Crystallography Open Database
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Searching volume of publication is 140
COD ID  |
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Space group |
Cell parameters | Cell volume |
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|---|---|---|---|---|---|---|
| 4133301 | CIF | C136 H154 B2 F48 P4 Rh2 | I 1 2/a 1 | 20.6397; 17.8; 77.042 90; 94.612; 90 | 28212.6 | Martínez-Martínez, Antonio J; Tegner, Bengt E.; McKay, Alasdair I.; Bukvic, Alexander J.; Rees, Nicholas H.; Tizzard, Graham J.; Coles, Simon J.; Warren, Mark R.; Macgregor, Stuart A.; Weller, Andrew S. Modulation of σ-Alkane Interactions in [Rh(L<sub>2</sub>)(alkane)]<sup>+</sup> Solid-State Molecular Organometallic (SMOM) Systems by Variation of the Chelating Phosphine and Alkane: Access to η<sup>2</sup>,η<sup>2</sup>-σ-Alkane Rh(I), η<sup>1</sup>-σ-Alkane Rh(III) Complexes, and Alkane Encapsulation. Journal of the American Chemical Society, 2018, 140, 14958-14970 |
| 4133302 | CIF | C62 H68 B Cl2 F24 P2 Rh | P 1 21/c 1 | 13.7187; 16.7165; 29.163 90; 93.382; 90 | 6676.26 | Martínez-Martínez, Antonio J; Tegner, Bengt E.; McKay, Alasdair I.; Bukvic, Alexander J.; Rees, Nicholas H.; Tizzard, Graham J.; Coles, Simon J.; Warren, Mark R.; Macgregor, Stuart A.; Weller, Andrew S. Modulation of σ-Alkane Interactions in [Rh(L<sub>2</sub>)(alkane)]<sup>+</sup> Solid-State Molecular Organometallic (SMOM) Systems by Variation of the Chelating Phosphine and Alkane: Access to η<sup>2</sup>,η<sup>2</sup>-σ-Alkane Rh(I), η<sup>1</sup>-σ-Alkane Rh(III) Complexes, and Alkane Encapsulation. Journal of the American Chemical Society, 2018, 140, 14958-14970 |
| 4133303 | CIF | C69 H78 B F24 P2 Rh | P 1 21/c 1 | 14.3089; 17.4465; 27.6835 90; 94.654; 90 | 6888.13 | Martínez-Martínez, Antonio J; Tegner, Bengt E.; McKay, Alasdair I.; Bukvic, Alexander J.; Rees, Nicholas H.; Tizzard, Graham J.; Coles, Simon J.; Warren, Mark R.; Macgregor, Stuart A.; Weller, Andrew S. Modulation of σ-Alkane Interactions in [Rh(L<sub>2</sub>)(alkane)]<sup>+</sup> Solid-State Molecular Organometallic (SMOM) Systems by Variation of the Chelating Phosphine and Alkane: Access to η<sup>2</sup>,η<sup>2</sup>-σ-Alkane Rh(I), η<sup>1</sup>-σ-Alkane Rh(III) Complexes, and Alkane Encapsulation. Journal of the American Chemical Society, 2018, 140, 14958-14970 |
| 4133304 | CIF | C69 H78.98 B F24 P2 Rh | P 1 21/c 1 | 14.4218; 17.6642; 27.4924 90; 94.5641; 90 | 6981.5 | Martínez-Martínez, Antonio J; Tegner, Bengt E.; McKay, Alasdair I.; Bukvic, Alexander J.; Rees, Nicholas H.; Tizzard, Graham J.; Coles, Simon J.; Warren, Mark R.; Macgregor, Stuart A.; Weller, Andrew S. Modulation of σ-Alkane Interactions in [Rh(L<sub>2</sub>)(alkane)]<sup>+</sup> Solid-State Molecular Organometallic (SMOM) Systems by Variation of the Chelating Phosphine and Alkane: Access to η<sup>2</sup>,η<sup>2</sup>-σ-Alkane Rh(I), η<sup>1</sup>-σ-Alkane Rh(III) Complexes, and Alkane Encapsulation. Journal of the American Chemical Society, 2018, 140, 14958-14970 |
| 4133305 | CIF | C24 H20 B F4 N | C 1 2/c 1 | 25.7941; 7.4589; 20.1543 90; 90.743; 90 | 3877.27 | Karim, Alavi; Schulz, Nils; Andersson, Hanna; Nekoueishahraki, Bijan; Carlsson, Anna-Carin C; Sarabi, Daniel; Valkonen, Arto; Rissanen, Kari; Gräfenstein, Jürgen; Keller, Sandro; Erdélyi, Máté Carbon's Three-Center, Four-Electron Tetrel Bond, Treated Experimentally. Journal of the American Chemical Society, 2018, 140, 17571-17579 |
| 4133306 | CIF | C27 H24 F3 N4 O4 | P 1 21/n 1 | 15.571; 9.728; 16.373 90; 100.123; 90 | 2441.5 | Basnet, Prakash; Kc, Shekhar; Dhungana, Roshan K.; Shrestha, Bijay; Boyle, Timothy J.; Giri, Ramesh Synergistic Bimetallic Ni/Ag and Ni/Cu Catalysis for Regioselective γ,δ-Diarylation of Alkenyl Ketimines: Addressing β-H Elimination by in Situ Generation of Cationic Ni(II) Catalysts. Journal of the American Chemical Society, 2018, 140, 15586-15590 |
| 4133307 | CIF | C33 H40 Br N3 O3 | P 1 21 1 | 11.5281; 9.2306; 30.703 90; 96.237; 90 | 3247.81 | Zhong, Feng; Yue, Wen-Jun; Zhang, Hai-Jun; Zhang, Cheng-Yuan; Yin, Liang Catalytic Asymmetric Construction of Halogenated Stereogenic Carbon Centers by Direct Vinylogous Mannich-Type Reaction. Journal of the American Chemical Society, 2018, 140, 15170-15175 |
| 4133308 | CIF | C31 H30 Cl N3 O3 | P 1 21 1 | 11.1116; 10.1824; 12.4713 90; 101.661; 90 | 1381.9 | Zhong, Feng; Yue, Wen-Jun; Zhang, Hai-Jun; Zhang, Cheng-Yuan; Yin, Liang Catalytic Asymmetric Construction of Halogenated Stereogenic Carbon Centers by Direct Vinylogous Mannich-Type Reaction. Journal of the American Chemical Society, 2018, 140, 15170-15175 |
| 4133309 | CIF | C12 H15 N O3 | P 21 21 21 | 5.5125; 13.5718; 14.9 90; 90; 90 | 1114.74 | Zhong, Feng; Yue, Wen-Jun; Zhang, Hai-Jun; Zhang, Cheng-Yuan; Yin, Liang Catalytic Asymmetric Construction of Halogenated Stereogenic Carbon Centers by Direct Vinylogous Mannich-Type Reaction. Journal of the American Chemical Society, 2018, 140, 15170-15175 |
| 4133310 | CIF | C32 H32 F N3 O4 | P 21 21 21 | 5.3565; 22.187; 23.89 90; 90; 90 | 2839.2 | Zhong, Feng; Yue, Wen-Jun; Zhang, Hai-Jun; Zhang, Cheng-Yuan; Yin, Liang Catalytic Asymmetric Construction of Halogenated Stereogenic Carbon Centers by Direct Vinylogous Mannich-Type Reaction. Journal of the American Chemical Society, 2018, 140, 15170-15175 |
| 4133311 | CIF | C3 H5 N9 O3 | P 1 21/c 1 | 7.1275; 13.5886; 8.1305 90; 97.048; 90 | 781.51 | Hu, Lu; Yin, Ping; Zhao, Gang; He, Chunlin; Imler, Gregory H.; Parrish, Damon A.; Gao, Haixiang; Shreeve, Jean'ne M. Conjugated Energetic Salts Based on Fused Rings: Insensitive and Highly Dense Materials. Journal of the American Chemical Society, 2018, 140, 15001-15007 |
| 4133312 | CIF | C3 H10 N12 O7 | C 1 2/c 1 | 25.8059; 11.555; 8.0141 90; 93.927; 90 | 2384.09 | Hu, Lu; Yin, Ping; Zhao, Gang; He, Chunlin; Imler, Gregory H.; Parrish, Damon A.; Gao, Haixiang; Shreeve, Jean'ne M. Conjugated Energetic Salts Based on Fused Rings: Insensitive and Highly Dense Materials. Journal of the American Chemical Society, 2018, 140, 15001-15007 |
| 4133313 | CIF | C3 H2 N8 O2 | P 1 21/n 1 | 10.3002; 5.9834; 11.2693 90; 90.942; 90 | 694.44 | Hu, Lu; Yin, Ping; Zhao, Gang; He, Chunlin; Imler, Gregory H.; Parrish, Damon A.; Gao, Haixiang; Shreeve, Jean'ne M. Conjugated Energetic Salts Based on Fused Rings: Insensitive and Highly Dense Materials. Journal of the American Chemical Society, 2018, 140, 15001-15007 |
| 4133314 | CIF | C3 H10 N12 O5 | P -1 | 8.289; 12.021; 12.4452 64.042; 84.743; 81.763 | 1102.88 | Hu, Lu; Yin, Ping; Zhao, Gang; He, Chunlin; Imler, Gregory H.; Parrish, Damon A.; Gao, Haixiang; Shreeve, Jean'ne M. Conjugated Energetic Salts Based on Fused Rings: Insensitive and Highly Dense Materials. Journal of the American Chemical Society, 2018, 140, 15001-15007 |
| 4133315 | CIF | C16 H18 O3 | P 1 21/c 1 | 16.0554; 6.2996; 14.4609 90; 106.151; 90 | 1404.89 | Li, Man-Bo; Inge, A. Ken; Posevins, Daniels; Gustafson, Karl P. J.; Qiu, Youai; Bäckvall, Jan-E Chemodivergent and Diastereoselective Synthesis of γ-Lactones and γ-Lactams: A Heterogeneous Palladium-Catalyzed Oxidative Tandem Process. Journal of the American Chemical Society, 2018, 140, 14604-14608 |
| 4133316 | CIF | C216 H244 Cl4 Co4 F72 N76 O16 P12 | P -4 3 n | 21.728; 21.728; 21.728 90; 90; 90 | 10257.9 | Burke, Benjamin P.; Grantham, William; Burke, Michael J.; Nichol, Gary S.; Roberts, David; Renard, Isaline; Hargreaves, Rebecca; Cawthorne, Christopher; Archibald, Stephen J.; Lusby, Paul J. Visualizing Kinetically Robust Co<sup>III</sup><sub>4</sub>L<sub>6</sub> Assemblies in Vivo: SPECT Imaging of the Encapsulated [<sup>99m</sup>Tc]TcO<sub>4</sub><sup>-</sup> Anion. Journal of the American Chemical Society, 2018, 140, 16877-16881 |
| 4133317 | CIF | C2.62 H1.38 O0.67 Zr0.12 | F m -3 m | 32.5979; 32.5979; 32.5979 90; 90; 90 | 34639.3 | Tan, Chunxia; Han, Xing; Li, Zijian; Liu, Yan; Cui, Yong Controlled Exchange of Achiral Linkers with Chiral Linkers in Zr-Based UiO-68 Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 16229-16236 |
| 4133318 | CIF | C90 H78 Cu3 N6 O22 Zr3 | F 4 3 2 | 32.0319; 32.0319; 32.0319 90; 90; 90 | 32866.1 | Tan, Chunxia; Han, Xing; Li, Zijian; Liu, Yan; Cui, Yong Controlled Exchange of Achiral Linkers with Chiral Linkers in Zr-Based UiO-68 Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 16229-16236 |
| 4133319 | CIF | C13 H14 O3 | P 21 21 21 | 6.261; 7.4076; 24.242 90; 90; 90 | 1124.3 | Chen, Kai; Zhang, Shuo-Qing; Brandenberg, Oliver F.; Hong, Xin; Arnold, Frances H. Alternate Heme Ligation Steers Activity and Selectivity in Engineered Cytochrome P450-Catalyzed Carbene-Transfer Reactions. Journal of the American Chemical Society, 2018, 140, 16402-16407 |
| 4133320 | CIF | C12 H11 Br O2 | P 21 21 21 | 6.3854; 6.702; 25.222 90; 90; 90 | 1079.4 | Chen, Kai; Zhang, Shuo-Qing; Brandenberg, Oliver F.; Hong, Xin; Arnold, Frances H. Alternate Heme Ligation Steers Activity and Selectivity in Engineered Cytochrome P450-Catalyzed Carbene-Transfer Reactions. Journal of the American Chemical Society, 2018, 140, 16402-16407 |
| 4133321 | CIF | C10 H9 Br O2 S | P 1 21 1 | 5.7304; 8.3275; 10.4712 90; 92.034; 90 | 499.37 | Chen, Kai; Zhang, Shuo-Qing; Brandenberg, Oliver F.; Hong, Xin; Arnold, Frances H. Alternate Heme Ligation Steers Activity and Selectivity in Engineered Cytochrome P450-Catalyzed Carbene-Transfer Reactions. Journal of the American Chemical Society, 2018, 140, 16402-16407 |
| 4133322 | CIF | C51.5 H70 F24 Mo2 O11 | P -4 21 c | 17.0065; 17.0065; 21.4575 90; 90; 90 | 6206 | Zhai, Feng; Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Benzylidene Complexes. Journal of the American Chemical Society, 2018, 140, 13609-13613 |
| 4133323 | CIF | C62 H76 Mo O5 Si2 | P 1 21/n 1 | 11.0925; 15.0304; 34.812 90; 90.062; 90 | 5804 | Zhai, Feng; Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Benzylidene Complexes. Journal of the American Chemical Society, 2018, 140, 13609-13613 |
| 4133324 | CIF | C56 H58 Mo O4 | C 1 2/c 1 | 31.9462; 11.8211; 27.6304 90; 104.247; 90 | 10113.4 | Zhai, Feng; Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Benzylidene Complexes. Journal of the American Chemical Society, 2018, 140, 13609-13613 |
| 4133325 | CIF | C44 H40 F36 Mo2 O11 | P n a 21 | 21.5299; 23.117; 11.3996 90; 90; 90 | 5673.7 | Zhai, Feng; Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Benzylidene Complexes. Journal of the American Chemical Society, 2018, 140, 13609-13613 |
| 4133326 | CIF | C51 H54 Cl0.5 Cs F0.5 N4 O7 | P 1 21/c 1 | 25.8755; 23.2023; 17.0251 90; 92.263; 90 | 10213.4 | Chi, Xiaodong; Peters, Gretchen M.; Brockman, Chandler; Lynch, Vincent M.; Sessler, Jonathan L. Controlling Structure Beyond the Initial Coordination Sphere: Complexation-Induced Reversed Micelle Formation in Calix[4]pyrrole-Containing Diblock Copolymers. Journal of the American Chemical Society, 2018, 140, 13219-13222 |
| 4133327 | CIF | C54 H60 N4 O7 | P 1 21/c 1 | 14.248; 18.85; 18.471 90; 111.445; 90 | 4617.4 | Chi, Xiaodong; Peters, Gretchen M.; Brockman, Chandler; Lynch, Vincent M.; Sessler, Jonathan L. Controlling Structure Beyond the Initial Coordination Sphere: Complexation-Induced Reversed Micelle Formation in Calix[4]pyrrole-Containing Diblock Copolymers. Journal of the American Chemical Society, 2018, 140, 13219-13222 |
| 4133328 | CIF | C31.5 H32.08 N O4.54 S2 | P 1 21/c 1 | 19.007; 10.872; 27.409 90; 102.88; 90 | 5521 | Hu, Xiaoran; McFadden, Molly E.; Barber, Ross W.; Robb, Maxwell J. Mechanochemical Regulation of a Photochemical Reaction. Journal of the American Chemical Society, 2018, 140, 14073-14077 |
| 4133329 | CIF | C414 H422 Cd24 N122 O26 | P 1 21/n 1 | 16.2363; 22.6153; 29.9087 90; 94.639; 90 | 10946.2 | McGuirk, C. Michael; Runčevski, Tomče; Oktawiec, Julia; Turkiewicz, Ari; Taylor, Mercedes K.; Long, Jeffrey R. Influence of Metal Substitution on the Pressure-Induced Phase Change in Flexible Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2018, 140, 15924-15933 |
| 4133330 | CIF | C178 H140 Cd12 Cl20 N48 | P 1 21/n 1 | 14.7241; 21.4248; 17.2433 90; 113.366; 90 | 4993.5 | McGuirk, C. Michael; Runčevski, Tomče; Oktawiec, Julia; Turkiewicz, Ari; Taylor, Mercedes K.; Long, Jeffrey R. Influence of Metal Substitution on the Pressure-Induced Phase Change in Flexible Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2018, 140, 15924-15933 |
| 4133331 | CIF | C27 H23 N O | P 1 21/c 1 | 5.9715; 34.571; 9.5588 90; 100.25; 90 | 1941.8 | Cañellas, Santiago; Montgomery, John; Pericàs, Miquel À Nickel-Catalyzed Reductive [2+2] Cycloaddition of Alkynes. Journal of the American Chemical Society, 2018, 140, 17349-17355 |
| 4133332 | CIF | C20 H20 O4 | P 1 n 1 | 8.9219; 5.6293; 17.187 90; 103.268; 90 | 840.16 | Cañellas, Santiago; Montgomery, John; Pericàs, Miquel À Nickel-Catalyzed Reductive [2+2] Cycloaddition of Alkynes. Journal of the American Chemical Society, 2018, 140, 17349-17355 |
| 4133333 | CIF | C23 H22 O4 | C 1 2/c 1 | 15.1384; 16.8907; 7.8396 90; 115.744; 90 | 1805.6 | Cañellas, Santiago; Montgomery, John; Pericàs, Miquel À Nickel-Catalyzed Reductive [2+2] Cycloaddition of Alkynes. Journal of the American Chemical Society, 2018, 140, 17349-17355 |
| 4133334 | CIF | C26 H43 N O3 Si | P 21 21 21 | 7.75079; 17.50986; 18.79506 90; 90; 90 | 2550.78 | Richter, Matthieu J. R.; Schneider, Michael; Brandstätter, Marco; Krautwald, Simon; Carreira, Erick M. Total Synthesis of (-)-Mitrephorone A. Journal of the American Chemical Society, 2018, 140, 16704-16710 |
| 4133349 | CIF | C29 H33 N3 O2 | P 1 21/c 1 | 22.8468; 5.9484; 18.8992 90; 106.705; 90 | 2460 | Odella, Emmanuel; Mora, S. Jimena; Wadsworth, Brian L.; Huynh, Mioy T.; Goings, Joshua J.; Liddell, Paul A.; Groy, Thomas L.; Gervaldo, Miguel; Sereno, Leónides E; Gust, Devens; Moore, Thomas A.; Moore, Gary F.; Hammes-Schiffer, Sharon; Moore, Ana L. Controlling Proton-Coupled Electron Transfer in Bioinspired Artificial Photosynthetic Relays. Journal of the American Chemical Society, 2018, 140, 15450-15460 |
| 4133350 | CIF | C35 H61 I Th | P 1 21/c 1 | 9.3556; 23.2292; 16.8874 90; 105.518; 90 | 3536.2 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133351 | CIF | C58 H93 P Th | P 1 21/n 1 | 10.6013; 31.8019; 15.7364 90; 94.685; 90 | 5287.67 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133352 | CIF | C59 H92 P S2 Th | P 1 21/n 1 | 14.5566; 25.565; 15.0749 90; 92.616; 90 | 5604.12 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133353 | CIF | C41 H63 N S2 Th | P 1 21/c 1 | 11.7105; 14.3546; 27.5103 90; 93.334; 90 | 4616.6 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133354 | CIF | C68 H116 S2 Th2 | P c a 21 | 21.8176; 10.7827; 27.5783 90; 90; 90 | 6487.87 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133355 | CIF | C59 H92 N P Th | P 1 21/c 1 | 10.323; 28.5977; 18.6295 90; 100.592; 90 | 5406 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133356 | CIF | C59 H98 N P Th | P 1 21/c 1 | 10.3818; 28.7489; 18.6498 90; 96.834; 90 | 5526.8 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133357 | CIF | C60 H99 N P Th | P -1 | 10.5187; 11.0949; 25.1635 78.722; 85.304; 76.16 | 2794.46 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133358 | CIF | C132 H194 N4 P2 Th2 | P -1 | 15.8047; 18.1652; 24.3339 89.366; 84.928; 64.381 | 6271.8 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133359 | CIF | C138 H200 N4 P2 Th2 | P 1 21/n 1 | 11.1972; 20.3586; 28.01 90; 100.882; 90 | 6270.3 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133360 | CIF | C66 H97 N2 P Th | P -1 | 12.4141; 14.2991; 18.8879 99.847; 97.762; 96.856 | 3238.1 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133361 | CIF | C65 H105 N P Si Th | P -1 | 12.8472; 13.0939; 21.1147 85.562; 74.609; 63.017 | 3047.9 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133362 | CIF | C68 H107 N P Th | P -1 | 10.769; 15.6072; 19.4589 77.538; 83.282; 75.504 | 3084.95 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133363 | CIF | C61 H96 N P Th | P -1 | 13.3682; 14.9534; 16.5128 105.788; 90.91; 94.865 | 3162.33 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133364 | CIF | C52 H87 N4 P Th | P -1 | 14.5978; 18.9744; 19.2277 101.751; 90.019; 99.921 | 5132.7 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133365 | CIF | C50 H74 N2 Th | P -1 | 10.625; 12.002; 20.851 100.631; 90.727; 115.77 | 2340 | Zhang, Congcong; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. A Base-Free Terminal Actinide Phosphinidene Metallocene: Synthesis, Structure, Reactivity, and Computational Studies. Journal of the American Chemical Society, 2018, 140, 14511-14525 |
| 4133376 | CIF | C90.5 H110 Al2 N4 O8 W | P 1 21/c 1 | 27.7428; 12.2385; 25.2788 90; 102.219; 90 | 8388.5 | Kong, Richard Y.; Crimmin, Mark R. Carbon Chain Growth by Sequential Reactions of CO and CO<sub>2</sub> with [W(CO)<sub>6</sub>] and an Aluminum(I) Reductant. Journal of the American Chemical Society, 2018, 140, 13614-13617 |
| 4133377 | CIF | C74 H90 Al2 N4 O9 W | P 1 21/c 1 | 15.3318; 21.4894; 21.5498 90; 92.4806; 90 | 7093.4 | Kong, Richard Y.; Crimmin, Mark R. Carbon Chain Growth by Sequential Reactions of CO and CO<sub>2</sub> with [W(CO)<sub>6</sub>] and an Aluminum(I) Reductant. Journal of the American Chemical Society, 2018, 140, 13614-13617 |
| 4133378 | CIF | C79 H94 Al2 N4 O10 W | P 1 21/c 1 | 17.8441; 19.0576; 22.2871 90; 92.815; 90 | 7569.9 | Kong, Richard Y.; Crimmin, Mark R. Carbon Chain Growth by Sequential Reactions of CO and CO<sub>2</sub> with [W(CO)<sub>6</sub>] and an Aluminum(I) Reductant. Journal of the American Chemical Society, 2018, 140, 13614-13617 |
| 4133379 | CIF | C77.5 H94 Al2 N4 O10 W | P 1 21/c 1 | 36.7014; 15.0966; 28.7796 90; 111.273; 90 | 14859.3 | Kong, Richard Y.; Crimmin, Mark R. Carbon Chain Growth by Sequential Reactions of CO and CO<sub>2</sub> with [W(CO)<sub>6</sub>] and an Aluminum(I) Reductant. Journal of the American Chemical Society, 2018, 140, 13614-13617 |
| 4133380 | CIF | Br3 Mo3 S10 | P 1 21/c 1 | 24.246; 15.3192; 24.56 90; 119.55; 90 | 7936 | Ji, Zhe; Trickett, Christopher; Pei, Xiaokun; Yaghi, Omar M. Linking Molybdenum-Sulfur Clusters for Electrocatalytic Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 13618-13622 |
| 4133381 | CIF | C54 H34 Mo6 N6 O18 S8 | C 1 2/c 1 | 24.8186; 21.5751; 33.513 90; 106.853; 90 | 17174 | Ji, Zhe; Trickett, Christopher; Pei, Xiaokun; Yaghi, Omar M. Linking Molybdenum-Sulfur Clusters for Electrocatalytic Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 13618-13622 |
| 4133382 | CIF | C60 H126 Br10 Mo6 N6 S18 | C c c m | 12.4938; 42.4264; 22.2065 90; 90; 90 | 11770.9 | Ji, Zhe; Trickett, Christopher; Pei, Xiaokun; Yaghi, Omar M. Linking Molybdenum-Sulfur Clusters for Electrocatalytic Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 13618-13622 |
| 4133383 | CIF | C9 H5.5 Br6 Mo6 S20 | P n a 21 | 30.418; 12.37; 21.063 90; 90; 90 | 7925 | Ji, Zhe; Trickett, Christopher; Pei, Xiaokun; Yaghi, Omar M. Linking Molybdenum-Sulfur Clusters for Electrocatalytic Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 13618-13622 |
| 4133384 | CIF | C144 H144 Mo24 N24 O150 S32 Zn6 | I m -3 m | 32.877; 32.877; 32.877 90; 90; 90 | 35537 | Ji, Zhe; Trickett, Christopher; Pei, Xiaokun; Yaghi, Omar M. Linking Molybdenum-Sulfur Clusters for Electrocatalytic Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 13618-13622 |
| 4133385 | CIF | C57.26 H37.26 O0.26 | I 1 2/a 1 | 27.657; 7.6139; 35.2089 90; 100.653; 90 | 7286.4 | Nakakuki, Yusuke; Hirose, Takashi; Matsuda, Kenji Synthesis of a Helical Analogue of Kekulene: A Flexible π-Expanded Helicene with Large Helical Diameter Acting as a Soft Molecular Spring. Journal of the American Chemical Society, 2018, 140, 15461-15469 |
| 4133386 | CIF | C15 H13 N3 | P -1 | 5.5819; 9.2612; 12.4359 79.19; 86.826; 86.365 | 629.58 | Ren, Yansong; Xie, Sheng; Svensson Grape, Erik; Inge, A. Ken; Ramström, Olof Multistimuli-Responsive Enaminitrile Molecular Switches Displaying H<sup>+</sup>-Induced Aggregate Emission, Metal Ion-Induced Turn-On Fluorescence, and Organogelation Properties. Journal of the American Chemical Society, 2018, 140, 13640-13643 |
| 4133387 | CIF | C18 H17 N3 | P -1 | 7.9989; 8.2629; 11.7753 75.035; 78.866; 84.766 | 737.03 | Ren, Yansong; Xie, Sheng; Svensson Grape, Erik; Inge, A. Ken; Ramström, Olof Multistimuli-Responsive Enaminitrile Molecular Switches Displaying H<sup>+</sup>-Induced Aggregate Emission, Metal Ion-Induced Turn-On Fluorescence, and Organogelation Properties. Journal of the American Chemical Society, 2018, 140, 13640-13643 |
| 4133388 | CIF | C19 H21 N3 O3 S | C 1 2/c 1 | 23.609; 10.8697; 15.2722 90; 106.999; 90 | 3748 | Ren, Yansong; Xie, Sheng; Svensson Grape, Erik; Inge, A. Ken; Ramström, Olof Multistimuli-Responsive Enaminitrile Molecular Switches Displaying H<sup>+</sup>-Induced Aggregate Emission, Metal Ion-Induced Turn-On Fluorescence, and Organogelation Properties. Journal of the American Chemical Society, 2018, 140, 13640-13643 |
| 4133389 | CIF | C16 H17 N3 O3 S | P 1 21 1 | 5.451; 39.24; 7.731 90; 95.806; 90 | 1645 | Ren, Yansong; Xie, Sheng; Svensson Grape, Erik; Inge, A. Ken; Ramström, Olof Multistimuli-Responsive Enaminitrile Molecular Switches Displaying H<sup>+</sup>-Induced Aggregate Emission, Metal Ion-Induced Turn-On Fluorescence, and Organogelation Properties. Journal of the American Chemical Society, 2018, 140, 13640-13643 |
| 4133390 | CIF | C16 H29 Li N2 Ni | P b c a | 16.555; 11.7095; 17.7899 90; 90; 90 | 3448.6 | Nattmann, Lukas; Lutz, Sigrid; Ortsack, Pascal; Goddard, Richard; Cornella, Josep A Highly Reduced Ni-Li-Olefin Complex for Catalytic Kumada-Corriu Cross-Couplings. Journal of the American Chemical Society, 2018, 140, 13628-13633 |
| 4133391 | CIF | C32 H56 Li2 Ni O4 | P 1 21/c 1 | 10.5241; 18.135; 17.197 90; 107.478; 90 | 3130.6 | Nattmann, Lukas; Lutz, Sigrid; Ortsack, Pascal; Goddard, Richard; Cornella, Josep A Highly Reduced Ni-Li-Olefin Complex for Catalytic Kumada-Corriu Cross-Couplings. Journal of the American Chemical Society, 2018, 140, 13628-13633 |
| 4133392 | CIF | C36 H31 Ge N O2 | P 41 21 2 | 9.5716; 9.5716; 64.226 90; 90; 90 | 5884.1 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133393 | CIF | C34 H29 Ge N O2 | P 1 21/c 1 | 10.4058; 20.8929; 13.6211 90; 111.976; 90 | 2746.16 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133394 | CIF | C30 H37 Ge N O3 Si | P 1 21/n 1 | 11.7444; 15.9338; 32.3292 90; 92.83; 90 | 6042.5 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133395 | CIF | C26 H24 F3 Ge N O2 | P 1 21/c 1 | 11.4162; 16.8675; 24.7995 90; 96.907; 90 | 4740.8 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133396 | CIF | C39 H33 Ge N O2 | P 1 21/n 1 | 11.0689; 17.7248; 16.4657 90; 90.862; 90 | 3230.11 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133397 | CIF | C52 H52 Cl4 Ge2 N2 O4 Zn | P c a 21 | 21.4118; 12.0493; 39.1926 90; 90; 90 | 10111.6 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133398 | CIF | C54 H56 Cl4 Ge2 N2 O4 Zn | P 21 21 21 | 13.4291; 17.2102; 23.7226 90; 90; 90 | 5482.7 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133399 | CIF | C32 H35 Ge O3 P | C 1 2/c 1 | 16.3298; 12.8553; 28.1785 90; 97.582; 90 | 5863.6 | de la Vega-Hernández, Karen; Romain, Elise; Coffinet, Anais; Bijouard, Kajetan; Gontard, Geoffrey; Chemla, Fabrice; Ferreira, Franck; Jackowski, Olivier; Perez-Luna, Alejandro Radical Germylzincation of α-Heteroatom-Substituted Alkynes. Journal of the American Chemical Society, 2018, 140, 17632-17642 |
| 4133400 | CIF | C14 H10 Br Mn N2 O3 S | P -1 | 6.6811; 8.3367; 13.932 92.589; 97.506; 93.047 | 767.2 | Clark, Melissa L.; Ge, Aimin; Videla, Pablo E.; Rudshteyn, Benjamin; Miller, Christopher J.; Song, Jia; Batista, Victor S.; Lian, Tianquan; Kubiak, Clifford P. CO<sub>2</sub> Reduction Catalysts on Gold Electrode Surfaces Influenced by Large Electric Fields. Journal of the American Chemical Society, 2018, 140, 17643-17655 |
| 4133401 | CIF | C14 H10 Cl N2 O3 Re S | P 1 21/n 1 | 10.5295; 12.7123; 11.9526 90; 98.859; 90 | 1580.82 | Clark, Melissa L.; Ge, Aimin; Videla, Pablo E.; Rudshteyn, Benjamin; Miller, Christopher J.; Song, Jia; Batista, Victor S.; Lian, Tianquan; Kubiak, Clifford P. CO<sub>2</sub> Reduction Catalysts on Gold Electrode Surfaces Influenced by Large Electric Fields. Journal of the American Chemical Society, 2018, 140, 17643-17655 |
| 4133402 | CIF | C10 H8 N2 S | P 1 21/n 1 | 7.0306; 10.251; 12.9104 90; 101.624; 90 | 911.38 | Clark, Melissa L.; Ge, Aimin; Videla, Pablo E.; Rudshteyn, Benjamin; Miller, Christopher J.; Song, Jia; Batista, Victor S.; Lian, Tianquan; Kubiak, Clifford P. CO<sub>2</sub> Reduction Catalysts on Gold Electrode Surfaces Influenced by Large Electric Fields. Journal of the American Chemical Society, 2018, 140, 17643-17655 |
| 4133403 | CIF | C36 H84 Si8 Sn | P -1 | 11.4372; 11.5112; 20.7806 95.647; 103.837; 90.081 | 2642.7 | Koby, Ross F.; Hanusa, Timothy P.; Schley, Nathan D. Mechanochemically Driven Transformations in Organotin Chemistry: Stereochemical Rearrangement, Redox Behavior, and Dispersion-Stabilized Complexes. Journal of the American Chemical Society, 2018, 140, 15934-15942 |
| 4133404 | CIF | C36 H84 Si8 Sn | P 1 21 1 | 11.3719; 19.8321; 12.1517 90; 107.788; 90 | 2609.54 | Koby, Ross F.; Hanusa, Timothy P.; Schley, Nathan D. Mechanochemically Driven Transformations in Organotin Chemistry: Stereochemical Rearrangement, Redox Behavior, and Dispersion-Stabilized Complexes. Journal of the American Chemical Society, 2018, 140, 15934-15942 |
| 4133405 | CIF | C27 H63 K Si6 Sn | P 1 21/n 1 | 12.5863; 16.2257; 20.9657 90; 100.864; 90 | 4204.91 | Koby, Ross F.; Hanusa, Timothy P.; Schley, Nathan D. Mechanochemically Driven Transformations in Organotin Chemistry: Stereochemical Rearrangement, Redox Behavior, and Dispersion-Stabilized Complexes. Journal of the American Chemical Society, 2018, 140, 15934-15942 |
| 4133406 | CIF | C34 H23 I O3 S | P 1 21 1 | 9.3269; 18.8579; 9.8275 90; 101.531; 90 | 1693.63 | Tan, Yu; Jia, Shiqi; Hu, Fangli; Liu, Yidong; Peng, Lei; Li, Dongmei; Yan, Hailong Enantioselective Construction of Vicinal Diaxial Styrenes and Multiaxis System via Organocatalysis. Journal of the American Chemical Society, 2018, 140, 16893-16898 |
| 4133407 | CIF | C24 H15 Br2 I O3 S | P 21 21 21 | 7.6112; 9.4733; 32.0728 90; 90; 90 | 2312.55 | Tan, Yu; Jia, Shiqi; Hu, Fangli; Liu, Yidong; Peng, Lei; Li, Dongmei; Yan, Hailong Enantioselective Construction of Vicinal Diaxial Styrenes and Multiaxis System via Organocatalysis. Journal of the American Chemical Society, 2018, 140, 16893-16898 |
| 4133408 | CIF | C24 H15 Br2 I O3 S | P 21 21 21 | 9.5781; 12.2304; 23.1878 90; 90; 90 | 2716.31 | Tan, Yu; Jia, Shiqi; Hu, Fangli; Liu, Yidong; Peng, Lei; Li, Dongmei; Yan, Hailong Enantioselective Construction of Vicinal Diaxial Styrenes and Multiaxis System via Organocatalysis. Journal of the American Chemical Society, 2018, 140, 16893-16898 |
| 4133409 | CIF | C39 H32 Cl I O5 S | P 1 21 1 | 9.1728; 20.333; 9.8676 90; 100.761; 90 | 1808.05 | Tan, Yu; Jia, Shiqi; Hu, Fangli; Liu, Yidong; Peng, Lei; Li, Dongmei; Yan, Hailong Enantioselective Construction of Vicinal Diaxial Styrenes and Multiaxis System via Organocatalysis. Journal of the American Chemical Society, 2018, 140, 16893-16898 |
| 4133410 | CIF | C352 H180 Co12 P12 Te16 | I 1 2/m 1 | 25.7743; 16.3541; 28.9052 90; 92.161; 90 | 12175.3 | O'Brien, Evan S; Russell, Jake C.; Bartnof, Matthew; Christodoulides, Alexander D.; Lee, Kihong; DeGayner, Jordan A.; Paley, Daniel W.; McGaughey, Alan J. H.; Ong, Wee-Liat; Malen, Jonathan A.; Zhu, X.-Y.; Roy, Xavier Spontaneous Electronic Band Formation and Switchable Behaviors in a Phase-Rich Superatomic Crystal. Journal of the American Chemical Society, 2018, 140, 15601-15605 |
| 4133411 | CIF | C352 H180 Co12 P12 Te16 | P 1 21/n 1 | 25.3864; 16.3196; 28.8221 90; 92.581; 90 | 11928.8 | O'Brien, Evan S; Russell, Jake C.; Bartnof, Matthew; Christodoulides, Alexander D.; Lee, Kihong; DeGayner, Jordan A.; Paley, Daniel W.; McGaughey, Alan J. H.; Ong, Wee-Liat; Malen, Jonathan A.; Zhu, X.-Y.; Roy, Xavier Spontaneous Electronic Band Formation and Switchable Behaviors in a Phase-Rich Superatomic Crystal. Journal of the American Chemical Society, 2018, 140, 15601-15605 |
| 4133412 | CIF | C176 H90 Co6 P6 Te8 | P -3 m 1 | 16.603; 16.603; 12.9455 90; 90; 120 | 3090.5 | O'Brien, Evan S; Russell, Jake C.; Bartnof, Matthew; Christodoulides, Alexander D.; Lee, Kihong; DeGayner, Jordan A.; Paley, Daniel W.; McGaughey, Alan J. H.; Ong, Wee-Liat; Malen, Jonathan A.; Zhu, X.-Y.; Roy, Xavier Spontaneous Electronic Band Formation and Switchable Behaviors in a Phase-Rich Superatomic Crystal. Journal of the American Chemical Society, 2018, 140, 15601-15605 |
| 4133413 | CIF | C35 H31 B O3 | P 1 | 10.1118; 11.8308; 12.5795 83.377; 70.474; 72.023 | 1348.98 | Myhill, Jesse A.; Wilhelmsen, Christopher A.; Zhang, Liang; Morken, James P. Diastereoselective and Enantioselective Conjunctive Cross-Coupling Enabled by Boron Ligand Design. Journal of the American Chemical Society, 2018, 140, 15181-15185 |
| 4133414 | CIF | C37 H27 F12 N4 O P3 Ru | P 1 21/c 1 | 12.0274; 14.89; 20.8508 90; 94.768; 90 | 3721.21 | Lee, Sze Koon; Kondo, Mio; Okamura, Masaya; Enomoto, Takafumi; Nakamura, Go; Masaoka, Shigeyuki Function-Integrated Ru Catalyst for Photochemical CO<sub>2</sub> Reduction. Journal of the American Chemical Society, 2018, 140, 16899-16903 |
| 4133417 | CIF | C94 H71 Cl2 Mn4 N6 O13 P3 | P -1 | 14.2765; 14.3034; 23.7048 72.614; 87.529; 67.645 | 4258.6 | Lee, Heui Beom; Shiau, Angela A.; Oyala, Paul H.; Marchiori, David A.; Gul, Sheraz; Chatterjee, Ruchira; Yano, Junko; Britt, R. David; Agapie, Theodor Tetranuclear [Mn<sup>III</sup>Mn<sub>3</sub><sup>IV</sup>O<sub>4</sub>] Complexes as Spectroscopic Models of the S<sub>2</sub> State of the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 17175-17187 |
| 4133418 | CIF | C95 H71 Cl2 F3 Mn4 N6 O16 P3 S | P 1 21/n 1 | 14.3608; 27.4932; 23.6617 90; 101.255; 90 | 9162.5 | Lee, Heui Beom; Shiau, Angela A.; Oyala, Paul H.; Marchiori, David A.; Gul, Sheraz; Chatterjee, Ruchira; Yano, Junko; Britt, R. David; Agapie, Theodor Tetranuclear [Mn<sup>III</sup>Mn<sub>3</sub><sup>IV</sup>O<sub>4</sub>] Complexes as Spectroscopic Models of the S<sub>2</sub> State of the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 17175-17187 |
| 4133419 | CIF | C73.55 H56 Cl2.51 Mn4 N8 O12.57 | P -1 | 13.2586; 15.443; 18.255 89.004; 85.374; 82.474 | 3693.4 | Lee, Heui Beom; Shiau, Angela A.; Oyala, Paul H.; Marchiori, David A.; Gul, Sheraz; Chatterjee, Ruchira; Yano, Junko; Britt, R. David; Agapie, Theodor Tetranuclear [Mn<sup>III</sup>Mn<sub>3</sub><sup>IV</sup>O<sub>4</sub>] Complexes as Spectroscopic Models of the S<sub>2</sub> State of the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 17175-17187 |
| 4133420 | CIF | C68 H57 Cl2 F3 Mn4 N8 O14 S | P -1 | 12.925; 15.479; 18.467 81.151; 84.367; 66.925 | 3355.7 | Lee, Heui Beom; Shiau, Angela A.; Oyala, Paul H.; Marchiori, David A.; Gul, Sheraz; Chatterjee, Ruchira; Yano, Junko; Britt, R. David; Agapie, Theodor Tetranuclear [Mn<sup>III</sup>Mn<sub>3</sub><sup>IV</sup>O<sub>4</sub>] Complexes as Spectroscopic Models of the S<sub>2</sub> State of the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 17175-17187 |
| 4133421 | CIF | C77 H65 F6 Mn4 N8 O15 S | C 1 2/c 1 | 41.9795; 15.5642; 26.7105 90; 122.423; 90 | 14731.5 | Lee, Heui Beom; Shiau, Angela A.; Oyala, Paul H.; Marchiori, David A.; Gul, Sheraz; Chatterjee, Ruchira; Yano, Junko; Britt, R. David; Agapie, Theodor Tetranuclear [Mn<sup>III</sup>Mn<sub>3</sub><sup>IV</sup>O<sub>4</sub>] Complexes as Spectroscopic Models of the S<sub>2</sub> State of the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 17175-17187 |
| 4133422 | CIF | C104 H104 La3 N16 O32 | P 1 21/c 1 | 14.5237; 23.9029; 38.344 90; 90.844; 90 | 13310 | Wang, Xiaozhu; Jaraquemada-Peláez, María de Guadalupe; Rodríguez-Rodríguez, Cristina; Cao, Yang; Buchwalder, Christian; Choudhary, Neha; Jermilova, Una; Ramogida, Caterina F.; Saatchi, Katayoun; Häfeli, Urs O; Patrick, Brian O.; Orvig, Chris H<sub>4</sub>octox: Versatile Bimodal Octadentate Acyclic Chelating Ligand for Medicinal Inorganic Chemistry. Journal of the American Chemical Society, 2018, 140, 15487-15500 |
| 4133423 | CIF | C25 H37 Br Cl N O4 Si | P -1 | 8.6052; 10.8224; 16.0638 72.9449; 78.4844; 73.8845 | 1362.58 | Godfrey, Nicole A.; Schatz, Devon J.; Pronin, Sergey V. Twelve-Step Asymmetric Synthesis of (-)-Nodulisporic Acid C. Journal of the American Chemical Society, 2018, 140, 12770-12774 |
| 4133424 | CIF | C23 H29 N O2 | P 1 21/n 1 | 15.3662; 13.9849; 17.6635 90; 97.3964; 90 | 3764.2 | Godfrey, Nicole A.; Schatz, Devon J.; Pronin, Sergey V. Twelve-Step Asymmetric Synthesis of (-)-Nodulisporic Acid C. Journal of the American Chemical Society, 2018, 140, 12770-12774 |
| 4133425 | CIF | C25 H37 Br Cl N O4 Si | P 21 21 21 | 7.9555; 16.5243; 21.253 90; 90; 90 | 2793.9 | Godfrey, Nicole A.; Schatz, Devon J.; Pronin, Sergey V. Twelve-Step Asymmetric Synthesis of (-)-Nodulisporic Acid C. Journal of the American Chemical Society, 2018, 140, 12770-12774 |
| 4133426 | CIF | C76 H64 O | P 1 21/n 1 | 17.139; 17.0795; 20.123 90; 98.862; 90 | 5820.2 | Fernández-García, Jesús M; Evans, Paul J.; Medina Rivero, Samara; Fernández, Israel; García-Fresnadillo, David; Perles, Josefina; Casado, Juan; Martín, Nazario π-Extended Corannulene-Based Nanographenes: Selective Formation of Negative Curvature. Journal of the American Chemical Society, 2018, 140, 17188-17196 |
| 4133427 | CIF | C78 H61 Cl3.5 O1.5 | P -1 | 12.7107; 16.888; 17.1768 93.094; 100.081; 107.113 | 3447.6 | Fernández-García, Jesús M; Evans, Paul J.; Medina Rivero, Samara; Fernández, Israel; García-Fresnadillo, David; Perles, Josefina; Casado, Juan; Martín, Nazario π-Extended Corannulene-Based Nanographenes: Selective Formation of Negative Curvature. Journal of the American Chemical Society, 2018, 140, 17188-17196 |
| 4133428 | CIF | C9 H8 F N3 O4 S | P -1 | 9.0211; 9.8773; 12.0584 90.0808; 99.2615; 91.3378 | 1060.14 | Jangra, Harish; Chen, Quan; Fuks, Elina; Zenz, Ivo; Mayer, Peter; Ofial, Armin R.; Zipse, Hendrik; Mayr, Herbert Nucleophilicity and Electrophilicity Parameters for Predicting Absolute Rate Constants of Highly Asynchronous 1,3-Dipolar Cycloadditions of Aryldiazomethanes. Journal of the American Chemical Society, 2018, 140, 16758-16772 |
| 4133429 | CIF | C29 H29 N O4 | P 65 | 26.7901; 26.7901; 5.9921 90; 90; 120 | 3724.42 | Jangra, Harish; Chen, Quan; Fuks, Elina; Zenz, Ivo; Mayer, Peter; Ofial, Armin R.; Zipse, Hendrik; Mayr, Herbert Nucleophilicity and Electrophilicity Parameters for Predicting Absolute Rate Constants of Highly Asynchronous 1,3-Dipolar Cycloadditions of Aryldiazomethanes. Journal of the American Chemical Society, 2018, 140, 16758-16772 |
| 4133430 | CIF | C22 H17 N O4 S2 | P n a 21 | 11.1451; 16.3538; 10.6857 90; 90; 90 | 1947.63 | Jangra, Harish; Chen, Quan; Fuks, Elina; Zenz, Ivo; Mayer, Peter; Ofial, Armin R.; Zipse, Hendrik; Mayr, Herbert Nucleophilicity and Electrophilicity Parameters for Predicting Absolute Rate Constants of Highly Asynchronous 1,3-Dipolar Cycloadditions of Aryldiazomethanes. Journal of the American Chemical Society, 2018, 140, 16758-16772 |
| 4133431 | CIF | C20 H17 F3 O3 | C 1 2 1 | 27.392; 8.3185; 18.8264 90; 126.339; 90 | 3455.5 | Wiest, Johannes M.; Conner, Michael L.; Brown, M. Kevin Allenoates in Enantioselective [2+2] Cycloadditions: From a Mechanistic Curiosity to a Stereospecific Transformation. Journal of the American Chemical Society, 2018, 140, 15943-15949 |
| 4133432 | CIF | C22 H17 Br5 O2 | P 21 21 21 | 6.3241; 8.6365; 41.542 90; 90; 90 | 2268.9 | Wiest, Johannes M.; Conner, Michael L.; Brown, M. Kevin Allenoates in Enantioselective [2+2] Cycloadditions: From a Mechanistic Curiosity to a Stereospecific Transformation. Journal of the American Chemical Society, 2018, 140, 15943-15949 |
| 4133433 | CIF | C13 H14 O2 | P 21 21 21 | 5.766; 17.9957; 21.5234 90; 90; 90 | 2233.3 | Wiest, Johannes M.; Conner, Michael L.; Brown, M. Kevin Allenoates in Enantioselective [2+2] Cycloadditions: From a Mechanistic Curiosity to a Stereospecific Transformation. Journal of the American Chemical Society, 2018, 140, 15943-15949 |
| 4133447 | CIF | C39 H53 N3 O3 | P 1 | 6.3235; 8.7307; 16.0117 92.4545; 91.3114; 107.094 | 843.57 | Liu, Guofeng; Sheng, Jianhui; Teo, Wei Liang; Yang, Guangbao; Wu, Hongwei; Li, Yongxin; Zhao, Yanli Control on Dimensions and Supramolecular Chirality of Self-Assemblies through Light and Metal Ions. Journal of the American Chemical Society, 2018, 140, 16275-16283 |
| 4133448 | CIF | C86 H76 B F24 Fe6 N12 O2 | P -1 | 13.1308; 14.3903; 22.4509 94.5275; 91.9082; 100.816 | 4148.9 | Sánchez, Raúl Hernández; Betley, Theodore A. Thermally Persistent High-Spin Ground States in Octahedral Iron Clusters. Journal of the American Chemical Society, 2018, 140, 16792-16806 |
| 4133449 | CIF | C76 H78 F6 Fe6 N18 P | P -1 | 12.9618; 13.4006; 23.834 91.711; 104.785; 117.907 | 3482.9 | Sánchez, Raúl Hernández; Betley, Theodore A. Thermally Persistent High-Spin Ground States in Octahedral Iron Clusters. Journal of the American Chemical Society, 2018, 140, 16792-16806 |
| 4133450 | CIF | C62 H84 Fe6 N13 | C 1 2/c 1 | 23.0565; 15.886; 17.9778 90; 105.974; 90 | 6330.6 | Sánchez, Raúl Hernández; Betley, Theodore A. Thermally Persistent High-Spin Ground States in Octahedral Iron Clusters. Journal of the American Chemical Society, 2018, 140, 16792-16806 |
| 4133451 | CIF | C70 H97 Fe6 N12 O4 P | P -1 | 13.473; 15.5825; 17.2825 100.978; 107.685; 98.7756 | 3306.6 | Sánchez, Raúl Hernández; Betley, Theodore A. Thermally Persistent High-Spin Ground States in Octahedral Iron Clusters. Journal of the American Chemical Society, 2018, 140, 16792-16806 |
| 4133452 | CIF | C110 H152 Fe6 N18 | P -1 | 13.945; 14.132; 15.316 95.563; 103.823; 117.557 | 2521.8 | Sánchez, Raúl Hernández; Betley, Theodore A. Thermally Persistent High-Spin Ground States in Octahedral Iron Clusters. Journal of the American Chemical Society, 2018, 140, 16792-16806 |
| 4133453 | CIF | C348 H476 Cl20 Fe32 N12 O100 | P 1 21/n 1 | 29.594; 27.812; 30.175 90; 95.96; 90 | 24702 | Rathnayake, Asanka S.; Fraser, Hector W. L.; Brechin, Euan K.; Dalgarno, Scott J.; Baumeister, Jakob E.; White, Joshua; Rungthanaphatsophon, Pokpong; Walensky, Justin R.; Kelley, Steven P.; Barnes, Charles L.; Atwood, Jerry L. Site-Specific Metal Chelation Facilitates the Unveiling of Hidden Coordination Sites in an Fe<sup>II</sup>/Fe<sup>III</sup>-Seamed Pyrogallol[4]arene Nanocapsule. Journal of the American Chemical Society, 2018, 140, 15611-15615 |
| 4133454 | CIF | C63 H94 N6 O11 | P -1 | 12.2367; 12.6872; 22.0591 96.517; 100.607; 113.124 | 3029.61 | Li, Errui; Jie, Kecheng; Zhou, Yujuan; Zhao, Run; Huang, Feihe Post-Synthetic Modification of Nonporous Adaptive Crystals of Pillar[4]arene[1]quinone by Capturing Vaporized Amines. Journal of the American Chemical Society, 2018, 140, 15070-15079 |
| 4133455 | CIF | C66 H82 N3 O10 | P -1 | 12.4803; 13.1925; 22.0752 97.674; 99.394; 113.819 | 3199.3 | Li, Errui; Jie, Kecheng; Zhou, Yujuan; Zhao, Run; Huang, Feihe Post-Synthetic Modification of Nonporous Adaptive Crystals of Pillar[4]arene[1]quinone by Capturing Vaporized Amines. Journal of the American Chemical Society, 2018, 140, 15070-15079 |
| 4133456 | CIF | C60 H83 N3 O10.5 | P 1 2/c 1 | 18.251; 12.4803; 25.254 90; 94.868; 90 | 5731.6 | Li, Errui; Jie, Kecheng; Zhou, Yujuan; Zhao, Run; Huang, Feihe Post-Synthetic Modification of Nonporous Adaptive Crystals of Pillar[4]arene[1]quinone by Capturing Vaporized Amines. Journal of the American Chemical Society, 2018, 140, 15070-15079 |
| 4133457 | CIF | C66 H95 N3 O10 | P -1 | 12.4043; 12.7618; 22.4296 97.336; 100.5; 113.674 | 3116.82 | Li, Errui; Jie, Kecheng; Zhou, Yujuan; Zhao, Run; Huang, Feihe Post-Synthetic Modification of Nonporous Adaptive Crystals of Pillar[4]arene[1]quinone by Capturing Vaporized Amines. Journal of the American Chemical Society, 2018, 140, 15070-15079 |
| 4133458 | CIF | C63 H89 N3 O11 | P -1 | 12.2429; 12.5858; 22.187 96.046; 101.187; 114.345 | 2989.2 | Li, Errui; Jie, Kecheng; Zhou, Yujuan; Zhao, Run; Huang, Feihe Post-Synthetic Modification of Nonporous Adaptive Crystals of Pillar[4]arene[1]quinone by Capturing Vaporized Amines. Journal of the American Chemical Society, 2018, 140, 15070-15079 |
| 4133459 | CIF | C2 H5 N5 O6 | P -1 | 6.764; 7.374; 8.058 98.976; 100.324; 109.945 | 361.3 | Baxter, Amanda F.; Martin, Igor; Christe, Karl O.; Haiges, Ralf Formamidinium Nitroformate: An Insensitive RDX Alternative. Journal of the American Chemical Society, 2018, 140, 15089-15098 |
| 4133460 | CIF | C4 H10 N8 O12 | C 1 2/m 1 | 10.023; 9.24; 8.25 90; 116.017; 90 | 686.6 | Baxter, Amanda F.; Martin, Igor; Christe, Karl O.; Haiges, Ralf Formamidinium Nitroformate: An Insensitive RDX Alternative. Journal of the American Chemical Society, 2018, 140, 15089-15098 |
| 4133461 | CIF | C3 H8 N4 O6 | P 1 21/c 1 | 7.409; 9.031; 12.671 90; 92.666; 90 | 846.9 | Baxter, Amanda F.; Martin, Igor; Christe, Karl O.; Haiges, Ralf Formamidinium Nitroformate: An Insensitive RDX Alternative. Journal of the American Chemical Society, 2018, 140, 15089-15098 |
| 4133462 | CIF | C2 H7 N5 O6 | P 1 21/n 1 | 8.5003; 9.2107; 10.3713 90; 108.348; 90 | 770.73 | Baxter, Amanda F.; Martin, Igor; Christe, Karl O.; Haiges, Ralf Formamidinium Nitroformate: An Insensitive RDX Alternative. Journal of the American Chemical Society, 2018, 140, 15089-15098 |
| 4133463 | CIF | C2 H6 N4 O6 | P n m a | 8.226; 8.403; 10.367 90; 90; 90 | 716.6 | Baxter, Amanda F.; Martin, Igor; Christe, Karl O.; Haiges, Ralf Formamidinium Nitroformate: An Insensitive RDX Alternative. Journal of the American Chemical Society, 2018, 140, 15089-15098 |
| 4133464 | CIF | C34 H43 Br N2 O4 S Si | P -1 | 11.8977; 12.077; 12.1695 76.118; 89.803; 84.021 | 1687.89 | Yang, Pei-Jun; Qi, Ling; Liu, Zhen; Yang, Gaosheng; Chai, Zhuo Lewis Acid Catalyzed Dynamic Kinetic Asymmetric Transformation of Racemic N-Sulfonylaziridines. Journal of the American Chemical Society, 2018, 140, 17211-17217 |
| 4133465 | CIF | C27 H27 N3 O2 S | P 1 21 1 | 7.3353; 14.8015; 11.0786 90; 103.001; 90 | 1172.01 | Yang, Pei-Jun; Qi, Ling; Liu, Zhen; Yang, Gaosheng; Chai, Zhuo Lewis Acid Catalyzed Dynamic Kinetic Asymmetric Transformation of Racemic N-Sulfonylaziridines. Journal of the American Chemical Society, 2018, 140, 17211-17217 |
| 4133466 | CIF | C27 H27 N3 O2 S | P 1 21 1 | 9.084; 6.6655; 18.9521 90; 98.78; 90 | 1134.09 | Yang, Pei-Jun; Qi, Ling; Liu, Zhen; Yang, Gaosheng; Chai, Zhuo Lewis Acid Catalyzed Dynamic Kinetic Asymmetric Transformation of Racemic N-Sulfonylaziridines. Journal of the American Chemical Society, 2018, 140, 17211-17217 |
| 4133471 | CIF | C32 H44 F6 I Mn N4 O9 S2 | P 1 21/n 1 | 16.056; 15.486; 17.51 90; 111.03; 90 | 4064 | Jeong, Donghyun; Ohta, Takehiro; Cho, Jaeheung Structure and Reactivity of a Mononuclear Nonheme Manganese(III)-Iodosylarene Complex. Journal of the American Chemical Society, 2018, 140, 16037-16041 |
| 4133476 | CIF | C8 H16 B10 | P 1 21/n 1 | 6.7382; 13.5359; 14.4823 90; 95.384; 90 | 1315.07 | Tang, Cen; Zhang, Jiji; Zhang, Jie; Xie, Zuowei Regioselective Nucleophilic Alkylation/Arylation of B-H Bonds in o-Carboranes: An Alternative Method for Selective Cage Boron Functionalization. Journal of the American Chemical Society, 2018, 140, 16423-16427 |
| 4133477 | CIF | C18 H28 B10 | P -1 | 8.9801; 10.7996; 12.6811 112.362; 97.0307; 106.717 | 1051.3 | Tang, Cen; Zhang, Jiji; Zhang, Jie; Xie, Zuowei Regioselective Nucleophilic Alkylation/Arylation of B-H Bonds in o-Carboranes: An Alternative Method for Selective Cage Boron Functionalization. Journal of the American Chemical Society, 2018, 140, 16423-16427 |
| 4133478 | CIF | C17 H30 B10 | P 1 21/c 1 | 10.227; 7.9359; 26.7561 90; 91.4085; 90 | 2170.88 | Tang, Cen; Zhang, Jiji; Zhang, Jie; Xie, Zuowei Regioselective Nucleophilic Alkylation/Arylation of B-H Bonds in o-Carboranes: An Alternative Method for Selective Cage Boron Functionalization. Journal of the American Chemical Society, 2018, 140, 16423-16427 |
| 4133479 | CIF | C9 H18 B10 | P n a 21 | 11.9901; 13.1211; 9.2461 90; 90; 90 | 1454.63 | Tang, Cen; Zhang, Jiji; Zhang, Jie; Xie, Zuowei Regioselective Nucleophilic Alkylation/Arylation of B-H Bonds in o-Carboranes: An Alternative Method for Selective Cage Boron Functionalization. Journal of the American Chemical Society, 2018, 140, 16423-16427 |
| 4133484 | CIF | C30 H37 B O2 S | P 21 21 21 | 9.52; 13.4283; 20.6016 90; 90; 90 | 2633.66 | Tao, Zhonglin; Robb, Kevin A.; Panger, Jesse L.; Denmark, Scott E. Enantioselective, Lewis Base-Catalyzed Carbosulfenylation of Alkenylboronates by 1,2-Boronate Migration. Journal of the American Chemical Society, 2018, 140, 15621-15625 |
| 4133486 | CIF | C11 H11 F3 O2 | P -1 | 5.028; 10.144; 10.796 109.16; 95.29; 92.72 | 516.2 | Liu, Jie; Wei, Yongliang; Tang, Pingping Cobalt-Catalyzed Trifluoromethoxylation of Epoxides. Journal of the American Chemical Society, 2018, 140, 15194-15199 |
| 4133487 | CIF | C8 H5 N4 S2 | P b c a | 8.6067; 9.8761; 21.569 90; 90; 90 | 1833.4 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133488 | CIF | C8 H5 N4 S2 | P b c a | 8.6046; 9.8826; 21.43 90; 90; 90 | 1822.3 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133489 | CIF | C8 H5 N4 S2 | P b c a | 8.6191; 9.901; 21.737 90; 90; 90 | 1855 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133490 | CIF | C8 H5 N4 S2 | P b c a | 8.7702; 9.952; 21.743 90; 90; 90 | 1897.8 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133491 | CIF | C8 H5 N4 S2 | P b c a | 8.7678; 9.943; 21.634 90; 90; 90 | 1886 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133492 | CIF | C8 H5 N4 S2 | P b c a | 8.6175; 9.8992; 21.74 90; 90; 90 | 1854.6 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133493 | CIF | C8 H5 N4 S2 | P b c a | 8.6168; 9.898; 21.715 90; 90; 90 | 1852.1 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133494 | CIF | C8 H5 N4 S2 | P b c a | 8.6152; 9.8905; 21.64 90; 90; 90 | 1843.9 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133495 | CIF | C8 H5 N4 S2 | P b c a | 8.6189; 9.8998; 21.717 90; 90; 90 | 1853 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133496 | CIF | C8 H5 N4 S2 | P b c a | 8.7703; 9.946; 21.667 90; 90; 90 | 1890 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133497 | CIF | C8 H5 N4 S2 | P b c a | 8.6116; 9.885; 21.582 90; 90; 90 | 1837.2 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133498 | CIF | C8 H5 N4 S2 | P b c a | 8.6181; 9.8959; 21.651 90; 90; 90 | 1846.5 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133499 | CIF | C8 H5 N4 S2 | P b c a | 8.7614; 9.9569; 21.863 90; 90; 90 | 1907.2 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133500 | CIF | C8 H5 N4 S2 | P b c a | 8.7668; 9.9419; 21.658 90; 90; 90 | 1887.7 | Mills, Michelle B.; Wohlhauser, Tobie; Stein, Benjamin; Verduyn, Willem R.; Song, Ellen; Dechambenoit, Pierre; Rouzières, Mathieu; Clérac, Rodolphe; Preuss, Kathryn E. Magnetic Bistability in Crystalline Organic Radicals: The Interplay of H-bonding, Pancake Bonding, and Electrostatics in 4-(2'-Benzimidazolyl)-1,2,3,5-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 16904-16908 |
| 4133501 | CIF | C43 H46 | P -1 | 8.824; 13.4501; 15.5579 67.708; 74.052; 86.15 | 1641.28 | Choi, Inho; Yang, Sanghee; Choi, Tae-Lim Preparing Semiconducting Nanoribbons with Tunable Length and Width via Crystallization-Driven Self-Assembly of a Simple Conjugated Homopolymer. Journal of the American Chemical Society, 2018, 140, 17218-17225 |
| 4133502 | CIF | C118 H46 Cl6 N4 Ni S0 U | C 1 2/m 1 | 25.18; 15.2158; 19.325 90; 92.509; 90 | 7397 | Cai, Wenting; Abella, Laura; Zhuang, Jiaxin; Zhang, Xingxing; Feng, Lai; Wang, Yaofeng; Morales-Martínez, Roser; Esper, Ronda; Boero, Mauro; Metta-Magaña, Alejandro; Rodríguez-Fortea, Antonio; Poblet, Josep M.; Echegoyen, Luis; Chen, Ning Synthesis and Characterization of Non-Isolated-Pentagon-Rule Actinide Endohedral Metallofullerenes U@ C<sub>1</sub>(17418)-C<sub>76</sub>, U@ C<sub>1</sub>(28324)-C<sub>80</sub>, and Th@ C<sub>1</sub>(28324)-C<sub>80</sub>: Low-Symmetry Cage Selection Directed by a Tetravalent Ion. Journal of the American Chemical Society, 2018, 140, 18039-18050 |
| 4133503 | CIF | C113 H45 Cl3 I0 N4 Ni S0 U | P 1 2/c 1 | 18.686; 15.184; 25.496 90; 91.39; 90 | 7232 | Cai, Wenting; Abella, Laura; Zhuang, Jiaxin; Zhang, Xingxing; Feng, Lai; Wang, Yaofeng; Morales-Martínez, Roser; Esper, Ronda; Boero, Mauro; Metta-Magaña, Alejandro; Rodríguez-Fortea, Antonio; Poblet, Josep M.; Echegoyen, Luis; Chen, Ning Synthesis and Characterization of Non-Isolated-Pentagon-Rule Actinide Endohedral Metallofullerenes U@ C<sub>1</sub>(17418)-C<sub>76</sub>, U@ C<sub>1</sub>(28324)-C<sub>80</sub>, and Th@ C<sub>1</sub>(28324)-C<sub>80</sub>: Low-Symmetry Cage Selection Directed by a Tetravalent Ion. Journal of the American Chemical Society, 2018, 140, 18039-18050 |
| 4133504 | CIF | C128 H56 N4 Ni Th | C 1 2/c 1 | 45.4289; 15.0655; 25.2663 90; 120.302; 90 | 14930 | Cai, Wenting; Abella, Laura; Zhuang, Jiaxin; Zhang, Xingxing; Feng, Lai; Wang, Yaofeng; Morales-Martínez, Roser; Esper, Ronda; Boero, Mauro; Metta-Magaña, Alejandro; Rodríguez-Fortea, Antonio; Poblet, Josep M.; Echegoyen, Luis; Chen, Ning Synthesis and Characterization of Non-Isolated-Pentagon-Rule Actinide Endohedral Metallofullerenes U@ C<sub>1</sub>(17418)-C<sub>76</sub>, U@ C<sub>1</sub>(28324)-C<sub>80</sub>, and Th@ C<sub>1</sub>(28324)-C<sub>80</sub>: Low-Symmetry Cage Selection Directed by a Tetravalent Ion. Journal of the American Chemical Society, 2018, 140, 18039-18050 |
| 4133505 | CIF | C26 H27 N3 O7 S | P 1 21/c 1 | 9.7778; 10.9762; 23.229 90; 93.747; 90 | 2487.68 | Farndon, Joshua J.; Young, Tom A.; Bower, John F. Stereospecific Alkene Aziridination Using a Bifunctional Amino-Reagent: An Aza-Prilezhaev Reaction. Journal of the American Chemical Society, 2018, 140, 17846-17850 |
| 4133506 | CIF | C15 H20 Cl N O2 | P 1 21/c 1 | 8.2302; 15.7113; 11.2016 90; 93.2127; 90 | 1446.17 | Farndon, Joshua J.; Young, Tom A.; Bower, John F. Stereospecific Alkene Aziridination Using a Bifunctional Amino-Reagent: An Aza-Prilezhaev Reaction. Journal of the American Chemical Society, 2018, 140, 17846-17850 |
| 4133507 | CIF | C11 H12 Cl N | P 21 21 21 | 5.7714; 7.3205; 22.5971 90; 90; 90 | 954.72 | Farndon, Joshua J.; Young, Tom A.; Bower, John F. Stereospecific Alkene Aziridination Using a Bifunctional Amino-Reagent: An Aza-Prilezhaev Reaction. Journal of the American Chemical Society, 2018, 140, 17846-17850 |
| 4133508 | CIF | C26 H28 N2 O7 S | P 1 21/n 1 | 12.6; 14.7908; 13.3412 90; 105.054; 90 | 2400.99 | Farndon, Joshua J.; Young, Tom A.; Bower, John F. Stereospecific Alkene Aziridination Using a Bifunctional Amino-Reagent: An Aza-Prilezhaev Reaction. Journal of the American Chemical Society, 2018, 140, 17846-17850 |
| 4133509 | CIF | C24 H31 F3 N2 O7 S | P 1 21/c 1 | 16.3198; 12.408; 13.98 90; 113.396; 90 | 2598.1 | Farndon, Joshua J.; Young, Tom A.; Bower, John F. Stereospecific Alkene Aziridination Using a Bifunctional Amino-Reagent: An Aza-Prilezhaev Reaction. Journal of the American Chemical Society, 2018, 140, 17846-17850 |
| 4133516 | CIF | C45 H51 N9 O9 | C 1 2/c 1 | 32.4628; 19.1378; 14.8992 90; 116.386; 90 | 8292 | Zhao, Chenfei; Diercks, Christian S.; Zhu, Chenhui; Hanikel, Nikita; Pei, Xiaokun; Yaghi, Omar M. Urea-Linked Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 16438-16441 |
| 4133517 | CIF | C123 H119 Cu2 F12 N9 O P6 | C 1 2/c 1 | 27.5497; 16.772; 24.5756 90; 96.29; 90 | 11287.1 | Takeda, Hiroyuki; Kamiyama, Hiroko; Okamoto, Kouhei; Irimajiri, Mina; Mizutani, Toshihide; Koike, Kazuhide; Sekine, Akiko; Ishitani, Osamu Highly Efficient and Robust Photocatalytic Systems for CO<sub>2</sub> Reduction Consisting of a Cu(I) Photosensitizer and Mn(I) Catalysts. Journal of the American Chemical Society, 2018, 140, 17241-17254 |
| 4133518 | CIF | C20 H20 O3 S | P -1 | 8.3514; 13.3861; 15.2817 83.607; 86.533; 87.048 | 1692.92 | Gerwien, Aaron; Mayer, Peter; Dube, Henry Photon-Only Molecular Motor with Reverse Temperature-Dependent Efficiency. Journal of the American Chemical Society, 2018, 140, 16442-16445 |
| 4133519 | CIF | C20 H20 O3 S | P b c a | 13.0489; 15.1168; 16.9239 90; 90; 90 | 3338.37 | Gerwien, Aaron; Mayer, Peter; Dube, Henry Photon-Only Molecular Motor with Reverse Temperature-Dependent Efficiency. Journal of the American Chemical Society, 2018, 140, 16442-16445 |
| 4133520 | CIF | C20 H20 O3 S | P -1 | 10.0205; 10.8597; 16.2287 81.764; 80.799; 85.353 | 1722.24 | Gerwien, Aaron; Mayer, Peter; Dube, Henry Photon-Only Molecular Motor with Reverse Temperature-Dependent Efficiency. Journal of the American Chemical Society, 2018, 140, 16442-16445 |
| 4133521 | CIF | C20 H20 O3 S | P 21 21 21 | 10.3115; 12.0645; 13.9574 90; 90; 90 | 1736.34 | Gerwien, Aaron; Mayer, Peter; Dube, Henry Photon-Only Molecular Motor with Reverse Temperature-Dependent Efficiency. Journal of the American Chemical Society, 2018, 140, 16442-16445 |
| 4133522 | CIF | C16 H8 Br F5 N2 O Pd | P b c a | 6.905; 20.104; 22.846 90; 90; 90 | 3171.44 | Salamanca, Vanesa; Toledo, Alberto; Albéniz, Ana C [2,2'-Bipyridin]-6(1 H)-one, a Truly Cooperating Ligand in the Palladium-Mediated C-H Activation Step: Experimental Evidence in the Direct C-3 Arylation of Pyridine. Journal of the American Chemical Society, 2018, 140, 17851-17856 |
| 4133523 | CIF | C21 H16 F5 N3 O3 Pd | P -1 | 7.4795; 12.5387; 12.6596 71.425; 83.843; 75.99 | 1091.35 | Salamanca, Vanesa; Toledo, Alberto; Albéniz, Ana C [2,2'-Bipyridin]-6(1 H)-one, a Truly Cooperating Ligand in the Palladium-Mediated C-H Activation Step: Experimental Evidence in the Direct C-3 Arylation of Pyridine. Journal of the American Chemical Society, 2018, 140, 17851-17856 |
| 4133524 | CIF | C22 H16 F3 N3 O Pd | P b c a | 7.8072; 15.7255; 32.2864 90; 90; 90 | 3963.9 | Salamanca, Vanesa; Toledo, Alberto; Albéniz, Ana C [2,2'-Bipyridin]-6(1 H)-one, a Truly Cooperating Ligand in the Palladium-Mediated C-H Activation Step: Experimental Evidence in the Direct C-3 Arylation of Pyridine. Journal of the American Chemical Society, 2018, 140, 17851-17856 |
| 4133525 | CIF | C38 H42 N2 O4 | P 21 21 21 | 9.6036; 47.197; 7.3012 90; 90; 90 | 3309.4 | Zhang, Hong-Hao; Zhao, Jia-Jia; Yu, Shouyun Enantioselective Allylic Alkylation with 4-Alkyl-1,4-dihydro-pyridines Enabled by Photoredox/Palladium Cocatalysis. Journal of the American Chemical Society, 2018, 140, 16914-16919 |
| 4133529 | CIF | C23 H24 Br Fe N3 O | P 1 21 1 | 7.2267; 10.4032; 14.3685 90; 96.435; 90 | 1073.4 | Seidl, Frederick J.; Min, Chang; Lopez, Jovan A.; Burns, Noah Z. Catalytic Regio- and Enantioselective Haloazidation of Allylic Alcohols. Journal of the American Chemical Society, 2018, 140, 15646-15650 |
| 4133530 | CIF | C23 H24 Cl Fe N3 O | P 1 21 1 | 7.2168; 10.3152; 14.2483 90; 95.891; 90 | 1055.08 | Seidl, Frederick J.; Min, Chang; Lopez, Jovan A.; Burns, Noah Z. Catalytic Regio- and Enantioselective Haloazidation of Allylic Alcohols. Journal of the American Chemical Society, 2018, 140, 15646-15650 |
| 4133531 | CIF | C30 H24 O2 | P 21 21 21 | 9.323; 15.2792; 15.3454 90; 90; 90 | 2185.92 | Pizzolato, Stefano F.; Štacko, Peter; Kistemaker, Jos C. M.; van Leeuwen, Thomas; Otten, Edwin; Feringa, Ben L. Central-to-Helical-to-Axial-to-Central Transfer of Chirality with a Photoresponsive Catalyst. Journal of the American Chemical Society, 2018, 140, 17278-17289 |
| 4133532 | CIF | C18 H66.5 N8 O35 S6 V5 W | P 21 21 21 | 15.49; 16.481; 21.309 90; 90; 90 | 5440 | Zhang, Yuteng; Gan, Hongmei; Qin, Chao; Wang, Xinlong; Su, Zhongmin; Zaworotko, Michael J. Self-Assembly of Goldberg Polyhedra from a Concave [WV<sub>5</sub>O<sub>11</sub>(RCO<sub>2</sub>)<sub>5</sub>(SO<sub>4</sub>)]<sup>3-</sup> Building Block with 5-Fold Symmetry. Journal of the American Chemical Society, 2018, 140, 17365-17368 |
| 4133533 | CIF | C240 H120 O313.5 S12 V65 W15 | P 42/m n m | 55.536; 55.536; 35.633 90; 90; 90 | 109901 | Zhang, Yuteng; Gan, Hongmei; Qin, Chao; Wang, Xinlong; Su, Zhongmin; Zaworotko, Michael J. Self-Assembly of Goldberg Polyhedra from a Concave [WV<sub>5</sub>O<sub>11</sub>(RCO<sub>2</sub>)<sub>5</sub>(SO<sub>4</sub>)]<sup>3-</sup> Building Block with 5-Fold Symmetry. Journal of the American Chemical Society, 2018, 140, 17365-17368 |
| 4133534 | CIF | C450 H540 N45 O323.5 S12 V65 W15 | P 42/m m c | 43.2511; 43.2511; 39.0469 90; 90; 90 | 73043 | Zhang, Yuteng; Gan, Hongmei; Qin, Chao; Wang, Xinlong; Su, Zhongmin; Zaworotko, Michael J. Self-Assembly of Goldberg Polyhedra from a Concave [WV<sub>5</sub>O<sub>11</sub>(RCO<sub>2</sub>)<sub>5</sub>(SO<sub>4</sub>)]<sup>3-</sup> Building Block with 5-Fold Symmetry. Journal of the American Chemical Society, 2018, 140, 17365-17368 |
| 4133535 | CIF | C268 H412 N44 O316 S16 V60 W12 | C 1 2/m 1 | 51.595; 29.778; 29.872 90; 110.903; 90 | 42875 | Zhang, Yuteng; Gan, Hongmei; Qin, Chao; Wang, Xinlong; Su, Zhongmin; Zaworotko, Michael J. Self-Assembly of Goldberg Polyhedra from a Concave [WV<sub>5</sub>O<sub>11</sub>(RCO<sub>2</sub>)<sub>5</sub>(SO<sub>4</sub>)]<sup>3-</sup> Building Block with 5-Fold Symmetry. Journal of the American Chemical Society, 2018, 140, 17365-17368 |
| 4133536 | CIF | C556 H544 N98 O304 S12 V60 W12 | P 42/m m c | 41.174; 41.174; 53.404 90; 90; 90 | 90536 | Zhang, Yuteng; Gan, Hongmei; Qin, Chao; Wang, Xinlong; Su, Zhongmin; Zaworotko, Michael J. Self-Assembly of Goldberg Polyhedra from a Concave [WV<sub>5</sub>O<sub>11</sub>(RCO<sub>2</sub>)<sub>5</sub>(SO<sub>4</sub>)]<sup>3-</sup> Building Block with 5-Fold Symmetry. Journal of the American Chemical Society, 2018, 140, 17365-17368 |
| 4133537 | CIF | C540 H240 N60 O324 S10 V60 W12 | P 42/m m c | 41.893; 41.893; 53.783 90; 90; 90 | 94390 | Zhang, Yuteng; Gan, Hongmei; Qin, Chao; Wang, Xinlong; Su, Zhongmin; Zaworotko, Michael J. Self-Assembly of Goldberg Polyhedra from a Concave [WV<sub>5</sub>O<sub>11</sub>(RCO<sub>2</sub>)<sub>5</sub>(SO<sub>4</sub>)]<sup>3-</sup> Building Block with 5-Fold Symmetry. Journal of the American Chemical Society, 2018, 140, 17365-17368 |
| 4133538 | CIF | C19 H23 N O4 | P 1 21 1 | 6.6824; 6.7915; 19.0741 90; 100.083; 90 | 852.28 | Zhou, Yuebiao; Shi, Ying; Torker, Sebastian; Hoveyda, Amir H. S<sub>N</sub>2″-Selective and Enantioselective Substitution with Unsaturated Organoboron Compounds and Catalyzed by a Sulfonate-Containing NHC-Cu Complex. Journal of the American Chemical Society, 2018, 140, 16842-16854 |
| 4133539 | CIF | C74 H105 I N2 O0.5 U | P 1 21/n 1 | 15.2986; 23.8567; 18.6523 90; 96.007; 90 | 6770.2 | Billow, Brennan S.; Livesay, Brooke N.; Mokhtarzadeh, Charles C.; McCracken, John; Shores, Matthew P.; Boncella, James M.; Odom, Aaron L. Synthesis and Characterization of a Neutral U(II) Arene Sandwich Complex. Journal of the American Chemical Society, 2018, 140, 17369-17373 |
| 4133540 | CIF | C76 H108 N2 O U | C 1 2/c 1 | 18.0536; 16.8949; 22.7572 90; 106.972; 90 | 6639 | Billow, Brennan S.; Livesay, Brooke N.; Mokhtarzadeh, Charles C.; McCracken, John; Shores, Matthew P.; Boncella, James M.; Odom, Aaron L. Synthesis and Characterization of a Neutral U(II) Arene Sandwich Complex. Journal of the American Chemical Society, 2018, 140, 17369-17373 |
| 4133541 | CIF | C105 H114.5 B F24 N2 O0.25 U | P 1 21/c 1 | 14.7775; 16.4035; 41.8881 90; 90.893; 90 | 10152.6 | Billow, Brennan S.; Livesay, Brooke N.; Mokhtarzadeh, Charles C.; McCracken, John; Shores, Matthew P.; Boncella, James M.; Odom, Aaron L. Synthesis and Characterization of a Neutral U(II) Arene Sandwich Complex. Journal of the American Chemical Society, 2018, 140, 17369-17373 |
| 4133542 | CIF | C78 H114 I N2 U | P 1 21/n 1 | 13.3008; 15.0013; 36.19 90; 94.323; 90 | 7200.4 | Billow, Brennan S.; Livesay, Brooke N.; Mokhtarzadeh, Charles C.; McCracken, John; Shores, Matthew P.; Boncella, James M.; Odom, Aaron L. Synthesis and Characterization of a Neutral U(II) Arene Sandwich Complex. Journal of the American Chemical Society, 2018, 140, 17369-17373 |
| 4133543 | CIF | C25 H38 O6 Si | P 21 21 21 | 6.608; 9.8783; 38.8492 90; 90; 90 | 2535.91 | Economou, Christos; Tomanik, Martin; Herzon, Seth B. Synthesis of Myrocin G, the Putative Active Form of the Myrocin Antitumor Antibiotics. Journal of the American Chemical Society, 2018, 140, 16058-16061 |
| 4133544 | CIF | C13 H13 N O2 | P b c a | 9.67683; 11.05812; 20.5604 90; 90; 90 | 2200.12 | Verbraeken, Bart; Hullaert, Jan; van Guyse, Joachim; Van Hecke, Kristof; Winne, Johan; Hoogenboom, Richard The Elusive Seven-Membered Cyclic Imino Ether Tetrahydrooxazepine. Journal of the American Chemical Society, 2018, 140, 17404-17408 |
| 4133545 | CIF | C10 H13 N O S | P 1 21 1 | 6.45; 10.41727; 14.8501 90; 99.2411; 90 | 984.85 | Verbraeken, Bart; Hullaert, Jan; van Guyse, Joachim; Van Hecke, Kristof; Winne, Johan; Hoogenboom, Richard The Elusive Seven-Membered Cyclic Imino Ether Tetrahydrooxazepine. Journal of the American Chemical Society, 2018, 140, 17404-17408 |
| 4133546 | CIF | C11 H13 N O | P 1 21/c 1 | 11.49513; 7.96423; 10.68229 90; 109.079; 90 | 924.24 | Verbraeken, Bart; Hullaert, Jan; van Guyse, Joachim; Van Hecke, Kristof; Winne, Johan; Hoogenboom, Richard The Elusive Seven-Membered Cyclic Imino Ether Tetrahydrooxazepine. Journal of the American Chemical Society, 2018, 140, 17404-17408 |
| 4133553 | CIF | C206.85 Cu4.8 I4.8 N48 O157.62 Zr18 | P m -3 m | 22.7496; 22.7496; 22.7496 90; 90; 90 | 11773.9 | Sun, Chenyue; Skorupskii, Grigorii; Dou, Jin-Hu; Wright, Ashley M.; Dincă, Mircea Reversible Metalation and Catalysis with a Scorpionate-like Metallo-ligand in a Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 17394-17398 |
| 4133554 | CIF | C28 H33 N O3 | P -1 | 7.7628; 9.63; 16.0084 84.37; 88.502; 70.429 | 1122.11 | Okamoto, Yuta; Tanioka, Masaru; Muranaka, Atsuya; Miyamoto, Kazunori; Aoyama, Tetsuya; Ouyang, Xingmei; Kamino, Shinichiro; Sawada, Daisuke; Uchiyama, Masanobu Stable Thiele's Hydrocarbon Derivatives Exhibiting Near-Infrared Absorption/Emission and Two-Step Electrochromism. Journal of the American Chemical Society, 2018, 140, 17857-17861 |
| 4133555 | CIF | C58 H66 N2 O4 | P -1 | 7.7432; 9.6665; 16.3637 84.384; 76.739; 71.034 | 1127.08 | Okamoto, Yuta; Tanioka, Masaru; Muranaka, Atsuya; Miyamoto, Kazunori; Aoyama, Tetsuya; Ouyang, Xingmei; Kamino, Shinichiro; Sawada, Daisuke; Uchiyama, Masanobu Stable Thiele's Hydrocarbon Derivatives Exhibiting Near-Infrared Absorption/Emission and Two-Step Electrochromism. Journal of the American Chemical Society, 2018, 140, 17857-17861 |
| 4133556 | CIF | C36 H45 Li N8 Si0.97 | P 1 n 1 | 10.729; 20.345; 16.436 90; 90.71; 90 | 3587.4 | Ebner, Fabian; Greb, Lutz Calix[4]pyrrole Hydridosilicate: The Elusive Planar Tetracoordinate Silicon Imparts Striking Stability to Its Anionic Silicon Hydride. Journal of the American Chemical Society, 2018, 140, 17409-17412 |
| 4133557 | CIF | C29 H34 Cl2 K N4 Si | P 1 21 1 | 9.009; 13.671; 11.931 90; 108.59; 90 | 1392.8 | Ebner, Fabian; Greb, Lutz Calix[4]pyrrole Hydridosilicate: The Elusive Planar Tetracoordinate Silicon Imparts Striking Stability to Its Anionic Silicon Hydride. Journal of the American Chemical Society, 2018, 140, 17409-17412 |
| 4133558 | CIF | C20 H25 O P | P 21 21 21 | 5.9083; 13.523; 21.616 90; 90; 90 | 1727.1 | Nie, Shao-Zhen; Davison, Ryan T.; Dong, Vy M. Enantioselective Coupling of Dienes and Phosphine Oxides. Journal of the American Chemical Society, 2018, 140, 16450-16454 |
| 4133559 | CIF | C508.8 H317.76 B16 F64 Fe8 N120 O7.68 Pd6 | I 4 2 2 | 32.5147; 32.5147; 37.7674 90; 90; 90 | 39927.9 | Hou, Ya-Jun; Wu, Kai; Wei, Zhang-Wen; Li, Kang; Lu, Yu-Lin; Zhu, Cheng-Yi; Wang, Jing-Si; Pan, Mei; Jiang, Ji-Jun; Li, Guang-Qin; Su, Cheng-Yong Design and Enantioresolution of Homochiral Fe(II)-Pd(II) Coordination Cages from Stereolabile Metalloligands: Stereochemical Stability and Enantioselective Separation. Journal of the American Chemical Society, 2018, 140, 18183-18191 |
| 4133560 | CIF | C488 H303.2 Fe8 N120 O5.6 Pd6 | I 4 2 2 | 32.3616; 32.3616; 37.4948 90; 90; 90 | 39267 | Hou, Ya-Jun; Wu, Kai; Wei, Zhang-Wen; Li, Kang; Lu, Yu-Lin; Zhu, Cheng-Yi; Wang, Jing-Si; Pan, Mei; Jiang, Ji-Jun; Li, Guang-Qin; Su, Cheng-Yong Design and Enantioresolution of Homochiral Fe(II)-Pd(II) Coordination Cages from Stereolabile Metalloligands: Stereochemical Stability and Enantioselective Separation. Journal of the American Chemical Society, 2018, 140, 18183-18191 |
| 4133561 | CIF | C126 H139 Br20 I N2 O20 | P -1 | 12.3928; 15.6251; 18.2747 82.203; 81.506; 76.519 | 3384.5 | Hua, Bin; Zhou, Wei; Yang, Zhaoliang; Zhang, Zhihua; Shao, Li; Zhu, Haiming; Huang, Feihe Supramolecular Solid-State Microlaser Constructed from Pillar[5]arene-Based Host-Guest Complex Microcrystals. Journal of the American Chemical Society, 2018, 140, 15651-15654 |
| 4133562 | CIF | C192 H132 F20 N8 | P 1 21/c 1 | 29.325; 18.3887; 37.359 90; 111.838; 90 | 18700 | Ke, Xian-Sheng; Kim, Taeyeon; He, Qing; Lynch, Vincent M.; Kim, Dongho; Sessler, Jonathan L. Three-Dimensional Fully Conjugated Carbaporphyrin Cage. Journal of the American Chemical Society, 2018, 140, 16455-16459 |
| 4133563 | CIF | C208 H136 F44 N8 O16 | P 1 21/c 1 | 40.02; 14.0404; 43.5179 90; 111.986; 90 | 22674.3 | Ke, Xian-Sheng; Kim, Taeyeon; He, Qing; Lynch, Vincent M.; Kim, Dongho; Sessler, Jonathan L. Three-Dimensional Fully Conjugated Carbaporphyrin Cage. Journal of the American Chemical Society, 2018, 140, 16455-16459 |
| 4133564 | CIF | C49 H75 N3 P2 Zr | P 1 21/c 1 | 16.199; 13.062; 23.636 90; 96.243; 90 | 4972 | Grant, Lauren N.; Pinter, Balazs; Gu, Jun; Mindiola, Daniel J. Molecular Zirconium Nitride Super Base from a Mononuclear Parent Imide. Journal of the American Chemical Society, 2018, 140, 17399-17403 |
| 4133565 | CIF | C44 H62 N8 P2 Zr | P b c a | 17.0256; 15.8891; 32.2683 90; 90; 90 | 8729.3 | Grant, Lauren N.; Pinter, Balazs; Gu, Jun; Mindiola, Daniel J. Molecular Zirconium Nitride Super Base from a Mononuclear Parent Imide. Journal of the American Chemical Society, 2018, 140, 17399-17403 |
| 4133566 | CIF | C124 H172 Li2 N6 O2 P4 Zr2 | P 42 21 2 | 14.569; 14.569; 27.444 90; 90; 90 | 5825.1 | Grant, Lauren N.; Pinter, Balazs; Gu, Jun; Mindiola, Daniel J. Molecular Zirconium Nitride Super Base from a Mononuclear Parent Imide. Journal of the American Chemical Society, 2018, 140, 17399-17403 |
| 4133571 | CIF | C42 H28 K2 | P 1 21/c 1 | 12.85953; 8.3632; 14.53708 90; 71.2596; 90 | 1480.53 | Zhang, Jiliang; Whitehead, George F. S.; Manning, Troy D.; Stewart, David; Hiley, Craig I.; Pitcher, Michael J.; Jansat, Susanna; Prassides, Kosmas; Rosseinsky, Matthew J. Reactivity of Solid Rubrene with Potassium: Competition between Intercalation and Molecular Decomposition. Journal of the American Chemical Society, 2018, 140, 18162-18172 |
| 4133572 | CIF | C42 H26.16 | P 1 21/c 1 | 13.0398; 11.6254; 18.7191 90; 108.991; 90 | 2683.23 | Zhang, Jiliang; Whitehead, George F. S.; Manning, Troy D.; Stewart, David; Hiley, Craig I.; Pitcher, Michael J.; Jansat, Susanna; Prassides, Kosmas; Rosseinsky, Matthew J. Reactivity of Solid Rubrene with Potassium: Competition between Intercalation and Molecular Decomposition. Journal of the American Chemical Society, 2018, 140, 18162-18172 |
| 4133574 | CIF | C42 H73 Fe N P2 Si | P 1 21/n 1 | 16.2359; 16.4096; 17.4876 90; 111.339; 90 | 4339.71 | Ott, Jonas C.; Wadepohl, Hubert; Enders, Markus; Gade, Lutz H. Taking Solution Proton NMR to Its Extreme: Prediction and Detection of a Hydride Resonance in an Intermediate-Spin Iron Complex. Journal of the American Chemical Society, 2018, 140, 17413-17417 |
| 4133575 | CIF | C45 H69 Fe N P2 | I -4 | 23.62428; 23.62428; 15.31409 90; 90; 90 | 8546.89 | Ott, Jonas C.; Wadepohl, Hubert; Enders, Markus; Gade, Lutz H. Taking Solution Proton NMR to Its Extreme: Prediction and Detection of a Hydride Resonance in an Intermediate-Spin Iron Complex. Journal of the American Chemical Society, 2018, 140, 17413-17417 |
| 4133576 | CIF | C39.25 H66 Fe N P2 | P 1 2/c 1 | 25.6211; 13.0431; 47.8048 90; 102.544; 90 | 15594 | Ott, Jonas C.; Wadepohl, Hubert; Enders, Markus; Gade, Lutz H. Taking Solution Proton NMR to Its Extreme: Prediction and Detection of a Hydride Resonance in an Intermediate-Spin Iron Complex. Journal of the American Chemical Society, 2018, 140, 17413-17417 |
| 4133577 | CIF | C104 H112 B2 Co2 N4 S2 | P 1 21/n 1 | 15.8118; 14.5805; 17.8689 90; 97.245; 90 | 4086.7 | Zhu, Congzhi; Ji, Xiaozhou; You, Di; Chen, Teresa L.; Mu, Anthony U.; Barker, Kayla P.; Klivansky, Liana M.; Liu, Yi; Fang, Lei Extraordinary Redox Activities in Ladder-Type Conjugated Molecules Enabled by B ←N Coordination-Promoted Delocalization and Hyperconjugation. Journal of the American Chemical Society, 2018, 140, 18173-18182 |
| 4133578 | CIF | C66 H54 B2 Cl6 N4 S2 | P 1 21/n 1 | 10.3742; 20.3276; 14.6088 90; 105.28; 90 | 2971.84 | Zhu, Congzhi; Ji, Xiaozhou; You, Di; Chen, Teresa L.; Mu, Anthony U.; Barker, Kayla P.; Klivansky, Liana M.; Liu, Yi; Fang, Lei Extraordinary Redox Activities in Ladder-Type Conjugated Molecules Enabled by B ←N Coordination-Promoted Delocalization and Hyperconjugation. Journal of the American Chemical Society, 2018, 140, 18173-18182 |
| 4133579 | CIF | C70.75 H67.5 B2 Cl9.5 N4 S2 Sb | P b c a | 23.9213; 17.921; 32.1974 90; 90; 90 | 13802.8 | Zhu, Congzhi; Ji, Xiaozhou; You, Di; Chen, Teresa L.; Mu, Anthony U.; Barker, Kayla P.; Klivansky, Liana M.; Liu, Yi; Fang, Lei Extraordinary Redox Activities in Ladder-Type Conjugated Molecules Enabled by B ←N Coordination-Promoted Delocalization and Hyperconjugation. Journal of the American Chemical Society, 2018, 140, 18173-18182 |
| 4133580 | CIF | C50 H66 N4 Ni Si2 | P c c a | 17.6886; 14.3121; 19.8456 90; 90; 90 | 5024.13 | Kostenko, Arseni; Driess, Matthias Geometrically Compelled Disilene with λ<sup>4</sup>-Coordinate Si<sup>II</sup> Atoms. Journal of the American Chemical Society, 2018, 140, 16962-16966 |
| 4133581 | CIF | C42 H54 N4 O2 Si2 | C 1 2/c 1 | 14.768; 10.4696; 25.1558 90; 98.675; 90 | 3845 | Kostenko, Arseni; Driess, Matthias Geometrically Compelled Disilene with λ<sup>4</sup>-Coordinate Si<sup>II</sup> Atoms. Journal of the American Chemical Society, 2018, 140, 16962-16966 |
| 4133582 | CIF | C55 H64 N4 O Si2 | P -1 | 12.6253; 12.9455; 16.4249 83.107; 84.228; 66.911 | 2447.4 | Kostenko, Arseni; Driess, Matthias Geometrically Compelled Disilene with λ<sup>4</sup>-Coordinate Si<sup>II</sup> Atoms. Journal of the American Chemical Society, 2018, 140, 16962-16966 |
| 4133583 | CIF | C42 H54 N4 Si2 | C 1 2/c 1 | 14.12662; 10.49281; 25.5869 90; 94.5089; 90 | 3780.96 | Kostenko, Arseni; Driess, Matthias Geometrically Compelled Disilene with λ<sup>4</sup>-Coordinate Si<sup>II</sup> Atoms. Journal of the American Chemical Society, 2018, 140, 16962-16966 |
| 4133584 | CIF | C44 H58 N4 Si2 | P 1 21/n 1 | 9.1557; 35.74; 12.4628 90; 96.968; 90 | 4048 | Kostenko, Arseni; Driess, Matthias Geometrically Compelled Disilene with λ<sup>4</sup>-Coordinate Si<sup>II</sup> Atoms. Journal of the American Chemical Society, 2018, 140, 16962-16966 |
| 4133585 | CIF | C56 H64 N4 Si2 | P -1 | 10.5082; 13.0458; 19.448 76.133; 88.079; 67.359 | 2383.8 | Kostenko, Arseni; Driess, Matthias Geometrically Compelled Disilene with λ<sup>4</sup>-Coordinate Si<sup>II</sup> Atoms. Journal of the American Chemical Society, 2018, 140, 16962-16966 |
| 4133594 | CIF | C2.13 H0.5 O2.71 Zr0.5 | F d -3 m :2 | 35.0494; 35.0494; 35.0494 90; 90; 90 | 43056.8 | Baek, Jayeon; Rungtaweevoranit, Bunyarat; Pei, Xiaokun; Park, Myeongkee; Fakra, Sirine C.; Liu, Yi-Sheng; Matheu, Roc; Alshmimri, Sultan A.; Alshehri, Saeed; Trickett, Christopher A.; Somorjai, Gabor A.; Yaghi, Omar M. Bioinspired Metal-Organic Framework Catalysts for Selective Methane Oxidation to Methanol. Journal of the American Chemical Society, 2018, 140, 18208-18216 |
| 4133595 | CIF | C1.9 H0.55 O2.77 Zr0.5 | F d -3 m :2 | 35.0221; 35.0221; 35.0221 90; 90; 90 | 42956 | Baek, Jayeon; Rungtaweevoranit, Bunyarat; Pei, Xiaokun; Park, Myeongkee; Fakra, Sirine C.; Liu, Yi-Sheng; Matheu, Roc; Alshmimri, Sultan A.; Alshehri, Saeed; Trickett, Christopher A.; Somorjai, Gabor A.; Yaghi, Omar M. Bioinspired Metal-Organic Framework Catalysts for Selective Methane Oxidation to Methanol. Journal of the American Chemical Society, 2018, 140, 18208-18216 |
| 4133596 | CIF | C1.74 H0.5 O2.83 Zr0.5 | F d -3 m :2 | 35.0104; 35.0104; 35.0104 90; 90; 90 | 42913 | Baek, Jayeon; Rungtaweevoranit, Bunyarat; Pei, Xiaokun; Park, Myeongkee; Fakra, Sirine C.; Liu, Yi-Sheng; Matheu, Roc; Alshmimri, Sultan A.; Alshehri, Saeed; Trickett, Christopher A.; Somorjai, Gabor A.; Yaghi, Omar M. Bioinspired Metal-Organic Framework Catalysts for Selective Methane Oxidation to Methanol. Journal of the American Chemical Society, 2018, 140, 18208-18216 |
| 4133601 | CIF | C64 H65 B F24 Ir N3 O P2 | P 1 | 13.14495; 13.47863; 22.0101 76.341; 78.4708; 62.6282 | 3346.23 | Salomó, Ernest; Gallen, Albert; Sciortino, Giuseppe; Ujaque, Gregori; Grabulosa, Arnald; Lledós, Agustí; Riera, Antoni; Verdaguer, Xavier Direct Asymmetric Hydrogenation of N-Methyl and N-Alkyl Imines with an Ir(III)H Catalyst. Journal of the American Chemical Society, 2018, 140, 16967-16970 |
| 4133609 | CIF | C33 H35 Cl F3 Fe O8 P3 Pt S | P -1 | 9.1811; 12.1939; 16.6464 87.574; 77.784; 86.681 | 1817.5 | Xing, Xiangyou; Xu, Chen; Chen, Bo; Li, Chengcheng; Virgil, Scott C.; Grubbs, Robert H. Highly Active Platinum Catalysts for Nitrile and Cyanohydrin Hydration: Catalyst Design and Ligand Screening via High-Throughput Techniques. Journal of the American Chemical Society, 2018, 140, 17782-17789 |
| 4133610 | CIF | C37 H35 Cl F3 Fe O4 P3 Pt S | P -1 | 12.02; 14.966; 21.674 74.877; 79.712; 89.614 | 3700 | Xing, Xiangyou; Xu, Chen; Chen, Bo; Li, Chengcheng; Virgil, Scott C.; Grubbs, Robert H. Highly Active Platinum Catalysts for Nitrile and Cyanohydrin Hydration: Catalyst Design and Ligand Screening via High-Throughput Techniques. Journal of the American Chemical Society, 2018, 140, 17782-17789 |
| 4133611 | CIF | C37 H35 Cl F3 Fe O4 P3 Pt S | P -1 | 10.9388; 12.077; 15.114 88.291; 74.307; 79.727 | 1891.1 | Xing, Xiangyou; Xu, Chen; Chen, Bo; Li, Chengcheng; Virgil, Scott C.; Grubbs, Robert H. Highly Active Platinum Catalysts for Nitrile and Cyanohydrin Hydration: Catalyst Design and Ligand Screening via High-Throughput Techniques. Journal of the American Chemical Society, 2018, 140, 17782-17789 |
| 4133612 | CIF | C37 H35 Cl F3 Fe O4 P3 Pt S | P -1 | 10.966; 12.151; 15.127 88.301; 74.446; 79.668 | 1910 | Xing, Xiangyou; Xu, Chen; Chen, Bo; Li, Chengcheng; Virgil, Scott C.; Grubbs, Robert H. Highly Active Platinum Catalysts for Nitrile and Cyanohydrin Hydration: Catalyst Design and Ligand Screening via High-Throughput Techniques. Journal of the American Chemical Society, 2018, 140, 17782-17789 |
| 4133613 | CIF | C36 H35 B Cl F4 Fe O P3 Pt | P -1 | 10.6888; 11.6609; 14.5386 93.888; 102.803; 97.548 | 1742.9 | Xing, Xiangyou; Xu, Chen; Chen, Bo; Li, Chengcheng; Virgil, Scott C.; Grubbs, Robert H. Highly Active Platinum Catalysts for Nitrile and Cyanohydrin Hydration: Catalyst Design and Ligand Screening via High-Throughput Techniques. Journal of the American Chemical Society, 2018, 140, 17782-17789 |
| 4133614 | CIF | C37.5 H57 F4 Ni P | P 1 21/c 1 | 18.7227; 16.83446; 11.12873 90; 94.7276; 90 | 3495.69 | Kawashima, Takuya; Ohashi, Masato; Ogoshi, Sensuke Selective Catalytic Formation of Cross-Tetramers from Tetrafluoroethylene, Ethylene, Alkynes, and Aldehydes via Nickelacycles as Key Reaction Intermediates. Journal of the American Chemical Society, 2018, 140, 17423-17427 |
| 4133631 | CIF | C26 H29 N O3 | P 1 n 1 | 9.4406; 11.4272; 20.2122 90; 97.538; 90 | 2161.64 | Derosa, Joseph; Kleinmans, Roman; Tran, Van T.; Karunananda, Malkanthi K.; Wisniewski, Steven R.; Eastgate, Martin D.; Engle, Keary M. Nickel-Catalyzed 1,2-Diarylation of Simple Alkenyl Amides. Journal of the American Chemical Society, 2018, 140, 17878-17883 |
| 4133632 | CIF | C21 H27 N O2 | P 1 21/n 1 | 14.588; 5.3289; 23.934 90; 99.081; 90 | 1837.3 | Derosa, Joseph; Kleinmans, Roman; Tran, Van T.; Karunananda, Malkanthi K.; Wisniewski, Steven R.; Eastgate, Martin D.; Engle, Keary M. Nickel-Catalyzed 1,2-Diarylation of Simple Alkenyl Amides. Journal of the American Chemical Society, 2018, 140, 17878-17883 |
| 4133633 | CIF | C26 H29 N O4 | P 1 21/c 1 | 9.4479; 15.9921; 30.118 90; 97.482; 90 | 4511.8 | Derosa, Joseph; Kleinmans, Roman; Tran, Van T.; Karunananda, Malkanthi K.; Wisniewski, Steven R.; Eastgate, Martin D.; Engle, Keary M. Nickel-Catalyzed 1,2-Diarylation of Simple Alkenyl Amides. Journal of the American Chemical Society, 2018, 140, 17878-17883 |
| 4133650 | CIF | C19 H20 F N O3 Si | P -1 | 6.84; 7.717; 18.32 81.71; 85.48; 72.46 | 912 | Li, Ting; Zhang, Liming Bifunctional Biphenyl-2-ylphosphine Ligand Enables Tandem Gold-Catalyzed Propargylation of Aldehyde and Unexpected Cycloisomerization. Journal of the American Chemical Society, 2018, 140, 17439-17443 |
| 4135643 | CIF | Cu26 S32 Sn6 V2 | P -4 3 n | 10.8289; 10.8289; 10.8289 90; 90; 90 | 1269.85 | Bourges, C.; Bouyrie, Y.; Supka, A.R.; Al Rahal Al Orabi, R.; Lemoine, P.; Lebedev, O.I.; Ohta, M.; Suekuni, K.; Nassif, V.; Hardy, V.; Daou, R.; Miyazaki, Y.; Fornari, M.; Guilmeau, E. 'High-performance thermoelectric bulk colusite by process controlled structural disordering' Journal of the American Chemical Society, 2018, 140, 2186-2195 |
| 4135644 | CIF | Cu26 S32 Sn6 V2 | P -4 3 n | 10.77006; 10.77006; 10.77006 90; 90; 90 | 1249.26 | Bourges, C.; Bouyrie, Y.; Supka, A.R.; Al Rahal Al Orabi, R.; Lemoine, P.; Lebedev, O.I.; Ohta, M.; Suekuni, K.; Nassif, V.; Hardy, V.; Daou, R.; Miyazaki, Y.; Fornari, M.; Guilmeau, E. 'High-performance thermoelectric bulk colusite by process controlled structural disordering' Journal of the American Chemical Society, 2018, 140, 2186-2195 |
| 6000381 | CIF | H2 O8 P2 Ti | P 1 21/n 1 | 18.9503; 6.3127; 5.1391 90; 105.366; 90 | 592.8 | Andersen, A. M. K.; Norby, P.; Vogt, T. Determination of formation regions of titanium phosphates; determination of the crystal structure of beta-titanium phosphate, Ti(PO4)(H2PO4), from neutron powder data Journal of Solid State Chemistry, 1998, 140, 266-271 |
| 6000382 | CIF | ? | I 4/m m m | 3.9168; 3.9168; 25.322 90; 90; 90 | 388.47 | Retoux, R.; Rodriguez-Carvajal, J.; Lacorre, P. Neutron diffraction and tem studies of the crystal structure and defects of Nd4Ni3O8 Journal of Solid State Chemistry, 1998, 140, 307-315 |
| 6000400 | CIF | Cr O6 Ta2 | P 1 21/n 1 | 4.738; 4.7421; 9.2972 90; 90.55; 90 | 208.88 | Saes, M.; Raju, N. P.; Greedan, J. E. Structure and magnetism in CrTa2O6: a trirutile oxide based on Cr2+ Journal of Solid State Chemistry, 1998, 140, 7-13 |
| 6000401 | CIF | O7 P2 Zn2 | P b c m | 4.9504; 13.335; 16.482 90; 90; 90 | 1088.04 | Bataille, T.; Benard-Rocherulle, P.; Louer, D. Thermal behavior of zinc phenylphosphonate and structure determination of gamma-Zn2P2O7 from X-ray powder diffraction data Journal of Solid State Chemistry, 1998, 140, 62-70 |
| 6000402 | CIF | Cs2 Pd Se8 | I 41/a c d | 14.935; 14.935; 12.907 90; 90; 90 | 2878.96 | Li, J.; Chen, Z.; Wang, R. J.; Lu, J. Y. Cs2PdSe8: a unique open framework structure with double helical assemblies of [Pd(Se-4)(2)](2-) Journal of Solid State Chemistry, 1998, 140, 149-153 |
| 8104161 | CIF | Cd In2 O4 | F d -3 m :1 | 9.166; 9.166; 9.166 90; 90; 90 | 770.087 | Rasines, I. On the structure of cadmium indate Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1974, 140, 410-413 |
| 8104324 | CIF | Bi16 Cu0.48 Pb14 S36 | P n m a | 23.89; 4.057; 19.098 90; 90; 90 | 1851.01 | Srikrishnan, T.; Nowacki, W. A redetermination of the crystal structure of cosalite, Pb2 Bi2 S5 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1974, 140, 114-136 |
| 8104326 | CIF | Bi8 Pb2 S16 | C 1 2/m 1 | 13.247; 4.03; 15.421 90; 131.04; 90 | 620.942 | Takeuchi, Y.; Takagi, J.; Yamanaka, T. The crystal structure of PbS (Bi2 S3)2 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1974, 140, 249-272 |
| 8104363 | CIF | Al10 O45.44 Rb9.8 Si10 | I 2 2 2 | 9.978; 9.978; 13.215 90; 90; 90 | 1315.69 | Baerlocher, C.; Barrer, R.M. The crystal structure of synthetic zeolite F Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1974, 140, 10-26 |
| 9008240 | CIF | Ag4 Mn S6 Sb2 | P 1 21/n 1 | 10.362; 8.101; 6.647 90; 92.63; 90 | 557.378 | Edenharter, A.; Nowacki, W. Verfeinerung der kristallstruktur von samsonit (SbS3)2Ag2Ag2Mn Zeitschrift fur Kristallographie, 1974, 140, 87-99 |
| 9008241 | CIF | Bi4 Cu0.12 Pb4 S10 | P b n m | 19.098; 23.89; 4.057 90; 90; 90 | 1851.01 | Srikrishnan, T.; Nowacki, W. A redetermination of the crystal structure of cosalite, Pb2Bi2S5 Zeitschrift fur Kristallographie, 1974, 140, 114-136 |
| 9011428 | CIF | Cu0.333 Fe0.667 S | F -4 3 m | 5.296; 5.296; 5.296 90; 90; 90 | 148.54 | Szymanski, J. T. The crystal structure of high-temperature CuFe2S3 Zeitschrift fur Kristallographie, 1974, 140, 240-248 |
| 9011588 | CIF | Fe2 O4 Si | P b n m | 4.822; 10.488; 6.094 90; 90; 90 | 308.193 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 0.001 kbar Physica B+C, 1986, 140, 333-336 |
| 9011589 | CIF | Fe2 O4 Si | P b n m | 4.793; 10.31; 6.041 90; 90; 90 | 298.521 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 49 kbar Physica B+C, 1986, 140, 333-336 |
| 9011590 | CIF | Fe2 O4 Si | P b n m | 4.773; 10.252; 6.026 90; 90; 90 | 294.869 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 67 kbar Physica B+C, 1986, 140, 333-336 |
| 9011591 | CIF | Fe2 O4 Si | P b n m | 4.757; 10.153; 5.985 90; 90; 90 | 289.062 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 93 kbar Physica B+C, 1986, 140, 333-336 |
| 9011592 | CIF | Fe2 O4 Si | P b n m | 4.756; 10.089; 5.976 90; 90; 90 | 286.748 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 117 kbar Physica B+C, 1986, 140, 333-336 |
| 9011593 | CIF | Fe2 O4 Si | P b n m | 4.739; 9.899; 5.979 90; 90; 90 | 280.483 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 140 kbar Physica B+C, 1986, 140, 333-336 |
| 9015215 | CIF | As2 Cu3 O8 | P 1 21/c 1 | 6.306; 8.643; 11.31 90; 92.26; 90 | 615.947 | Starova, G. L.; Vergasova, L. P.; Filatov, S. K.; Britvin S N. Ananyev V V Lammerite-beta, Cu3(AsO4)2 - a new mineral from fumaroles of the Great Fissure Tolbachic eruption (Kamchatka, Russia) Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva, 2011, 140, 46-51 |
| 9016243 | CIF | Al0.5 Ca0.6 Fe La3.4 Mn0.5 Nb0.5 O22 Si4 Ti2.5 | P 1 21/a 1 | 13.668; 5.6601; 11.743 90; 113.64; 90 | 832.229 | Chukanov, N. V.; Blass, G.; Pekov, I. V.; Belakovskiy, D. I.; Van, K. V.; Rastsvetaeva, R. K.; Aksenov, S. M. Perrierite-(La) (La,Ce,Ca)4Fe2+(Ti,Fe)4(Si2O7)2O8 - a new mineral species from volcanic region Eifel, Germany Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva, 2011, 140, 34-44 |
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