | C23 H30 O4 | P 21 21 21 | 6.7003; 14.5512; 20.4826 90; 90; 90 | 1997 | Wang, Yu; Ju, Wei; Tian, Hailong; Sun, Suyun; Li, Xinghui; Tian, Weisheng; Gui, Jinghan Facile Access to Bridged Ring Systems via Point-to-Planar Chirality Transfer: Unified Synthesis of Ten Cyclocitrinols. Journal of the American Chemical Society, 2019, 141, 5021-5033 |
4129032 | CIF | C19 H22 O | P 21 21 21 | 5.0118; 9.3269; 32.56 90; 90; 90 | 1522 | Wang, Yu; Ju, Wei; Tian, Hailong; Sun, Suyun; Li, Xinghui; Tian, Weisheng; Gui, Jinghan Facile Access to Bridged Ring Systems via Point-to-Planar Chirality Transfer: Unified Synthesis of Ten Cyclocitrinols. Journal of the American Chemical Society, 2019, 141, 5021-5033 |
4129033 | CIF | C22 H17 I O | P -1 | 11.4777; 11.7014; 15.3255 97.482; 90.147; 118.95 | 1780.65 | Hu, Zhifei; Tang, Yu; Yu, Biao Glycosylation with 3,5-Dimethyl-4-(2'-phenylethynylphenyl)phenyl (EPP) Glycosides via a Dearomative Activation Mechanism. Journal of the American Chemical Society, 2019, 141, 4806-4810 |
4129034 | CIF | C14 H13 I O | P b c n | 22.1638; 15.0475; 7.499 90; 90; 90 | 2501 | Hu, Zhifei; Tang, Yu; Yu, Biao Glycosylation with 3,5-Dimethyl-4-(2'-phenylethynylphenyl)phenyl (EPP) Glycosides via a Dearomative Activation Mechanism. Journal of the American Chemical Society, 2019, 141, 4806-4810 |
4129035 | CIF | C36 H36 O10 | P 1 21 1 | 10.7002; 23.8506; 22.5203 90; 98.085; 90 | 5690.2 | Hu, Zhifei; Tang, Yu; Yu, Biao Glycosylation with 3,5-Dimethyl-4-(2'-phenylethynylphenyl)phenyl (EPP) Glycosides via a Dearomative Activation Mechanism. Journal of the American Chemical Society, 2019, 141, 4806-4810 |
4129036 | CIF | C8 H4 Cu N4 Ni S4 | P 42/m m c | 6.8132; 6.8132; 16.166 90; 90; 90 | 750.4 | Aubrey, Michael L.; Kapelewski, Matthew T.; Melville, Jonathan F.; Oktawiec, Julia; Presti, Davide; Gagliardi, Laura; Long, Jeffrey R. Chemiresistive Detection of Gaseous Hydrocarbons and Interrogation of Charge Transport in Cu[Ni(2,3-pyrazinedithiolate)<sub>2</sub>] by Gas Adsorption. Journal of the American Chemical Society, 2019, 141, 5005-5013 |
4129037 | CIF | C10 H6 Cu N4 Ni S4 | P 42/m m c | 6.8233; 6.8233; 16.1432 90; 90; 90 | 751.59 | Aubrey, Michael L.; Kapelewski, Matthew T.; Melville, Jonathan F.; Oktawiec, Julia; Presti, Davide; Gagliardi, Laura; Long, Jeffrey R. Chemiresistive Detection of Gaseous Hydrocarbons and Interrogation of Charge Transport in Cu[Ni(2,3-pyrazinedithiolate)<sub>2</sub>] by Gas Adsorption. Journal of the American Chemical Society, 2019, 141, 5005-5013 |
4129038 | CIF | C2.4 H1.81 Cu0.25 N Ni0.25 S | P 42/m m c | 6.8342; 6.8342; 16.0964 90; 90; 90 | 751.8 | Aubrey, Michael L.; Kapelewski, Matthew T.; Melville, Jonathan F.; Oktawiec, Julia; Presti, Davide; Gagliardi, Laura; Long, Jeffrey R. Chemiresistive Detection of Gaseous Hydrocarbons and Interrogation of Charge Transport in Cu[Ni(2,3-pyrazinedithiolate)<sub>2</sub>] by Gas Adsorption. Journal of the American Chemical Society, 2019, 141, 5005-5013 |
4129039 | CIF | C10 H15 N O3 S | P 1 21 1 | 9.491; 6.116; 9.9296 90; 101.54; 90 | 564.73 | Yuan, Jingsong; Xiong, Wei; Zhou, Xuhao; Zhang, Yi; Shi, Dong; Li, Zichen; Lu, Hua 4-Hydroxyproline-Derived Sustainable Polythioesters: Controlled Ring-Opening Polymerization, Complete Recyclability, and Facile Functionalization. Journal of the American Chemical Society, 2019, 141, 4928-4935 |
4129040 | CIF | C13 H13 N O3 S | P 41 21 2 | 8.7471; 8.7471; 32.7688 90; 90; 90 | 2507.2 | Yuan, Jingsong; Xiong, Wei; Zhou, Xuhao; Zhang, Yi; Shi, Dong; Li, Zichen; Lu, Hua 4-Hydroxyproline-Derived Sustainable Polythioesters: Controlled Ring-Opening Polymerization, Complete Recyclability, and Facile Functionalization. Journal of the American Chemical Society, 2019, 141, 4928-4935 |
4129041 | CIF | C24 H40 Br N2 Ni | P 1 21 1 | 6.8458; 11.2304; 16.4338 90; 99.126; 90 | 1247.46 | Zarate, Cayetana; Yang, Haifeng; Bezdek, Máté J; Hesk, David; Chirik, Paul J. Ni(I)-X Complexes Bearing a Bulky α-Diimine Ligand: Synthesis, Structure, and Superior Catalytic Performance in the Hydrogen Isotope Exchange in Pharmaceuticals. Journal of the American Chemical Society, 2019, 141, 5034-5044 |
4129042 | CIF | C24 H40 Cl N2 Ni | P 1 21 1 | 6.849; 11.091; 32.493 90; 93.69; 90 | 2463.1 | Zarate, Cayetana; Yang, Haifeng; Bezdek, Máté J; Hesk, David; Chirik, Paul J. Ni(I)-X Complexes Bearing a Bulky α-Diimine Ligand: Synthesis, Structure, and Superior Catalytic Performance in the Hydrogen Isotope Exchange in Pharmaceuticals. Journal of the American Chemical Society, 2019, 141, 5034-5044 |
4129043 | CIF | C24 H40 I N2 Ni | P 21 21 21 | 7.7891; 22.175; 28.51 90; 90; 90 | 4924.3 | Zarate, Cayetana; Yang, Haifeng; Bezdek, Máté J; Hesk, David; Chirik, Paul J. Ni(I)-X Complexes Bearing a Bulky α-Diimine Ligand: Synthesis, Structure, and Superior Catalytic Performance in the Hydrogen Isotope Exchange in Pharmaceuticals. Journal of the American Chemical Society, 2019, 141, 5034-5044 |
4129044 | CIF | C24 H40 N2 Ni | P 21 21 2 | 13.0031; 13.3258; 14.169 90; 90; 90 | 2455.16 | Zarate, Cayetana; Yang, Haifeng; Bezdek, Máté J; Hesk, David; Chirik, Paul J. Ni(I)-X Complexes Bearing a Bulky α-Diimine Ligand: Synthesis, Structure, and Superior Catalytic Performance in the Hydrogen Isotope Exchange in Pharmaceuticals. Journal of the American Chemical Society, 2019, 141, 5034-5044 |
4129045 | CIF | C44 H72 Br2 N4 Ni2 | P 1 21 1 | 13.3155; 12.3857; 13.9317 90; 104.318; 90 | 2226.27 | Zarate, Cayetana; Yang, Haifeng; Bezdek, Máté J; Hesk, David; Chirik, Paul J. Ni(I)-X Complexes Bearing a Bulky α-Diimine Ligand: Synthesis, Structure, and Superior Catalytic Performance in the Hydrogen Isotope Exchange in Pharmaceuticals. Journal of the American Chemical Society, 2019, 141, 5034-5044 |
4129046 | CIF | C27 H19 B F2 I N O2 | P 1 21/n 1 | 10.145; 19.61; 11.073 90; 90.77; 90 | 2202.7 | Wang, Xiao-Fang; Xiao, Hongyan; Chen, Peng-Zhong; Yang, Qing-Zheng; Chen, Bin; Tung, Chen-Ho; Chen, Yu-Zhe; Wu, Li-Zhu Pure Organic Room Temperature Phosphorescence from Excited Dimers in Self-Assembled Nanoparticles under Visible and Near-Infrared Irradiation in Water. Journal of the American Chemical Society, 2019, 141, 5045-5050 |
4129047 | CIF | C27 H19 B Br F2 N O2 | P 1 21/n 1 | 10.217; 19.415; 10.927 90; 90.86; 90 | 2167.3 | Wang, Xiao-Fang; Xiao, Hongyan; Chen, Peng-Zhong; Yang, Qing-Zheng; Chen, Bin; Tung, Chen-Ho; Chen, Yu-Zhe; Wu, Li-Zhu Pure Organic Room Temperature Phosphorescence from Excited Dimers in Self-Assembled Nanoparticles under Visible and Near-Infrared Irradiation in Water. Journal of the American Chemical Society, 2019, 141, 5045-5050 |
4129048 | CIF | Mn2 O7 Y2 | F d -3 m :2 | 9.9099; 9.9099; 9.9099 90; 90; 90 | 973.2 | Todd, Paul K.; Neilson, James R. Selective Formation of Yttrium Manganese Oxides through Kinetically Competent Assisted Metathesis Reactions. Journal of the American Chemical Society, 2019, 141, 1191-1195 |
4129049 | CIF | Mn O3.11 Y | P n m a | 5.6452; 7.3942; 5.2218 90; 90; 90 | 217.97 | Todd, Paul K.; Neilson, James R. Selective Formation of Yttrium Manganese Oxides through Kinetically Competent Assisted Metathesis Reactions. Journal of the American Chemical Society, 2019, 141, 1191-1195 |
4129050 | CIF | C12 H11 N O3 | P 1 21/c 1 | 8.4738; 14.00094; 11.47243 90; 125.365; 90 | 1109.95 | Lukin, Stipe; Tireli, Martina; Stolar, Tomislav; Barišić, Dajana; Blanco, Maria Valeria; di Michiel, Marco; Užarević, Krunoslav; Halasz, Ivan Isotope Labeling Reveals Fast Atomic and Molecular Exchange in Mechanochemical Milling Reactions. Journal of the American Chemical Society, 2019, 141, 1212-1216 |
4129051 | CIF | C28 H44 O3 | P 32 | 17.4837; 17.4837; 29.713 90; 90; 120 | 7865.8 | Heinze, Robert C.; Heretsch, Philipp Translation of a Polar Biogenesis Proposal into a Radical Synthetic Approach: Synthesis of Pleurocin A/Matsutakone and Pleurocin B. Journal of the American Chemical Society, 2019, 141, 1222-1226 |
4129052 | CIF | C32 H46 O5 | P 21 21 21 | 6.3001; 15.0343; 31.3137 90; 90; 90 | 2965.96 | Heinze, Robert C.; Heretsch, Philipp Translation of a Polar Biogenesis Proposal into a Radical Synthetic Approach: Synthesis of Pleurocin A/Matsutakone and Pleurocin B. Journal of the American Chemical Society, 2019, 141, 1222-1226 |
4129074 | CIF | C20 H19 N O5 | P 1 21 1 | 11.3601; 5.8169; 13.5193 90; 107.48; 90 | 852.11 | Tanwar, Lalita; Börgel, Jonas; Ritter, Tobias Synthesis of Benzylic Alcohols by C-H Oxidation. Journal of the American Chemical Society, 2019, 141, 17983-17988 |
4129075 | CIF | C18 H15 N O5 | P 32 2 1 | 11.8237; 11.8237; 19.047 90; 90; 120 | 2306.03 | Tanwar, Lalita; Börgel, Jonas; Ritter, Tobias Synthesis of Benzylic Alcohols by C-H Oxidation. Journal of the American Chemical Society, 2019, 141, 17983-17988 |
4129083 | CIF | C17 H14 O5 | P 21 21 21 | 5.3944; 18.0328; 29.9372 90; 90; 90 | 2912.18 | Pyser, Joshua B.; Baker Dockrey, Summer A.; Benítez, Attabey Rodríguez; Joyce, Leo A.; Wiscons, Ren A.; Smith, Janet L.; Narayan, Alison R. H. Stereodivergent, Chemoenzymatic Synthesis of Azaphilone Natural Products. Journal of the American Chemical Society, 2019, 141, 18551-18559 |
4129084 | CIF | C68 H67 N5 Ni O2 | P -1 | 14.9071; 15.8745; 18.8299 94.574; 103.809; 110.373 | 3991.1 | Xu, Youzhi; Gsänger, Sebastian; Minameyer, Martin B.; Imaz, Inhar; Maspoch, Daniel; Shyshov, Oleksandr; Schwer, Fabian; Ribas, Xavi; Drewello, Thomas; Meyer, Bernd; von Delius, Max Highly Strained, Radially π-Conjugated Porphyrinylene Nanohoops. Journal of the American Chemical Society, 2019, 141, 18500-18507 |
4129085 | CIF | C132 H124 N8 Ni2 | P -1 | 15.45; 17.79; 18.18 115.78; 93.59; 114.36 | 3917 | Xu, Youzhi; Gsänger, Sebastian; Minameyer, Martin B.; Imaz, Inhar; Maspoch, Daniel; Shyshov, Oleksandr; Schwer, Fabian; Ribas, Xavi; Drewello, Thomas; Meyer, Bernd; von Delius, Max Highly Strained, Radially π-Conjugated Porphyrinylene Nanohoops. Journal of the American Chemical Society, 2019, 141, 18500-18507 |
4129086 | CIF | C192 H124 N8 Ni2 | P 1 21/n 1 | 15.83; 34.13; 30.67 90; 90.14; 90 | 16570 | Xu, Youzhi; Gsänger, Sebastian; Minameyer, Martin B.; Imaz, Inhar; Maspoch, Daniel; Shyshov, Oleksandr; Schwer, Fabian; Ribas, Xavi; Drewello, Thomas; Meyer, Bernd; von Delius, Max Highly Strained, Radially π-Conjugated Porphyrinylene Nanohoops. Journal of the American Chemical Society, 2019, 141, 18500-18507 |
4129088 | CIF | C20 H23 N3 O3 | P 21 21 21 | 6.3111; 9.3707; 30.764 90; 90; 90 | 1819.4 | Gonçalves, Carlos R; Lemmerer, Miran; Teskey, Christopher J.; Adler, Pauline; Kaiser, Daniel; Maryasin, Boris; González, Leticia; Maulide, Nuno Unified Approach to the Chemoselective α-Functionalization of Amides with Heteroatom Nucleophiles. Journal of the American Chemical Society, 2019, 141, 18437-18443 |
4129089 | CIF | C42 H56 Cl2 N2 O10 Ru | P -1 | 10.7706; 12.8085; 15.9271 96.76; 104.61; 94.684 | 2097.2 | Zhu, Jun; Chen, Peng-Hao; Lu, Gang; Liu, Peng; Dong, Guangbin Ruthenium-Catalyzed Reductive Cleavage of Unstrained Aryl-Aryl Bonds: Reaction Development and Mechanistic Study. Journal of the American Chemical Society, 2019, 141, 18630-18640 |
4129104 | CIF | C104 H94 Cl12 N10 O4 | P -1 | 15.9672; 17.4963; 19.2176 113.521; 91.756; 98.502 | 4844.7 | Rao, Yutao; Zhou, Wenjing; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Tanaka, Takayuki; Osuka, Atsuhiro; Song, Jianxin Singly and Doubly Neo-Confused Smaragdyrins. Journal of the American Chemical Society, 2019, 141, 18836-18844 |
4129105 | CIF | C52 H49 Cl2 N5 O | P -1 | 8.6711; 15.7062; 16.1757 92.5156; 95.7126; 98.8312 | 2162.12 | Rao, Yutao; Zhou, Wenjing; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Tanaka, Takayuki; Osuka, Atsuhiro; Song, Jianxin Singly and Doubly Neo-Confused Smaragdyrins. Journal of the American Chemical Society, 2019, 141, 18836-18844 |
4129106 | CIF | C51 H47 B Cl3 F2 N5 | P 1 21/n 1 | 9.2009; 23.2963; 21.177 90; 97.172; 90 | 4503.7 | Rao, Yutao; Zhou, Wenjing; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Tanaka, Takayuki; Osuka, Atsuhiro; Song, Jianxin Singly and Doubly Neo-Confused Smaragdyrins. Journal of the American Chemical Society, 2019, 141, 18836-18844 |
4129107 | CIF | C53 H47 Cl10 Cu N5 O2 | P -1 | 12.2842; 14.9772; 16.2006 84.5774; 77.5388; 67.318 | 2685.11 | Rao, Yutao; Zhou, Wenjing; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Tanaka, Takayuki; Osuka, Atsuhiro; Song, Jianxin Singly and Doubly Neo-Confused Smaragdyrins. Journal of the American Chemical Society, 2019, 141, 18836-18844 |
4129108 | CIF | C50 H47 N5 | I 1 2/c 1 | 20.739; 12.7534; 32.675 90; 96.259; 90 | 8590.8 | Rao, Yutao; Zhou, Wenjing; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Tanaka, Takayuki; Osuka, Atsuhiro; Song, Jianxin Singly and Doubly Neo-Confused Smaragdyrins. Journal of the American Chemical Society, 2019, 141, 18836-18844 |
4129109 | CIF | C50 H46 B F2 N5 | P 21 21 21 | 11.90631; 16.82151; 21.0724 90; 90; 90 | 4220.42 | Rao, Yutao; Zhou, Wenjing; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Tanaka, Takayuki; Osuka, Atsuhiro; Song, Jianxin Singly and Doubly Neo-Confused Smaragdyrins. Journal of the American Chemical Society, 2019, 141, 18836-18844 |
4129110 | CIF | C31.59 H19.8 Al2 N1.2 O9.05 | P 42 21 2 | 19.0466; 19.0466; 36.389 90; 90; 90 | 13200.9 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129111 | CIF | C29 H19.5 Al2 O11.08 P0.5 | P 42 21 2 | 18.7104; 18.7104; 37.1528 90; 90; 90 | 13006.4 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129112 | CIF | C27 H17 Al2 O12.08 S0.86 | P 42 21 2 | 18.1729; 18.1729; 37.6737 90; 90; 90 | 12441.9 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129113 | CIF | C30.05 H17 Al2 N0.56 O10.56 | P 42 21 2 | 18.5778; 18.5778; 37.2977 90; 90; 90 | 12872.7 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129114 | CIF | C29.8 H17.44 Al2 O10.15 S0.36 | P 42 21 2 | 18.4641; 18.4641; 37.4193 90; 90; 90 | 12757.1 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129115 | CIF | C33.75 H23.81 Al2 B0.51 N1.02 O10.21 | P 42 21 2 | 19.2915; 19.2915; 36.081 90; 90; 90 | 13428 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129116 | CIF | C28.98 H18.86 Al2 N2.59 O8.37 | P 42 21 2 | 19.5339; 19.5339; 35.7057 90; 90; 90 | 13624.3 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129117 | CIF | C27.45 H18.55 Al2 O11.03 P0.55 | P 42 21 2 | 18.1702; 18.1702; 37.843 90; 90; 90 | 12494.1 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129118 | CIF | C29.81 H19.81 Al2 N1.87 O8 | P 42 21 2 | 19.4481; 19.4481; 35.7074 90; 90; 90 | 13505.6 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129119 | CIF | C29.02 H19.04 Al2 N2.07 O9.21 | P 42 21 2 | 18.8135; 18.8135; 36.797 90; 90; 90 | 13024.2 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129120 | CIF | C30.06 H24.02 Al2 N0.69 O11.09 P0.41 | P 42 21 2 | 18.6051; 18.6051; 37.384 90; 90; 90 | 12940.5 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129121 | CIF | C30.61 H21.53 Al2 O10.25 S0.52 | P 42 21 2 | 18.6986; 18.6986; 37.201 90; 90; 90 | 13006.9 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129122 | CIF | C31 H21 Al2 Br N2 O8 | P 42 21 2 | 19.4353; 19.4353; 35.7957 90; 90; 90 | 13521.1 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129123 | CIF | C34.5 H21.61 Al2 N2.17 O9.87 | P 42 21 2 | 18.6944; 18.6944; 37.0688 90; 90; 90 | 12954.8 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129124 | CIF | C30.29 H19.53 Al2 N0.76 O9.35 | P 42 21 2 | 19.3331; 19.3331; 36.2317 90; 90; 90 | 13542.3 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129125 | CIF | C28.72 H18.69 Al2 N2.15 O8.57 | P 42 21 2 | 18.9; 18.9; 36.682 90; 90; 90 | 13103.2 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129126 | CIF | C37 H27 Al2 N1.8 O10.85 | P 42 21 2 | 19.4248; 19.4248; 35.7345 90; 90; 90 | 13483.4 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129127 | CIF | C28.66 H18.66 Al2 N1.97 O8.69 | P 42 21 2 | 18.9155; 18.9155; 36.6951 90; 90; 90 | 13129.4 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129128 | CIF | C36.71 H26.71 Al2 N1.74 O10.8 | P 42 21 2 | 19.375; 19.375; 35.8159 90; 90; 90 | 13445 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129129 | CIF | C28.3 H19.22 Al2 O10.76 P0.35 | P 42 21 2 | 19.1935; 19.1935; 36.602 90; 90; 90 | 13483.8 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129130 | CIF | C28.73 H21.63 Al2 O10.09 P0.73 | P 42 21 2 | 18.9892; 18.9892; 36.9796 90; 90; 90 | 13334.5 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129131 | CIF | C34.45 H22.72 Al2 N1.83 O10.47 | P 42 21 2 | 19.079; 19.079; 36.683 90; 90; 90 | 13353 | Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A.; Liu, Yuzhong; Yaghi, Omar M. Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 2019, 141, 18862-18869 |
4129132 | CIF | C27 H33 B F6 Mo N10 O5 S | P 1 21/n 1 | 14.228; 13.62; 18.353 90; 100.239; 90 | 3499.9 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129133 | CIF | C30 H34 B Cl2 F3 Mo N10 O | C 1 2/c 1 | 15.5566; 25.0893; 19.727 90; 102.353; 90 | 7521.3 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129134 | CIF | C62.99 H67.99 B2 Cl1.99 F12 Mo2 N20 O4 | P 1 21/c 1 | 13.8205; 25.6573; 20.2557 90; 92.501; 90 | 7175.8 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129135 | CIF | C32 H36 B Cl4 F3 Mo N10 O3 | P -1 | 11.3506; 12.5625; 14.3264 84.529; 72.615; 88.843 | 1940.6 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129136 | CIF | C24 H30 B F3 Mo N10 O | P 1 21/c 1 | 13.745; 15.2669; 13.937 90; 105.432; 90 | 2819.1 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129137 | CIF | C26 H32 B F3 Mo N10 O | P 1 21/c 1 | 13.817; 15.5253; 14.0856 90; 104.603; 90 | 2923.9 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129138 | CIF | C27 H34 B F3 Mo N10 O3 | P -1 | 12.4233; 15.1163; 19.2382 109.409; 90.253; 109.324 | 3188.9 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129139 | CIF | C23 H28 B F3 Mo N10 O | P -1 | 12.423; 18.4355; 19.7901 98.941; 94.15; 97.286 | 4421.5 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129140 | CIF | C19 H19 F3 N2 O2 | C 1 c 1 | 10.8231; 20.891; 7.2837 90; 90.103; 90 | 1646.9 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129141 | CIF | C19 H19 F3 N2 O2 | P 1 21 1 | 10.6487; 7.4485; 10.8541 90; 102.152; 90 | 841.62 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129142 | CIF | C20 H18 F6 N2 O3 | P -1 | 11.0432; 11.4785; 16.9996 101.568; 97.159; 110.427 | 1933.4 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129143 | CIF | C19 H17 F3 N2 O4 | C 1 2/c 1 | 19.0565; 7.1857; 26.1183 90; 110.89; 90 | 3341.4 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129144 | CIF | C18 H14 F3 N3 O2 | I 1 2/a 1 | 19.218; 8.0933; 20.8998 90; 96.456; 90 | 3230.1 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129145 | CIF | C17 H18 Cl F3 N2 | P 1 21/n 1 | 6.6579; 20.4939; 12.6239 90; 104.427; 90 | 1668.17 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129146 | CIF | C18 H21 Cl F3 N O2 | C 1 2/c 1 | 22.224; 12.486; 13.371 90; 92.751; 90 | 3706 | Wilde, Justin H.; Smith, Jacob A.; Dickie, Diane A.; Harman, W. Dean Molybdenum-Promoted Synthesis of Isoquinuclidines with Bridgehead CF<sub>3</sub> Groups. Journal of the American Chemical Society, 2019, 141, 18890-18899 |
4129147 | CIF | C58 H45 B F20 N2 O2 Si W | P 1 21/c 1 | 10.3107; 36.0951; 15.803 90; 101.428; 90 | 5764.7 | Fuchs, Julien; Irran, Elisabeth; Hrobárik, Peter; Klare, Hendrik F. T.; Oestreich, Martin Si-H Bond Activation with Bullock's Cationic Tungsten(II) Catalyst: CO as Cooperating Ligand. Journal of the American Chemical Society, 2019, 141, 18845-18850 |
4129157 | CIF | C10 H8 N6 O | P 1 21/c 1 | 3.7553; 17.3319; 44.326 90; 92.17; 90 | 2882.95 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129158 | CIF | C14 H18 Cl2 Fe N8 O11 | P -1 | 10.457; 15.2881; 15.3002 86.767; 77.965; 76.781 | 2328.76 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129159 | CIF | C12 H17 B2 F8 Fe N7 O4 | P -1 | 10.0049; 10.1934; 11.1633 109.358; 94.272; 91.322 | 1069.75 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129160 | CIF | C132 H114 B7 F28 Fe9 N78 O18 | C 1 2/c 1 | 28.138; 20.942; 29.14 90; 93.17; 90 | 17145 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129161 | CIF | C159 H176.5 B7 F28 Fe9 N74.5 O20.5 | P 1 21/n 1 | 17.279; 24.2218; 25.7224 90; 99.479; 90 | 10618.6 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129162 | CIF | C132 H114 B7 F28 Fe9 N78 O18 | C 1 2/c 1 | 28.3179; 21.082; 29.2509 90; 92.81; 90 | 17441.7 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129163 | CIF | C152.8 H162.4 B7 F28 Fe9 N73.8 O19.3 | P 1 21/n 1 | 17.4969; 24.4003; 25.9749 90; 98.569; 90 | 10965.7 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129164 | CIF | C132 H114 B7 F28 Fe9 N78 O18 | C 1 2/c 1 | 28.4475; 21.1969; 29.3353 90; 92.571; 90 | 17671.3 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129165 | CIF | C132 H114 B7 F28 Fe9 N78 O18 | C 1 2/c 1 | 28.1814; 20.9721; 29.1619 90; 93.064; 90 | 17210.7 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129166 | CIF | C155 H166.5 B7 F28 Fe9 N74.5 O19.5 | P 1 21/n 1 | 17.4408; 24.2929; 25.9866 90; 99.074; 90 | 10872.4 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129167 | CIF | C12 H12 N6 O | P -1 | 6.3701; 8.0327; 12.0083 77.757; 88.305; 75.102 | 580.09 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129168 | CIF | C14 H20 B2 F8 Fe N6 O3 | P 1 21/n 1 | 11.1084; 9.5675; 21.0007 90; 102.628; 90 | 2177.96 | Berdiell, Izar Capel; Hochdörffer, Tim; Desplanches, Cédric; Kulmaczewski, Rafal; Shahid, Namrah; Wolny, Juliusz A.; Warriner, Stuart L.; Cespedes, Oscar; Schünemann, Volker; Chastanet, Guillaume; Halcrow, Malcolm A. Supramolecular Iron Metallocubanes Exhibiting Site-Selective Thermal and Light-Induced Spin-Crossover. Journal of the American Chemical Society, 2019, 141, 18759-18770 |
4129169 | CIF | C25 H23 Br O2 | P 1 21 1 | 10.40748; 18.4667; 11.24341 90; 101.052; 90 | 2120.82 | Chen, Xiao-Wang; Zhu, Lei; Gui, Yong-Yuan; Jing, Ke; Jiang, Yuan-Xu; Bo, Zhi-Yu; Lan, Yu; Li, Jing; Yu, Da-Gang Highly Selective and Catalytic Generation of Acyclic Quaternary Carbon Stereocenters via Functionalization of 1,3-Dienes with CO<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 18825-18835 |
4129170 | CIF | C26 H25 Br O2 | C 1 2 1 | 14.6595; 9.9009; 16.7124 90; 110.621; 90 | 2270.3 | Chen, Xiao-Wang; Zhu, Lei; Gui, Yong-Yuan; Jing, Ke; Jiang, Yuan-Xu; Bo, Zhi-Yu; Lan, Yu; Li, Jing; Yu, Da-Gang Highly Selective and Catalytic Generation of Acyclic Quaternary Carbon Stereocenters via Functionalization of 1,3-Dienes with CO<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 18825-18835 |
4133227 | CIF | Co8 Fe8 Na13 O233 P4 Si4 W36 | P m m n :2 | 25.9719; 23.5149; 18.9224 90; 90; 90 | 11556.4 | Han, Xin-Bao; Tang, Xing-Yan; Lin, Yue; Gracia-Espino, Eduardo; Liu, San-Gui; Liang, Hai-Wei; Hu, Guang-Zhi; Zhao, Xin-Jing; Liao, Hong-Gang; Tan, Yuan-Zhi; Wagberg, Thomas; Xie, Su-Yuan; Zheng, Lan-Sun Ultrasmall Abundant Metal-Based Clusters as Oxygen-Evolving Catalysts. Journal of the American Chemical Society, 2019, 141, 232-239 |
4133228 | CIF | C8 Co12 Fe4 Na19 O232 P4 Si4 W36 | P m m n :2 | 23.4377; 25.9959; 18.9014 90; 90; 90 | 11516.3 | Han, Xin-Bao; Tang, Xing-Yan; Lin, Yue; Gracia-Espino, Eduardo; Liu, San-Gui; Liang, Hai-Wei; Hu, Guang-Zhi; Zhao, Xin-Jing; Liao, Hong-Gang; Tan, Yuan-Zhi; Wagberg, Thomas; Xie, Su-Yuan; Zheng, Lan-Sun Ultrasmall Abundant Metal-Based Clusters as Oxygen-Evolving Catalysts. Journal of the American Chemical Society, 2019, 141, 232-239 |
4133335 | CIF | C69 H81 N9 O2 | P 1 21/c 1 | 19.9187; 12.8361; 24.6531 90; 101.661; 90 | 6173.2 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133336 | CIF | C69 H80.5 Cl1.5 Co N9 O8 | P -1 | 17.911; 19.5002; 21.732 79.191; 78.964; 85.424 | 7310.2 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133337 | CIF | C68 H82.5 Cl2 Cu N3 O10.25 | P -1 | 17.2694; 18.7541; 23.8381 91.061; 98.694; 109.472 | 7175.6 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133338 | CIF | C68.5 H83.75 Cl2 Co N6 O10.38 | P -1 | 14.16695; 15.3447; 33.0606 80.6174; 78.6057; 85.0442 | 6940.15 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133339 | CIF | C70.33 H85 Cl2 N7.66 O10.25 Zn | P 1 21/c 1 | 21.5821; 19.5966; 34.0945 90; 103.984; 90 | 13992.4 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133340 | CIF | C67 H79 Cu F6 N6 O2 P | P 1 21/c 1 | 15.3429; 29.8447; 16.0649 90; 109.448; 90 | 6936.5 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133341 | CIF | C70 H83.5 Cu F6 N9 O2.25 P | P -1 | 11.4007; 15.078; 22.0734 107.853; 93.183; 108.418 | 3377.56 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133342 | CIF | C69.25 H83 Cl2 Cu N9 O10.75 | P -1 | 17.8219; 19.5882; 21.7632 79.434; 79.354; 85.891 | 7334.52 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133343 | CIF | C70.2 H84.8 Cl1.5 N9 Ni O8.7 | P -1 | 17.6574; 19.5677; 22.0939 79.326; 79.151; 85.4 | 7359.47 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133344 | CIF | C65 H80 Cl3 F6 N3 O9 S2 Zn | P -1 | 11.882; 16.596; 17.724 88.443; 86.436; 79.605 | 3430.6 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133345 | CIF | C71 H86 Cl2 N9 O10.5 Zn | P -1 | 17.6101; 19.8415; 21.9561 78.626; 79.156; 84.487 | 7372.9 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133346 | CIF | C65.2 H83.8 Cl2 Cu N6.6 O11.4 | P 1 21/n 1 | 12.0642; 16.2582; 33.1294 90; 90.603; 90 | 6497.71 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133347 | CIF | C67 H80 N6 O2 | P 1 21/n 1 | 19.0585; 12.4747; 25.7522 90; 101.83; 90 | 5992.52 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133348 | CIF | C71 H90 Cl2 N3 Ni O11 | P -1 | 14.9467; 15.04; 16.2204 104.093; 95.803; 101.189 | 3426.92 | Cirulli, Martina; Kaur, Amanpreet; Lewis, James E. M.; Zhang, Zhihui; Kitchen, Jonathan A.; Goldup, Stephen M.; Roessler, Maxie M. Rotaxane-Based Transition Metal Complexes: Effect of the Mechanical Bond on Structure and Electronic Properties. Journal of the American Chemical Society, 2019, 141, 879-889 |
4133366 | CIF | C84 H1092 Ce8 Mo256 N42 Na6 O1270 | P 1 | 31.5083; 31.9261; 41.4205 111.747; 91.181; 100.746 | 37838 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133367 | CIF | C110 H608 Mo154 N20 Na8 O716 | C 1 2/m 1 | 36.286; 43.194; 31.497 90; 108.25; 90 | 46883 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133368 | CIF | C48 H546 Ce4 Mo132 N24 O643 | P 21 21 2 | 35.3331; 47.455; 20.2692 90; 90; 90 | 33986 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133369 | CIF | C86 H534 Ce4 Mo124 N16 Na2 O604 | P 21 21 2 | 34.9681; 45.6548; 20.6531 90; 90; 90 | 32971.9 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133370 | CIF | C48 H604 Mo154 N24 Na4 O732 | C 1 2/m 1 | 36.1521; 43.2693; 31.4909 90; 107.595; 90 | 46956 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133371 | CIF | C86 H534 Ce4 Mo124 N16 Na2 O604 | P 21 21 2 | 34.961; 45.659; 20.6838 90; 90; 90 | 33017 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133372 | CIF | C48 H546 Ce4 Mo132 N24 O643 | P 21 21 2 | 35.356; 47.448; 20.2608 90; 90; 90 | 33989 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133373 | CIF | C36 H552 Ce4 Mo124 N24 O612 | P 21 21 2 | 35.219; 44.928; 20.818 90; 90; 90 | 32941 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133374 | CIF | C36 H552 Ce4 Mo124 N24 O612 | P 21 21 2 | 35.056; 45.188; 20.8435 90; 90; 90 | 33018 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133375 | CIF | C36 H508 Ce4 Mo132 N18 O629 | P 1 2 1 | 39.73; 20.462; 40.363 90; 90.8; 90 | 32810 | Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids. Journal of the American Chemical Society, 2019, 141, 1242-1250 |
4133415 | CIF | C30.5 H19 Cl | C 1 2/c 1 | 20.962; 12.826; 18.178 90; 110.79; 90 | 4569.1 | Zhou, Weixiang; Shen, Han; Wu, Chenyu; Tu, Zeyi; He, Feng; Gu, Yanan; Xue, Yurui; Zhao, Yingjie; Yi, Yuanping; Li, Yongjun; Li, Yuliang Direct Synthesis of Crystalline Graphdiyne Analogue Based on Supramolecular Interactions. Journal of the American Chemical Society, 2019, 141, 48-52 |
4133416 | CIF | C28 H18 | P 1 21/c 1 | 15.289; 13.561; 9.488 90; 95.023; 90 | 1959.6 | Zhou, Weixiang; Shen, Han; Wu, Chenyu; Tu, Zeyi; He, Feng; Gu, Yanan; Xue, Yurui; Zhao, Yingjie; Yi, Yuanping; Li, Yongjun; Li, Yuliang Direct Synthesis of Crystalline Graphdiyne Analogue Based on Supramolecular Interactions. Journal of the American Chemical Society, 2019, 141, 48-52 |
4133434 | CIF | C120 H90 Au25 N S2.2 Se15.8 | P -1 | 16.587; 20.288; 23.765 83.27; 80.28; 81.98 | 7769 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133435 | CIF | C125 H90 Au25 N S2.22 Se15.78 | P -1 | 16.612; 20.297; 23.736 83.17; 80.2; 81.91 | 7771 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133436 | CIF | C123 H90 Au25 N S2.97 Se15.03 | P -1 | 16.597; 20.304; 23.758 83.35; 80.26; 81.89 | 7777 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133437 | CIF | C129 H90 Au25 N S1.35 Se16.65 | P -1 | 16.555; 20.257; 23.831 83.18; 80.08; 81.7 | 7754 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133438 | CIF | C128 H90 Au25 N S1.21 Se16.79 | P -1 | 16.55; 20.272; 23.826 83.16; 80.06; 81.68 | 7754 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133439 | CIF | C131 H90 Au25 N S1.19 Se16.81 | P -1 | 16.558; 20.277; 23.823 83.13; 80.1; 81.66 | 7759 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133440 | CIF | C123 H90 Au25 N S3.12 Se14.88 | P -1 | 17.09; 20.273; 26.125 74.45; 73.34; 67.65 | 7890 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133441 | CIF | C120 H90 Au25 N S2.79 Se15.21 | P -1 | 17.091; 20.257; 26.102 74.39; 73.37; 67.63 | 7875 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133442 | CIF | C108 H90 Au25 S2.38 Se15.62 | P -1 | 16.615; 16.617; 16.798 70.27; 74.99; 62.56 | 3844.6 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133443 | CIF | C108 H90 Au25 S2.36 Se15.64 | P -1 | 16.638; 16.653; 16.868 70.3; 74.97; 62.52 | 3873.4 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133444 | CIF | C133 H90 Au25 N S1.36 Se16.64 | P -1 | 16.548; 20.264; 23.797 83.25; 80.14; 81.74 | 7745 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133445 | CIF | C122 H90 Au25 N S1.34 Se16.66 | P -1 | 16.552; 20.297; 23.828 83.14; 80.05; 81.62 | 7764 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133446 | CIF | C124 H90 Au25 N S1.34 Se16.66 | P -1 | 16.574; 20.332; 23.845 83.19; 79.85; 81.5 | 7787 | Hosier, Christopher A.; Ackerson, Christopher J. Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters. Journal of the American Chemical Society, 2019, 141, 309-314 |
4133467 | CIF | C16 H20 Cl O2 P | P 21 21 21 | 9.559; 16.4554; 20.1613 90; 90; 90 | 3171.3 | Siebert, Max; Seibicke, Max; Siegle, Alexander F.; Kräh, Sabrina; Trapp, Oliver Selective Ruthenium-Catalyzed Transformation of Carbon Dioxide: An Alternative Approach toward Formaldehyde. Journal of the American Chemical Society, 2019, 141, 334-341 |
4133468 | CIF | C57.21 H72.43 Cl0.43 N P3 | P 1 21/n 1 | 16.4485; 32.1049; 19.4326 90; 95.256; 90 | 10218.8 | Siebert, Max; Seibicke, Max; Siegle, Alexander F.; Kräh, Sabrina; Trapp, Oliver Selective Ruthenium-Catalyzed Transformation of Carbon Dioxide: An Alternative Approach toward Formaldehyde. Journal of the American Chemical Society, 2019, 141, 334-341 |
4133469 | CIF | C45 H48 N O2.63 P3 | P 1 21/n 1 | 14.4125; 11.9967; 23.2456 90; 102.13; 90 | 3929.5 | Siebert, Max; Seibicke, Max; Siegle, Alexander F.; Kräh, Sabrina; Trapp, Oliver Selective Ruthenium-Catalyzed Transformation of Carbon Dioxide: An Alternative Approach toward Formaldehyde. Journal of the American Chemical Society, 2019, 141, 334-341 |
4133470 | CIF | C50 H55 Cl3 N P3 Ru | P -1 | 10.4191; 12.8274; 18.6751 97.428; 98.167; 109.249 | 2290.7 | Siebert, Max; Seibicke, Max; Siegle, Alexander F.; Kräh, Sabrina; Trapp, Oliver Selective Ruthenium-Catalyzed Transformation of Carbon Dioxide: An Alternative Approach toward Formaldehyde. Journal of the American Chemical Society, 2019, 141, 334-341 |
4133472 | CIF | C30 H25 F6 N4 O P Ru S | P -1 | 9.1748; 12.0308; 15.151 95.641; 98.831; 109.006 | 1542.65 | Lameijer, Lucien N.; van de Griend, Corjan; Hopkins, Samantha L.; Volbeda, Anne-Geert; Askes, Sven H. C.; Siegler, Maxime A.; Bonnet, Sylvestre Photochemical Resolution of a Thermally Inert Cyclometalated Ru(phbpy)(N-N)(Sulfoxide)<sup>+</sup> Complex. Journal of the American Chemical Society, 2019, 141, 352-362 |
4133473 | CIF | C36 H27 Cl0.24 F4.53 N6 O P0.76 Ru S | C 1 2/c 1 | 15.6544; 38.0206; 14.7943 90; 116.312; 90 | 7893.1 | Lameijer, Lucien N.; van de Griend, Corjan; Hopkins, Samantha L.; Volbeda, Anne-Geert; Askes, Sven H. C.; Siegler, Maxime A.; Bonnet, Sylvestre Photochemical Resolution of a Thermally Inert Cyclometalated Ru(phbpy)(N-N)(Sulfoxide)<sup>+</sup> Complex. Journal of the American Chemical Society, 2019, 141, 352-362 |
4133474 | CIF | C28 H25 F6 N4 O P Ru S | P 1 21/c 1 | 16.488; 10.0475; 18.4299 90; 116.276; 90 | 2737.68 | Lameijer, Lucien N.; van de Griend, Corjan; Hopkins, Samantha L.; Volbeda, Anne-Geert; Askes, Sven H. C.; Siegler, Maxime A.; Bonnet, Sylvestre Photochemical Resolution of a Thermally Inert Cyclometalated Ru(phbpy)(N-N)(Sulfoxide)<sup>+</sup> Complex. Journal of the American Chemical Society, 2019, 141, 352-362 |
4133475 | CIF | C32 H25 F6 N6 O P Ru S | P -1 | 15.1228; 16.8679; 25.1053 100.234; 90.1903; 104.221 | 6101.7 | Lameijer, Lucien N.; van de Griend, Corjan; Hopkins, Samantha L.; Volbeda, Anne-Geert; Askes, Sven H. C.; Siegler, Maxime A.; Bonnet, Sylvestre Photochemical Resolution of a Thermally Inert Cyclometalated Ru(phbpy)(N-N)(Sulfoxide)<sup>+</sup> Complex. Journal of the American Chemical Society, 2019, 141, 352-362 |
4133480 | CIF | C146 H192 Li2 O16 | P 1 21/c 1 | 13.2397; 30.39; 15.9976 90; 105.737; 90 | 6195.4 | Dong, Shaoqiang; Gopalakrishna, Tullimilli Y.; Han, Yi; Phan, Hoa; Tao, Tao; Ni, Yong; Liu, Gang; Chi, Chunyan Extended Bis(anthraoxa)quinodimethanes with Nine and Ten Consecutively Fused Six-Membered Rings: Neutral Diradicaloids and Charged Diradical Dianions/Dications. Journal of the American Chemical Society, 2019, 141, 62-66 |
4133481 | CIF | C118 H104 F6 O6 | P -1 | 7.6416; 15.0479; 23.3547 89.396; 86.094; 83.812 | 2663.69 | Dong, Shaoqiang; Gopalakrishna, Tullimilli Y.; Han, Yi; Phan, Hoa; Tao, Tao; Ni, Yong; Liu, Gang; Chi, Chunyan Extended Bis(anthraoxa)quinodimethanes with Nine and Ten Consecutively Fused Six-Membered Rings: Neutral Diradicaloids and Charged Diradical Dianions/Dications. Journal of the American Chemical Society, 2019, 141, 62-66 |
4133482 | CIF | C178 H234 Li2 O18 | P -1 | 14.0023; 17.9457; 18.3619 116.776; 100.802; 99.945 | 3868.4 | Dong, Shaoqiang; Gopalakrishna, Tullimilli Y.; Han, Yi; Phan, Hoa; Tao, Tao; Ni, Yong; Liu, Gang; Chi, Chunyan Extended Bis(anthraoxa)quinodimethanes with Nine and Ten Consecutively Fused Six-Membered Rings: Neutral Diradicaloids and Charged Diradical Dianions/Dications. Journal of the American Chemical Society, 2019, 141, 62-66 |
4133483 | CIF | C96 H94 O2 | P -1 | 12.7262; 14.1728; 22.2771 82.881; 75.763; 65.38 | 3539.5 | Dong, Shaoqiang; Gopalakrishna, Tullimilli Y.; Han, Yi; Phan, Hoa; Tao, Tao; Ni, Yong; Liu, Gang; Chi, Chunyan Extended Bis(anthraoxa)quinodimethanes with Nine and Ten Consecutively Fused Six-Membered Rings: Neutral Diradicaloids and Charged Diradical Dianions/Dications. Journal of the American Chemical Society, 2019, 141, 62-66 |
4133485 | CIF | C144 H244 N28 O63 | P 1 21 1 | 8.9084; 39.9686; 13.1196 90; 109.252; 90 | 4410.1 | Mondal, Sudipta; Jacoby, Guy; Sawaya, Michael R.; Arnon, Zohar A.; Adler-Abramovich, Lihi; Rehak, Pavel; Vuković, Lela; Shimon, Linda J. W.; Král, Petr; Beck, Roy; Gazit, Ehud Transition of Metastable Cross-α Crystals into Cross-β Fibrils by β-Turn Flipping. Journal of the American Chemical Society, 2019, 141, 363-369 |
4133510 | CIF | C101 H81 F24 N8 P4 | P -1 | 10.6321; 21.0128; 22.5307 98.837; 103.69; 102.785 | 4655.3 | Wu, Huang; Chen, Yong; Zhang, Long; Anamimoghadam, Ommid; Shen, Dengke; Liu, Zhichang; Cai, Kang; Pezzato, Cristian; Stern, Charlotte L.; Liu, Yu; Stoddart, J. Fraser A Dynamic Tetracationic Macrocycle Exhibiting Photoswitchable Molecular Encapsulation. Journal of the American Chemical Society, 2019, 141, 1280-1289 |
4133511 | CIF | C62 H54 F24 N6 P4 | C 1 2/c 1 | 32.128; 40.07; 12.3508 90; 99.299; 90 | 15691 | Wu, Huang; Chen, Yong; Zhang, Long; Anamimoghadam, Ommid; Shen, Dengke; Liu, Zhichang; Cai, Kang; Pezzato, Cristian; Stern, Charlotte L.; Liu, Yu; Stoddart, J. Fraser A Dynamic Tetracationic Macrocycle Exhibiting Photoswitchable Molecular Encapsulation. Journal of the American Chemical Society, 2019, 141, 1280-1289 |
4133512 | CIF | C76 H58 F24 N4 O2 P4 | I 41 m d | 17.802; 17.802; 26.606 90; 90; 90 | 8432 | Wu, Huang; Chen, Yong; Zhang, Long; Anamimoghadam, Ommid; Shen, Dengke; Liu, Zhichang; Cai, Kang; Pezzato, Cristian; Stern, Charlotte L.; Liu, Yu; Stoddart, J. Fraser A Dynamic Tetracationic Macrocycle Exhibiting Photoswitchable Molecular Encapsulation. Journal of the American Chemical Society, 2019, 141, 1280-1289 |
4133513 | CIF | C94 H80 F24 N8 P4 | P -1 | 10.3102; 11.1967; 21.5627 79.7093; 86.3983; 64.3662 | 2207.8 | Wu, Huang; Chen, Yong; Zhang, Long; Anamimoghadam, Ommid; Shen, Dengke; Liu, Zhichang; Cai, Kang; Pezzato, Cristian; Stern, Charlotte L.; Liu, Yu; Stoddart, J. Fraser A Dynamic Tetracationic Macrocycle Exhibiting Photoswitchable Molecular Encapsulation. Journal of the American Chemical Society, 2019, 141, 1280-1289 |
4133514 | CIF | C60 H51 F24 N5 P4 | P 1 21/c 1 | 19.84; 12.3137; 14.4575 90; 105.945; 90 | 3396.1 | Wu, Huang; Chen, Yong; Zhang, Long; Anamimoghadam, Ommid; Shen, Dengke; Liu, Zhichang; Cai, Kang; Pezzato, Cristian; Stern, Charlotte L.; Liu, Yu; Stoddart, J. Fraser A Dynamic Tetracationic Macrocycle Exhibiting Photoswitchable Molecular Encapsulation. Journal of the American Chemical Society, 2019, 141, 1280-1289 |
4133515 | CIF | C72 H56 F24 N4 O2 P4 | P 1 21/c 1 | 19.8606; 12.2479; 14.4094 90; 105.31; 90 | 3380.7 | Wu, Huang; Chen, Yong; Zhang, Long; Anamimoghadam, Ommid; Shen, Dengke; Liu, Zhichang; Cai, Kang; Pezzato, Cristian; Stern, Charlotte L.; Liu, Yu; Stoddart, J. Fraser A Dynamic Tetracationic Macrocycle Exhibiting Photoswitchable Molecular Encapsulation. Journal of the American Chemical Society, 2019, 141, 1280-1289 |
4133526 | CIF | C14 H11 P | F m m 2 | 9.5932; 16.8116; 6.1756 90; 90; 90 | 995.98 | Transue, Wesley J.; Nava, Matthew; Terban, Maxwell W.; Yang, Jing; Greenberg, Matthew W.; Wu, Gang; Foreman, Elizabeth S.; Mustoe, Chantal L.; Kennepohl, Pierre; Owen, Jonathan S.; Billinge, Simon J. L.; Kulik, Heather J.; Cummins, Christopher C. Anthracene as a Launchpad for a Phosphinidene Sulfide and for Generation of a Phosphorus-Sulfur Material Having the Composition P<sub>2</sub>S, a Vulcanized Red Phosphorus That Is Yellow. Journal of the American Chemical Society, 2019, 141, 431-440 |
4133527 | CIF | C44 H49 O P3 Pt S | P 1 21/n 1 | 16.375; 10.7086; 22.9666 90; 100.066; 90 | 3965.3 | Transue, Wesley J.; Nava, Matthew; Terban, Maxwell W.; Yang, Jing; Greenberg, Matthew W.; Wu, Gang; Foreman, Elizabeth S.; Mustoe, Chantal L.; Kennepohl, Pierre; Owen, Jonathan S.; Billinge, Simon J. L.; Kulik, Heather J.; Cummins, Christopher C. Anthracene as a Launchpad for a Phosphinidene Sulfide and for Generation of a Phosphorus-Sulfur Material Having the Composition P<sub>2</sub>S, a Vulcanized Red Phosphorus That Is Yellow. Journal of the American Chemical Society, 2019, 141, 431-440 |
4133528 | CIF | C14 H11 P S | P n a 21 | 8.3118; 22.2656; 6.2032 90; 90; 90 | 1148.01 | Transue, Wesley J.; Nava, Matthew; Terban, Maxwell W.; Yang, Jing; Greenberg, Matthew W.; Wu, Gang; Foreman, Elizabeth S.; Mustoe, Chantal L.; Kennepohl, Pierre; Owen, Jonathan S.; Billinge, Simon J. L.; Kulik, Heather J.; Cummins, Christopher C. Anthracene as a Launchpad for a Phosphinidene Sulfide and for Generation of a Phosphorus-Sulfur Material Having the Composition P<sub>2</sub>S, a Vulcanized Red Phosphorus That Is Yellow. Journal of the American Chemical Society, 2019, 141, 431-440 |
4133547 | CIF | C20 H16 Br Cl N2 O3 | P 21 21 21 | 10.3858; 11.1289; 17.4363 90; 90; 90 | 2015.33 | Xiong, Yang; Du, Zhuanzhuan; Chen, Haohua; Yang, Zhao; Tan, Qiuyuan; Zhang, Changhui; Zhu, Lei; Lan, Yu; Zhang, Min Well-Designed Phosphine-Urea Ligand for Highly Diastereo- and Enantioselective 1,3-Dipolar Cycloaddition of Methacrylonitrile: A Combined Experimental and Theoretical Study. Journal of the American Chemical Society, 2019, 141, 961-971 |
4133548 | CIF | C21 H21 Br N2 O4 S | P 1 21 1 | 9.133; 12.6163; 10.2204 90; 113.676; 90 | 1078.52 | Xiong, Yang; Du, Zhuanzhuan; Chen, Haohua; Yang, Zhao; Tan, Qiuyuan; Zhang, Changhui; Zhu, Lei; Lan, Yu; Zhang, Min Well-Designed Phosphine-Urea Ligand for Highly Diastereo- and Enantioselective 1,3-Dipolar Cycloaddition of Methacrylonitrile: A Combined Experimental and Theoretical Study. Journal of the American Chemical Society, 2019, 141, 961-971 |
4133549 | CIF | C20 H20 N2 O2 | P 1 21 1 | 9.3729; 11.919; 15.7115 90; 90.581; 90 | 1755.1 | Xiong, Yang; Du, Zhuanzhuan; Chen, Haohua; Yang, Zhao; Tan, Qiuyuan; Zhang, Changhui; Zhu, Lei; Lan, Yu; Zhang, Min Well-Designed Phosphine-Urea Ligand for Highly Diastereo- and Enantioselective 1,3-Dipolar Cycloaddition of Methacrylonitrile: A Combined Experimental and Theoretical Study. Journal of the American Chemical Society, 2019, 141, 961-971 |
4133550 | CIF | C13 H13 Br N2 O2 | P 1 21 1 | 10.4672; 5.745; 11.4377 90; 110.754; 90 | 643.16 | Xiong, Yang; Du, Zhuanzhuan; Chen, Haohua; Yang, Zhao; Tan, Qiuyuan; Zhang, Changhui; Zhu, Lei; Lan, Yu; Zhang, Min Well-Designed Phosphine-Urea Ligand for Highly Diastereo- and Enantioselective 1,3-Dipolar Cycloaddition of Methacrylonitrile: A Combined Experimental and Theoretical Study. Journal of the American Chemical Society, 2019, 141, 961-971 |
4133551 | CIF | C14 H15 Br N2 O2 | P 1 21 1 | 10.3489; 6.3912; 11.1677 90; 94.707; 90 | 736.16 | Xiong, Yang; Du, Zhuanzhuan; Chen, Haohua; Yang, Zhao; Tan, Qiuyuan; Zhang, Changhui; Zhu, Lei; Lan, Yu; Zhang, Min Well-Designed Phosphine-Urea Ligand for Highly Diastereo- and Enantioselective 1,3-Dipolar Cycloaddition of Methacrylonitrile: A Combined Experimental and Theoretical Study. Journal of the American Chemical Society, 2019, 141, 961-971 |
4133552 | CIF | C84 H36 O32 Zr6 | F d -3 m :2 | 44.655; 44.655; 44.655 90; 90; 90 | 89045 | Qin, Jun-Sheng; Yuan, Shuai; Zhang, Lei; Li, Bao; Du, Dong-Ying; Huang, Ning; Guan, Wei; Drake, Hannah F.; Pang, Jiandong; Lan, Ya-Qian; Alsalme, Ali; Zhou, Hong-Cai Creating Well-Defined Hexabenzocoronene in Zirconium Metal-Organic Framework by Postsynthetic Annulation. Journal of the American Chemical Society, 2019, 141, 2054-2060 |
4133567 | CIF | C62.5 H42.5 Cl1.5 N6 O12 | P 21 21 2 | 30.418; 31.784; 12.38 90; 90; 90 | 11969 | Mohan Nalluri, Siva Krishna; Zhou, Jiawang; Cheng, Tao; Liu, Zhichang; Nguyen, Minh T.; Chen, Tianyang; Patel, Hasmukh A.; Krzyaniak, Matthew D.; Goddard, 3rd, William A; Wasielewski, Michael R.; Stoddart, J. Fraser Discrete Dimers of Redox-Active and Fluorescent Perylene Diimide-Based Rigid Isosceles Triangles in the Solid State. Journal of the American Chemical Society, 2019, 141, 1290-1303 |
4133568 | CIF | C62 H42 N6 O12 | P 21 21 2 | 30.3071; 32.069; 12.6054 90; 90; 90 | 12251.4 | Mohan Nalluri, Siva Krishna; Zhou, Jiawang; Cheng, Tao; Liu, Zhichang; Nguyen, Minh T.; Chen, Tianyang; Patel, Hasmukh A.; Krzyaniak, Matthew D.; Goddard, 3rd, William A; Wasielewski, Michael R.; Stoddart, J. Fraser Discrete Dimers of Redox-Active and Fluorescent Perylene Diimide-Based Rigid Isosceles Triangles in the Solid State. Journal of the American Chemical Society, 2019, 141, 1290-1303 |
4133569 | CIF | C72.5 H48.5 Cl7.5 N6 O12 | C 1 2 1 | 43.1347; 14.6175; 24.2886 90; 102.937; 90 | 14925.8 | Mohan Nalluri, Siva Krishna; Zhou, Jiawang; Cheng, Tao; Liu, Zhichang; Nguyen, Minh T.; Chen, Tianyang; Patel, Hasmukh A.; Krzyaniak, Matthew D.; Goddard, 3rd, William A; Wasielewski, Michael R.; Stoddart, J. Fraser Discrete Dimers of Redox-Active and Fluorescent Perylene Diimide-Based Rigid Isosceles Triangles in the Solid State. Journal of the American Chemical Society, 2019, 141, 1290-1303 |
4133570 | CIF | C131.3 H100.6 Cl1.3 N12 O24 | P 21 21 2 | 30.1044; 31.9984; 12.4179 90; 90; 90 | 11962.1 | Mohan Nalluri, Siva Krishna; Zhou, Jiawang; Cheng, Tao; Liu, Zhichang; Nguyen, Minh T.; Chen, Tianyang; Patel, Hasmukh A.; Krzyaniak, Matthew D.; Goddard, 3rd, William A; Wasielewski, Michael R.; Stoddart, J. Fraser Discrete Dimers of Redox-Active and Fluorescent Perylene Diimide-Based Rigid Isosceles Triangles in the Solid State. Journal of the American Chemical Society, 2019, 141, 1290-1303 |
4133573 | CIF | C114 H169 Cl6 N19 Ni4 | P c a 21 | 28.293; 12.726; 33.847 90; 90; 90 | 12187 | Sun, Rui; Qin, Yangzhong; Ruccolo, Serge; Schnedermann, Christoph; Costentin, Cyrille; Daniel G Nocera, ? Elucidation of a Redox-Mediated Reaction Cycle for Nickel-Catalyzed Cross Coupling. Journal of the American Chemical Society, 2019, 141, 89-93 |
4133586 | CIF | C35 H31 N O8 | C 1 2/c 1 | 26.6128; 10.402; 21.364 90; 94.776; 90 | 5893.6 | Zhang, Wenhan; Liu, Shufeng; Maiga, Rayelle I.; Pelletier, Jerry; Brown, Lauren E.; Wang, Tony T.; Porco, Jr, John A Chemical Synthesis Enables Structural Reengineering of Aglaroxin C Leading to Inhibition Bias for Hepatitis C Viral Infection. Journal of the American Chemical Society, 2019, 141, 1312-1323 |
4133587 | CIF | C18 H16 N2 O4 S2 | P 1 21/c 1 | 8.1317; 16.5366; 13.5858 90; 99.897; 90 | 1799.7 | Zhu, Xiaotao; Deng, Weili; Chiou, Mong-Feng; Ye, Changqing; Jian, Wujun; Zeng, Yuehua; Jiao, Yihang; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli Copper-Catalyzed Radical 1,4-Difunctionalization of 1,3-Enynes with Alkyl Diacyl Peroxides and N-Fluorobenzenesulfonimide. Journal of the American Chemical Society, 2019, 141, 548-559 |
4133588 | CIF | C27 H24 N2 O4 S2 | P 1 21/c 1 | 9.5006; 24.2369; 10.9473 90; 104.554; 90 | 2439.9 | Zhu, Xiaotao; Deng, Weili; Chiou, Mong-Feng; Ye, Changqing; Jian, Wujun; Zeng, Yuehua; Jiao, Yihang; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli Copper-Catalyzed Radical 1,4-Difunctionalization of 1,3-Enynes with Alkyl Diacyl Peroxides and N-Fluorobenzenesulfonimide. Journal of the American Chemical Society, 2019, 141, 548-559 |
4133589 | CIF | C30 H28.5 Br Cl2 N2.5 O4 S2 | P -1 | 7.159; 12.789; 17.774 95.896; 98.227; 94.371 | 1595.2 | Zhu, Xiaotao; Deng, Weili; Chiou, Mong-Feng; Ye, Changqing; Jian, Wujun; Zeng, Yuehua; Jiao, Yihang; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli Copper-Catalyzed Radical 1,4-Difunctionalization of 1,3-Enynes with Alkyl Diacyl Peroxides and N-Fluorobenzenesulfonimide. Journal of the American Chemical Society, 2019, 141, 548-559 |
4133590 | CIF | C15 H16 Cl N O | P n a 21 | 22.96; 11.149; 10.666 90; 90; 90 | 2730.3 | Zhu, Xiaotao; Deng, Weili; Chiou, Mong-Feng; Ye, Changqing; Jian, Wujun; Zeng, Yuehua; Jiao, Yihang; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli Copper-Catalyzed Radical 1,4-Difunctionalization of 1,3-Enynes with Alkyl Diacyl Peroxides and N-Fluorobenzenesulfonimide. Journal of the American Chemical Society, 2019, 141, 548-559 |
4133591 | CIF | C27 H24 N2 O4 S2 | P 1 21/c 1 | 10.112; 24.264; 11.299 90; 112.743; 90 | 2556.7 | Zhu, Xiaotao; Deng, Weili; Chiou, Mong-Feng; Ye, Changqing; Jian, Wujun; Zeng, Yuehua; Jiao, Yihang; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli Copper-Catalyzed Radical 1,4-Difunctionalization of 1,3-Enynes with Alkyl Diacyl Peroxides and N-Fluorobenzenesulfonimide. Journal of the American Chemical Society, 2019, 141, 548-559 |
4133592 | CIF | C27 H24 N2 O4 S2 | P c a 21 | 20.66; 10.256; 25.26 90; 90; 90 | 5352 | Zhu, Xiaotao; Deng, Weili; Chiou, Mong-Feng; Ye, Changqing; Jian, Wujun; Zeng, Yuehua; Jiao, Yihang; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli Copper-Catalyzed Radical 1,4-Difunctionalization of 1,3-Enynes with Alkyl Diacyl Peroxides and N-Fluorobenzenesulfonimide. Journal of the American Chemical Society, 2019, 141, 548-559 |
4133593 | CIF | C18 H14 Cl2 O2 | P 1 21/c 1 | 18.1358; 22.5942; 7.6401 90; 98.3549; 90 | 3097.4 | Kreuzahler, Mathis; Daniels, Alyssa; Wölper, Christoph; Haberhauer, Gebhard 1,3-Chlorine Shift to a Vinyl Cation: A Combined Experimental and Theoretical Investigation of the E-Selective Gold(I)-Catalyzed Dimerization of Chloroacetylenes. Journal of the American Chemical Society, 2019, 141, 1337-1348 |
4133597 | CIF | C282 H0 Cu24 N10 O150 | P n n m | 41.66; 23.73; 30.69 90; 90; 90 | 30340 | Lal, Garima; Derakhshandeh, Maziar; Akhtar, Farid; Spasyuk, Denis M.; Lin, Jian-Bin; Trifkovic, Milana; Shimizu, George K. H. Mechanical Properties of a Metal-Organic Framework formed by Covalent Cross-Linking of Metal-Organic Polyhedra. Journal of the American Chemical Society, 2019, 141, 1045-1053 |
4133598 | CIF | C41 H40 O S | P 1 n 1 | 8.16835; 12.1102; 32.7192 90; 91.3026; 90 | 3235.76 | Konishi, Akihito; Okada, Yui; Kishi, Ryohei; Nakano, Masayoshi; Yasuda, Makoto Enhancement of Antiaromatic Character via Additional Benzoannulation into Dibenzo[ a, f]pentalene: Syntheses and Properties of Benzo[ a]naphtho[2,1- f]pentalene and Dinaphtho[2,1- a, f]pentalene. Journal of the American Chemical Society, 2019, 141, 560-571 |
4133599 | CIF | C44 H40 Cl4 | P -1 | 9.1358; 12.4711; 16.4639 104.008; 92.5124; 98.3058 | 1794.84 | Konishi, Akihito; Okada, Yui; Kishi, Ryohei; Nakano, Masayoshi; Yasuda, Makoto Enhancement of Antiaromatic Character via Additional Benzoannulation into Dibenzo[ a, f]pentalene: Syntheses and Properties of Benzo[ a]naphtho[2,1- f]pentalene and Dinaphtho[2,1- a, f]pentalene. Journal of the American Chemical Society, 2019, 141, 560-571 |
4133600 | CIF | C42 H34 | P n a 21 | 8.1411; 25.1404; 14.1594 90; 90; 90 | 2898.01 | Konishi, Akihito; Okada, Yui; Kishi, Ryohei; Nakano, Masayoshi; Yasuda, Makoto Enhancement of Antiaromatic Character via Additional Benzoannulation into Dibenzo[ a, f]pentalene: Syntheses and Properties of Benzo[ a]naphtho[2,1- f]pentalene and Dinaphtho[2,1- a, f]pentalene. Journal of the American Chemical Society, 2019, 141, 560-571 |
4133602 | CIF | C45 H58 Cl2 Ge N4 O Si2 | P c a 21 | 18.8289; 15.5259; 17.5625 90; 90; 90 | 5134.14 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133603 | CIF | C90 H116 Ge2 N8 O2 Si4 | P 1 21/c 1 | 19.1807; 27.2268; 18.064 90; 110.913; 90 | 8812.1 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133604 | CIF | C49 H68 Al Br3 Ge N4 O2 Si2 | P b c a | 15.8154; 21.7298; 31.6007 90; 90; 90 | 10860.1 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133605 | CIF | C45 H58 Al2 Br6 Ge N4 O Si2 | P 1 21 1 | 11.4436; 22.3224; 13.7102 90; 102.777; 90 | 3415.53 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133606 | CIF | C53 H73 B Ge N4 O Si2 | C 1 2/c 1 | 27.1176; 10.0166; 39.9984 90; 107.426; 90 | 10366 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133607 | CIF | C94 H126 Ge2 N8 Ni O3 Si4 | P -1 | 15.2538; 15.9869; 21.3147 82.753; 85.315; 62.81 | 4584.8 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133608 | CIF | C63 H74 B Ge N4 O Si2 | P -1 | 9.0383; 18.6293; 18.9925 112.389; 91.666; 94.184 | 2943.35 | Wang, Yuwen; Karni, Miriam; Yao, Shenglai; Apeloig, Yitzhak; Driess, Matthias An Isolable Bis(silylene)-Stabilized Germylone and Its Reactivity. Journal of the American Chemical Society, 2019, 141, 1655-1664 |
4133615 | CIF | C270 H240 N105 O87.75 S30 | P 21 21 2 | 100.02; 18.644; 29.23 90; 90; 90 | 54507 | Liu, Bin; Pappas, Charalampos G.; Zangrando, Ennio; Demitri, Nicola; Chmielewski, Piotr J.; Otto, Sijbren Complex Molecules That Fold Like Proteins Can Emerge Spontaneously. Journal of the American Chemical Society, 2019, 141, 1685-1689 |
4133616 | CIF | C31 H31 N O3 | P -1 | 8.2078; 9.4326; 16.1782 102.743; 104.147; 97.677 | 1161.12 | Alachouzos, Georgios; Frontier, Alison J. Cationic Cascade for Building Complex Polycyclic Molecules from Simple Precursors: Diastereoselective Installation of Three Contiguous Stereogenic Centers in a One-Pot Process. Journal of the American Chemical Society, 2019, 141, 118-122 |
4133617 | CIF | C25 H20 Cl3 F3 N2 O4 | P 6 | 22.0755; 22.0755; 10.0326 90; 90; 120 | 4234.14 | Lin, Jin-Shun; Li, Tao-Tao; Liu, Ji-Ren; Jiao, Guan-Yuan; Gu, Qiang-Shuai; Cheng, Jiang-Tao; Guo, Yu-Long; Hong, Xin; Liu, Xin-Yuan Cu/Chiral Phosphoric Acid-Catalyzed Asymmetric Three-Component Radical-Initiated 1,2-Dicarbofunctionalization of Alkenes. Journal of the American Chemical Society, 2019, 141, 1074-1083 |
4133618 | CIF | C45 H50 Cl6 N6 O2 | P 21 21 21 | 14.55; 24.8696; 25.0479 90; 90; 90 | 9063.6 | Yousefi, Roozbeh; Struble, Thomas J.; Payne, Jenna L.; Vishe, Mahesh; Schley, Nathan D.; Johnston, Jeffrey N. Catalytic, Enantioselective Synthesis of Cyclic Carbamates from Dialkyl Amines by CO<sub>2</sub>-Capture: Discovery, Development, and Mechanism. Journal of the American Chemical Society, 2019, 141, 618-625 |
4133619 | CIF | C19 H17 F3 I N O2 | P 21 21 21 | 7.8606; 9.1352; 25.0134 90; 90; 90 | 1796.17 | Yousefi, Roozbeh; Struble, Thomas J.; Payne, Jenna L.; Vishe, Mahesh; Schley, Nathan D.; Johnston, Jeffrey N. Catalytic, Enantioselective Synthesis of Cyclic Carbamates from Dialkyl Amines by CO<sub>2</sub>-Capture: Discovery, Development, and Mechanism. Journal of the American Chemical Society, 2019, 141, 618-625 |
4133620 | CIF | C36 H45 Cl N2 O | P -1 | 10.666; 12.0616; 15.045 92.005; 110.621; 115.023 | 1602.4 | Regnier, Vianney; Romero, Erik A.; Molton, Florian; Jazzar, Rodolphe; Bertrand, Guy; Martin, David What Are the Radical Intermediates in Oxidative N-Heterocyclic Carbene Organocatalysis? Journal of the American Chemical Society, 2019, 141, 1109-1117 |
4133621 | CIF | C32 H43 Cl4 N O | P 1 21/n 1 | 13.0915; 16.6801; 17.3486 90; 101.572; 90 | 3711.4 | Regnier, Vianney; Romero, Erik A.; Molton, Florian; Jazzar, Rodolphe; Bertrand, Guy; Martin, David What Are the Radical Intermediates in Oxidative N-Heterocyclic Carbene Organocatalysis? Journal of the American Chemical Society, 2019, 141, 1109-1117 |
4133622 | CIF | C38 H47 Cl4 N O | P n a 21 | 16.9668; 16.6522; 25.8421 90; 90; 90 | 7301.3 | Regnier, Vianney; Romero, Erik A.; Molton, Florian; Jazzar, Rodolphe; Bertrand, Guy; Martin, David What Are the Radical Intermediates in Oxidative N-Heterocyclic Carbene Organocatalysis? Journal of the American Chemical Society, 2019, 141, 1109-1117 |
4133623 | CIF | C37 H46 N O | C 1 2/c 1 | 29.5873; 9.0822; 23.4041 90; 103.805; 90 | 6107.4 | Regnier, Vianney; Romero, Erik A.; Molton, Florian; Jazzar, Rodolphe; Bertrand, Guy; Martin, David What Are the Radical Intermediates in Oxidative N-Heterocyclic Carbene Organocatalysis? Journal of the American Chemical Society, 2019, 141, 1109-1117 |
4133624 | CIF | C45 H55 N4 O Si2 | C 1 2/c 1 | 36.1038; 9.0432; 26.0806 90; 92.463; 90 | 8507.3 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133625 | CIF | C51 H68 N4 O4 Si2 | P 21 21 21 | 15.6523; 17.3543; 18.3413 90; 90; 90 | 4982.13 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133626 | CIF | C42 H54 Fe N4 O2 Si2 | P n m a | 16.8653; 24.8239; 9.3582 90; 90; 90 | 3917.9 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133627 | CIF | C54 H67 N5 O Si2 | P 1 21/n 1 | 16.8495; 13.9048; 22.1044 90; 106.452; 90 | 4966.8 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133628 | CIF | C69 H90 N6 O Si2 | P -1 | 12.8721; 13.2729; 20.801 102.478; 90.872; 116.307 | 3085.4 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133629 | CIF | C63 H76 N6 O Si2 | P -1 | 11.3993; 12.6636; 21.9289 80.018; 83.9; 63.968 | 2799.7 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133630 | CIF | C55 H67 N5 O2 Si2 | P b c a | 16.9921; 21.7092; 27.5293 90; 90; 90 | 10155.1 | Wang, Yuwen; Kostenko, Arseni; Hadlington, Terrance J.; Luecke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Silicon-Mediated Selective Homo- and Heterocoupling of Carbon Monoxide. Journal of the American Chemical Society, 2019, 141, 626-634 |
4133634 | CIF | C44 H18 Cl4 N12 O12 | C 1 2/c 1 | 28.286; 13.537; 16.108 90; 116.85; 90 | 5503 | Tuo, De-Hui; Liu, Wei; Wang, Xue-Yuan; Wang, Xu-Dong; Ao, Yu-Fei; Wang, Qi-Qiang; Li, Zhi-Yan; Wang, De-Xian Toward Anion-π Interactions Directed Self-Assembly with Predesigned Dual Macrocyclic Receptors and Dianions. Journal of the American Chemical Society, 2019, 141, 1118-1125 |
4133635 | CIF | C48 H20 Cl4 N12 O12 | P 1 2/n 1 | 16.2491; 13.0217; 26.5922 90; 96.52; 90 | 5590.3 | Tuo, De-Hui; Liu, Wei; Wang, Xue-Yuan; Wang, Xu-Dong; Ao, Yu-Fei; Wang, Qi-Qiang; Li, Zhi-Yan; Wang, De-Xian Toward Anion-π Interactions Directed Self-Assembly with Predesigned Dual Macrocyclic Receptors and Dianions. Journal of the American Chemical Society, 2019, 141, 1118-1125 |
4133636 | CIF | C118 H130 Cl4 N18 O32 S2 | P -1 | 18.522; 18.643; 19.169 87.147; 78.044; 85.787 | 6454 | Tuo, De-Hui; Liu, Wei; Wang, Xue-Yuan; Wang, Xu-Dong; Ao, Yu-Fei; Wang, Qi-Qiang; Li, Zhi-Yan; Wang, De-Xian Toward Anion-π Interactions Directed Self-Assembly with Predesigned Dual Macrocyclic Receptors and Dianions. Journal of the American Chemical Society, 2019, 141, 1118-1125 |
4133637 | CIF | C54 H26 Cl22 N12 O12 | P 1 21/c 1 | 10.035; 21.931; 17.509 90; 94.079; 90 | 3844 | Tuo, De-Hui; Liu, Wei; Wang, Xue-Yuan; Wang, Xu-Dong; Ao, Yu-Fei; Wang, Qi-Qiang; Li, Zhi-Yan; Wang, De-Xian Toward Anion-π Interactions Directed Self-Assembly with Predesigned Dual Macrocyclic Receptors and Dianions. Journal of the American Chemical Society, 2019, 141, 1118-1125 |
4133638 | CIF | C64 H54 Cl4 N18 O16 | P -1 | 12.036; 12.274; 13.289 82.49; 67.68; 67.96 | 1683.2 | Tuo, De-Hui; Liu, Wei; Wang, Xue-Yuan; Wang, Xu-Dong; Ao, Yu-Fei; Wang, Qi-Qiang; Li, Zhi-Yan; Wang, De-Xian Toward Anion-π Interactions Directed Self-Assembly with Predesigned Dual Macrocyclic Receptors and Dianions. Journal of the American Chemical Society, 2019, 141, 1118-1125 |
4133639 | CIF | C21 H28 N4 O Si | P -1 | 10.3674; 10.4431; 10.6187 85.78; 85.901; 63.71 | 1027 | Gu, Yiting; Shen, Yangyang; Zarate, Cayetana; Martin, Ruben A Mild and Direct Site-Selective sp<sup>2</sup> C-H Silylation of (Poly)Azines. Journal of the American Chemical Society, 2019, 141, 127-132 |
4133640 | CIF | C27 H45 N5 O2 Si | P -1 | 7.1983; 11.583; 17.2442 101.815; 94.813; 99.388 | 1378.2 | Gu, Yiting; Shen, Yangyang; Zarate, Cayetana; Martin, Ruben A Mild and Direct Site-Selective sp<sup>2</sup> C-H Silylation of (Poly)Azines. Journal of the American Chemical Society, 2019, 141, 127-132 |
4133641 | CIF | C20 H18 O4 | P 21 21 21 | 6.2545; 13.5393; 19.2401 90; 90; 90 | 1629.28 | Wei, Yi; Liu, Song; Li, Miao-Miao; Li, Yi; Lan, Yu; Lu, Liang-Qiu; Xiao, Wen-Jing Enantioselective Trapping of Pd-Containing 1,5-Dipoles by Photogenerated Ketenes: Access to 7-Membered Lactones Bearing Chiral Quaternary Stereocenters. Journal of the American Chemical Society, 2019, 141, 133-137 |
4133642 | CIF | C20 H22 Br N3 O7 | P 1 21/n 1 | 10.4462; 16.5828; 12.4288 90; 105.487; 90 | 2074.83 | Bingham, Tanner W.; Hernandez, Lucas W.; Olson, Daniel G.; Svec, Riley L.; Hergenrother, Paul J.; Sarlah, David Enantioselective Synthesis of Isocarbostyril Alkaloids and Analogs Using Catalytic Dearomative Functionalization of Benzene. Journal of the American Chemical Society, 2019, 141, 657-670 |
4133643 | CIF | C17 H17 Br2 N3 O5 | P 1 21/c 1 | 8.6131; 13.0876; 16.5039 90; 97.683; 90 | 1843.7 | Bingham, Tanner W.; Hernandez, Lucas W.; Olson, Daniel G.; Svec, Riley L.; Hergenrother, Paul J.; Sarlah, David Enantioselective Synthesis of Isocarbostyril Alkaloids and Analogs Using Catalytic Dearomative Functionalization of Benzene. Journal of the American Chemical Society, 2019, 141, 657-670 |
4133644 | CIF | C17 H19 N3 O6 | R 3 :H | 36.4159; 36.4159; 6.6637 90; 90; 120 | 7652.9 | Bingham, Tanner W.; Hernandez, Lucas W.; Olson, Daniel G.; Svec, Riley L.; Hergenrother, Paul J.; Sarlah, David Enantioselective Synthesis of Isocarbostyril Alkaloids and Analogs Using Catalytic Dearomative Functionalization of Benzene. Journal of the American Chemical Society, 2019, 141, 657-670 |
4133645 | CIF | C14 H15 N O7 | P 1 | 7.2381; 9.3207; 11.0024 67.514; 89.888; 75.525 | 660.42 | Bingham, Tanner W.; Hernandez, Lucas W.; Olson, Daniel G.; Svec, Riley L.; Hergenrother, Paul J.; Sarlah, David Enantioselective Synthesis of Isocarbostyril Alkaloids and Analogs Using Catalytic Dearomative Functionalization of Benzene. Journal of the American Chemical Society, 2019, 141, 657-670 |
4133646 | CIF | C31 H49 I N4 Yb | P 1 21/n 1 | 10.84; 20.374; 14.4408 90; 92.411; 90 | 3186.49 | Liu, Xiaojuan; Xiang, Li; Louyriac, Elisa; Maron, Laurent; Leng, Xuebing; Chen, Yaofeng Divalent Ytterbium Complex-Catalyzed Homo- and Cross-Coupling of Primary Arylsilanes. Journal of the American Chemical Society, 2019, 141, 138-142 |
4133647 | CIF | C28 H52 N4 Si Yb | P b c a | 14.361; 20.959; 21.535 90; 90; 90 | 6482 | Liu, Xiaojuan; Xiang, Li; Louyriac, Elisa; Maron, Laurent; Leng, Xuebing; Chen, Yaofeng Divalent Ytterbium Complex-Catalyzed Homo- and Cross-Coupling of Primary Arylsilanes. Journal of the American Chemical Society, 2019, 141, 138-142 |
4133648 | CIF | C32 H63 N4 Si2 Yb | P -1 | 10.8609; 11.002; 18.3602 77.331; 83.437; 60.677 | 1866.16 | Liu, Xiaojuan; Xiang, Li; Louyriac, Elisa; Maron, Laurent; Leng, Xuebing; Chen, Yaofeng Divalent Ytterbium Complex-Catalyzed Homo- and Cross-Coupling of Primary Arylsilanes. Journal of the American Chemical Society, 2019, 141, 138-142 |
4133649 | CIF | C13 H18 Br Cl N2 O | P 1 21 1 | 7.1967; 19.2597; 10.445 90; 105.491; 90 | 1395.15 | Kim, Seung Wook; Schwartz, Leyah A.; Zbieg, Jason R.; Stivala, Craig E.; Krische, Michael J. Regio- and Enantioselective Iridium-Catalyzed Amination of Racemic Branched Alkyl-Substituted Allylic Acetates with Primary and Secondary Aromatic and Heteroaromatic Amines. Journal of the American Chemical Society, 2019, 141, 671-676 |
4133651 | CIF | C34 H47 N2 Re | P -1 | 9.6137; 12.478; 13.2623 73.366; 85.413; 84.457 | 1514.95 | Lohrey, Trevor D.; Maron, Laurent; Bergman, Robert G.; Arnold, John Heterotetrametallic Re-Zn-Zn-Re Complex Generated by an Anionic Rhenium(I) β-Diketiminate. Journal of the American Chemical Society, 2019, 141, 800-804 |
4133652 | CIF | C34 H46 N2 Re | P 1 21/n 1 | 12.5845; 18.1223; 13.8772 90; 106.396; 90 | 3036.1 | Lohrey, Trevor D.; Maron, Laurent; Bergman, Robert G.; Arnold, John Heterotetrametallic Re-Zn-Zn-Re Complex Generated by an Anionic Rhenium(I) β-Diketiminate. Journal of the American Chemical Society, 2019, 141, 800-804 |
4133653 | CIF | C34 H46 N2 Na Re | P n m a | 12.1625; 21.0519; 12.4534 90; 90; 90 | 3188.62 | Lohrey, Trevor D.; Maron, Laurent; Bergman, Robert G.; Arnold, John Heterotetrametallic Re-Zn-Zn-Re Complex Generated by an Anionic Rhenium(I) β-Diketiminate. Journal of the American Chemical Society, 2019, 141, 800-804 |
4133654 | CIF | C74 H102 F6 N4 O7 Re2 S2 Zn2 | P -1 | 11.979; 12.3925; 13.8937 97.317; 109.657; 94.52 | 1910.09 | Lohrey, Trevor D.; Maron, Laurent; Bergman, Robert G.; Arnold, John Heterotetrametallic Re-Zn-Zn-Re Complex Generated by an Anionic Rhenium(I) β-Diketiminate. Journal of the American Chemical Society, 2019, 141, 800-804 |
4133655 | CIF | C74 H106 N4 Re2 Zn2 | P -1 | 12.6151; 12.744; 22.8461 88.556; 77.634; 73.542 | 3438.22 | Lohrey, Trevor D.; Maron, Laurent; Bergman, Robert G.; Arnold, John Heterotetrametallic Re-Zn-Zn-Re Complex Generated by an Anionic Rhenium(I) β-Diketiminate. Journal of the American Chemical Society, 2019, 141, 800-804 |
4133656 | CIF | C16 H13 Cl O2 | P 1 | 6.5896; 9.7473; 12.2249 68.974; 75.048; 71.536 | 685.9 | Liu, Yidong; Liu, Song; Li, Dongmei; Zhang, Nan; Peng, Lei; Ao, Jun; Song, Choong Eui; Lan, Yu; Yan, Hailong Kinetic Resolution of Allylic Alcohol with Chiral BINOL-Based Alkoxides: A Combination of Experimental and Theoretical Studies. Journal of the American Chemical Society, 2019, 141, 1150-1159 |
4133657 | CIF | C20 H26 N2 O2 | P 65 | 19.5192; 19.5192; 8.5136 90; 90; 120 | 2809.1 | He, Chi; Stratton, Thomas P.; Baran, Phil S. Concise Total Synthesis of Herqulines B and C. Journal of the American Chemical Society, 2019, 141, 29-32 |
4133658 | CIF | C12 H20 N4 O3 | P -1 | 8.048; 8.858; 10.9924 69.1109; 76.8504; 68.754 | 678.01 | Wertjes, William C.; Okumura, Mikiko; Sarlah, David Palladium-Catalyzed Dearomative syn-1,4-Diamination. Journal of the American Chemical Society, 2019, 141, 163-167 |
4133659 | CIF | C13 H18 N4 O3 | C 1 2/c 1 | 22.4136; 6.0223; 19.9058 90; 94.244; 90 | 2679.5 | Wertjes, William C.; Okumura, Mikiko; Sarlah, David Palladium-Catalyzed Dearomative syn-1,4-Diamination. Journal of the American Chemical Society, 2019, 141, 163-167 |
4133660 | CIF | C16 H21.31 N4 O2.66 | P -1 | 9.8206; 11.1581; 15.3236 101.924; 100.739; 100.154 | 1573.33 | Wertjes, William C.; Okumura, Mikiko; Sarlah, David Palladium-Catalyzed Dearomative syn-1,4-Diamination. Journal of the American Chemical Society, 2019, 141, 163-167 |
4133661 | CIF | C21 H22 N4 O2 | P -1 | 9.5948; 12.3669; 16.3965 99.972; 104.315; 91.519 | 1851.78 | Wertjes, William C.; Okumura, Mikiko; Sarlah, David Palladium-Catalyzed Dearomative syn-1,4-Diamination. Journal of the American Chemical Society, 2019, 141, 163-167 |
4133662 | CIF | C24 H20 Cd N4 O8 | P 62 2 2 | 19.9464; 19.9464; 9.529 90; 90; 120 | 3283.3 | Qu, Liyuan; Iguchi, Hiroaki; Takaishi, Shinya; Habib, Faiza; Leong, Chanel F.; D'Alessandro, Deanna M; Yoshida, Takefumi; Abe, Hitoshi; Nishibori, Eiji; Yamashita, Masahiro Porous Molecular Conductor: Electrochemical Fabrication of Through-Space Conduction Pathways among Linear Coordination Polymers. Journal of the American Chemical Society, 2019, 141, 6802-6806 |
4133663 | CIF | C29 H18 Cd N O6 | P -1 | 10.944; 11.5746; 22.46 90.349; 92.11; 91.978 | 2841.4 | Mayer, David C.; Manzi, Aurora; Medishetty, Raghavender; Winkler, Benedikt; Schneider, Christian; Kieslich, Gregor; Pöthig, Alexander; Feldmann, Jochen; Fischer, Roland A. Controlling Multiphoton Absorption Efficiency by Chromophore Packing in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 11594-11602 |
4133664 | CIF | C74 H72 N6 O12 Zn2 | P 1 21/c 1 | 21.714; 10.0036; 15.182 90; 99.158; 90 | 3255.8 | Mayer, David C.; Manzi, Aurora; Medishetty, Raghavender; Winkler, Benedikt; Schneider, Christian; Kieslich, Gregor; Pöthig, Alexander; Feldmann, Jochen; Fischer, Roland A. Controlling Multiphoton Absorption Efficiency by Chromophore Packing in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 11594-11602 |
4133665 | CIF | C61 H44 Cd2 N3 O11 | P -1 | 11.072; 11.414; 22.31 91.12; 92.52; 93.32 | 2811 | Mayer, David C.; Manzi, Aurora; Medishetty, Raghavender; Winkler, Benedikt; Schneider, Christian; Kieslich, Gregor; Pöthig, Alexander; Feldmann, Jochen; Fischer, Roland A. Controlling Multiphoton Absorption Efficiency by Chromophore Packing in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 11594-11602 |
4133666 | CIF | C70 H66.5 Cl1.5 N2 O8 | P -1 | 10.0386; 16.5446; 17.6418 100.011; 104.223; 90.103 | 2793.9 | Mayer, David C.; Manzi, Aurora; Medishetty, Raghavender; Winkler, Benedikt; Schneider, Christian; Kieslich, Gregor; Pöthig, Alexander; Feldmann, Jochen; Fischer, Roland A. Controlling Multiphoton Absorption Efficiency by Chromophore Packing in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 11594-11602 |
4133667 | CIF | C14 H8 N0 O8 Zn2 | F d d d :2 | 11.987; 39.23; 47.618 90; 90; 90 | 22392 | Yang, Huajun; Peng, Fang; Dang, Candy; Wang, Yong; Hu, Dandan; Zhao, Xiang; Feng, Pingyun; Bu, Xianhui Ligand Charge Separation To Build Highly Stable Quasi-Isomer of MOF-74-Zn. Journal of the American Chemical Society, 2019, 141, 9808-9812 |
4133668 | CIF | C8 H4 N0 O7.75 Zn2 | P 61 2 2 | 22.026; 22.026; 12.068 90; 90; 120 | 5070 | Yang, Huajun; Peng, Fang; Dang, Candy; Wang, Yong; Hu, Dandan; Zhao, Xiang; Feng, Pingyun; Bu, Xianhui Ligand Charge Separation To Build Highly Stable Quasi-Isomer of MOF-74-Zn. Journal of the American Chemical Society, 2019, 141, 9808-9812 |
4133669 | CIF | C41 H28 N4 | I 41/a :2 | 20.15; 20.15; 8.85 90; 90; 90 | 3593.3 | Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography. Journal of the American Chemical Society, 2019, 141, 10962-10966 |
4133670 | CIF | C41 H28 N4 | I 41/a :2 | 27.3; 27.3; 7.7 90; 90; 90 | 5738.73 | Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography. Journal of the American Chemical Society, 2019, 141, 10962-10966 |
4133671 | CIF | C41 H28 N4 | I 41/a :2 | 20.5; 20.5; 9.1 90; 90; 90 | 3824.27 | Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography. Journal of the American Chemical Society, 2019, 141, 10962-10966 |
4133672 | CIF | C41 H36 N4 O4 | I 41/a :2 | 19.9; 19.9; 9.3 90; 90; 90 | 3682.89 | Sun, Tu; Wei, Lei; Chen, Yichong; Ma, Yanhang; Zhang, Yue-Biao Atomic-Level Characterization of Dynamics of a 3D Covalent Organic Framework by Cryo-Electron Diffraction Tomography. Journal of the American Chemical Society, 2019, 141, 10962-10966 |
4133673 | CIF | C34 H25 N12 S2 | F d d d :2 | 20.2514; 35.0504; 42.5407 90; 90; 90 | 30196.2 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133674 | CIF | C29 H27 N12 S | F d d d :2 | 20.144; 34.7052; 42.3035 90; 90; 90 | 29574.4 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133675 | CIF | C61 H58 N24 S2 | F d d d :2 | 19.9929; 34.6322; 42.3319 90; 90; 90 | 29310.5 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133676 | CIF | C33 H26 N12 S2 | F d d d :2 | 21.0124; 35.3974; 42.5092 90; 90; 90 | 31617.7 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133677 | CIF | C30 H25 N12 | F d d d :2 | 20.8296; 35.3105; 42.4936 90; 90; 90 | 31254.2 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133678 | CIF | C62 H68 N24 | F d d d :2 | 20.5062; 35.21; 42.652 90; 90; 90 | 30796 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133679 | CIF | C58 H68 N24 | F d d d :2 | 20.6068; 35.009; 42.3618 90; 90; 90 | 30560.8 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133680 | CIF | C30 H34 N12 S | F d d d :2 | 19.6681; 34.306; 42.246 90; 90; 90 | 28505 | Jiang, Xuanfeng; Cui, Xunzhe; Duncan, Andrew J. E.; Li, Liang; Hughes, Russell P.; Staples, Richard J.; Alexandrov, Eugeny V.; Proserpio, Davide M.; Wu, Yuyang; Ke, Chenfeng Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141, 10915-10923 |
4133681 | CIF | C32 H79 K O2 Si8 | P 1 21/n 1 | 14.4278; 21.935; 14.7814 90; 91.076; 90 | 4677.1 | Reiter, Dominik; Holzner, Richard; Porzelt, Amelie; Altmann, Philipp J.; Frisch, Philipp; Inoue, Shigeyoshi Disilene-Silylene Interconversion: A Synthetically Accessible Acyclic Bis(silyl)silylene. Journal of the American Chemical Society, 2019, 141, 13536-13546 |
4133682 | CIF | C21 H56 Si6 | P 21 21 21 | 9.4966; 13.7852; 24.0165 90; 90; 90 | 3144.06 | Reiter, Dominik; Holzner, Richard; Porzelt, Amelie; Altmann, Philipp J.; Frisch, Philipp; Inoue, Shigeyoshi Disilene-Silylene Interconversion: A Synthetically Accessible Acyclic Bis(silyl)silylene. Journal of the American Chemical Society, 2019, 141, 13536-13546 |
4133683 | CIF | C21 H54 Si6 | P 1 21/n 1 | 12.4962; 14.8445; 17.5284 90; 108.895; 90 | 3076.3 | Reiter, Dominik; Holzner, Richard; Porzelt, Amelie; Altmann, Philipp J.; Frisch, Philipp; Inoue, Shigeyoshi Disilene-Silylene Interconversion: A Synthetically Accessible Acyclic Bis(silyl)silylene. Journal of the American Chemical Society, 2019, 141, 13536-13546 |
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