Crystallography Open Database
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| 4135338 | CIF | C51 H60 Cl N3 O12 | P 1 21/n 1 | 11.8167; 19.4344; 20.4342 90; 95.609; 90 | 4670.3 | Liang, Haozhong; Hua, Bin; Xu, Fan; Gan, Li-She; Shao, Li; Huang, Feihe Acid/Base-Tunable Unimolecular Chirality Switching of a Pillar[5]azacrown <i>Pseudo</i>[1]Catenane. Journal of the American Chemical Society, 2020, 142, 19772-19778 |
| 4135339 | CIF | C108 H112 O Si4 | P 1 21/c 1 | 21.5851; 14.7231; 15.1871 90; 94.212; 90 | 4813.4 | Bergman, Harrison M.; Kiel, Gavin R.; Witzke, Ryan J.; Nenon, David P.; Schwartzberg, Adam M.; Liu, Yi; Tilley, T. Don Shape-Selective Synthesis of Pentacene Macrocycles and the Effect of Geometry on Singlet Fission. Journal of the American Chemical Society, 2020, 142, 19850-19855 |
| 4135340 | CIF | C156 H146 O4 Si4 | P 1 21/c 1 | 21.0146; 17.8252; 16.958 90; 90.02; 90 | 6352.3 | Bergman, Harrison M.; Kiel, Gavin R.; Witzke, Ryan J.; Nenon, David P.; Schwartzberg, Adam M.; Liu, Yi; Tilley, T. Don Shape-Selective Synthesis of Pentacene Macrocycles and the Effect of Geometry on Singlet Fission. Journal of the American Chemical Society, 2020, 142, 19850-19855 |
| 4135341 | CIF | C106 H70 Cl18 | P -1 | 11.8612; 14.1474; 14.9784 100.353; 102.176; 107.043 | 2269.2 | Bergman, Harrison M.; Kiel, Gavin R.; Witzke, Ryan J.; Nenon, David P.; Schwartzberg, Adam M.; Liu, Yi; Tilley, T. Don Shape-Selective Synthesis of Pentacene Macrocycles and the Effect of Geometry on Singlet Fission. Journal of the American Chemical Society, 2020, 142, 19850-19855 |
| 4135342 | CIF | C76 H95 O14 | C 1 2/c 1 | 26.7857; 12.5558; 25.1482 90; 118.957; 90 | 7400.4 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135343 | CIF | C67 H86 O12 | P 1 21/n 1 | 13.5823; 22.8453; 20.4508 90; 100.373; 90 | 6242 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135344 | CIF | C71 H78 Br12 O13 | P -1 | 14.1746; 16.4665; 19.6666 79.172; 77.599; 72.479 | 4237.6 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135345 | CIF | C67 H76 Br10 O12 | C 1 2/c 1 | 28.6532; 12.3731; 44.242 90; 108.836; 90 | 14845.1 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135346 | CIF | C78 H100 O14 | P -1 | 12.8203; 12.9026; 12.9306 61.278; 73.375; 78.559 | 1792.62 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135347 | CIF | C78 H88 Br12 O14 | P b c n | 13.8496; 23.998; 25.2072 90; 90; 90 | 8377.93 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135348 | CIF | C60 H66 Br10 O11 | P b c n | 24.4691; 20.7774; 12.8545 90; 90; 90 | 6535.3 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135349 | CIF | C60 H76 O11 | P -1 | 13.167; 14.706; 30.336 87.834; 86.789; 85.765 | 5845 | Wu, Yitao; Zhou, Jiong; Li, Errui; Wang, Mengbin; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Selective Separation of Methylfuran and Dimethylfuran by Nonporous Adaptive Crystals of Pillararenes. Journal of the American Chemical Society, 2020, 142, 19722-19730 |
| 4135350 | CIF | C11 H14 Br N | P 1 21 1 | 8.8938; 5.9958; 9.519 90; 94.883; 90 | 505.76 | Yan, Xingchen; Ge, Luo; Castiñeira Reis, Marta; Harutyunyan, Syuzanna R. Nucleophilic Dearomatization of N-Heteroaromatics Enabled by Lewis Acids and Copper Catalysis. Journal of the American Chemical Society, 2020, 142, 20247-20256 |
| 4135351 | CIF | C39 H68 O3 Si3 Ti3 | P -1 | 11.3762; 12.0964; 18.5162 98.867; 102.089; 113.854 | 2195.93 | Hu, Shaowei; Shima, Takanori; Hou, Zhaomin Hydrodeoxygenative Cyclotetramerization of Carbon Monoxide by a Trinuclear Titanium Polyhydride Complex. Journal of the American Chemical Society, 2020, 142, 19889-19894 |
| 4135352 | CIF | C41 H70 O5 Si3 Ti3 | P 1 | 10.0717; 11.556; 12.004 61.262; 73.979; 81.524 | 1177.3 | Hu, Shaowei; Shima, Takanori; Hou, Zhaomin Hydrodeoxygenative Cyclotetramerization of Carbon Monoxide by a Trinuclear Titanium Polyhydride Complex. Journal of the American Chemical Society, 2020, 142, 19889-19894 |
| 4135353 | CIF | C46 H73 N O5 Si3 Ti3 | P -1 | 8.7584; 14.858; 20.54 70.651; 86.515; 78.122 | 2467.9 | Hu, Shaowei; Shima, Takanori; Hou, Zhaomin Hydrodeoxygenative Cyclotetramerization of Carbon Monoxide by a Trinuclear Titanium Polyhydride Complex. Journal of the American Chemical Society, 2020, 142, 19889-19894 |
| 4135354 | CIF | C41 H70 O5 Si3 Ti3 | P n a 21 | 20.8973; 11.6751; 19.2927 90; 90; 90 | 4707 | Hu, Shaowei; Shima, Takanori; Hou, Zhaomin Hydrodeoxygenative Cyclotetramerization of Carbon Monoxide by a Trinuclear Titanium Polyhydride Complex. Journal of the American Chemical Society, 2020, 142, 19889-19894 |
| 4135355 | CIF | C14 H28 Cl2 Fe N2 | P 21 21 21 | 7.19727; 10.5288; 24.3626 90; 90; 90 | 1846.16 | Braconi, Elena; Götzinger, Alissa C; Cramer, Nicolai Enantioselective Iron-Catalyzed Cross-[4+4]-Cycloaddition of 1,3-Dienes Provides Chiral Cyclooctadienes. Journal of the American Chemical Society, 2020, 142, 19819-19824 |
| 4135356 | CIF | C20 H24 Cl2 Fe N2 | P 42 | 10.40448; 10.40448; 9.2611 90; 90; 90 | 1002.54 | Braconi, Elena; Götzinger, Alissa C; Cramer, Nicolai Enantioselective Iron-Catalyzed Cross-[4+4]-Cycloaddition of 1,3-Dienes Provides Chiral Cyclooctadienes. Journal of the American Chemical Society, 2020, 142, 19819-19824 |
| 4135357 | CIF | C18 H36 Cl2 Fe N2 | P 21 21 21 | 7.33605; 11.0844; 26.8365 90; 90; 90 | 2182.23 | Braconi, Elena; Götzinger, Alissa C; Cramer, Nicolai Enantioselective Iron-Catalyzed Cross-[4+4]-Cycloaddition of 1,3-Dienes Provides Chiral Cyclooctadienes. Journal of the American Chemical Society, 2020, 142, 19819-19824 |
| 4135358 | CIF | C46 H52 Cl2 Rh2 | P 21 21 2 | 14.5785; 11.9443; 10.9829 90; 90; 90 | 1912.45 | Braconi, Elena; Götzinger, Alissa C; Cramer, Nicolai Enantioselective Iron-Catalyzed Cross-[4+4]-Cycloaddition of 1,3-Dienes Provides Chiral Cyclooctadienes. Journal of the American Chemical Society, 2020, 142, 19819-19824 |
| 4135359 | CIF | C45 H51 Cl2 N3 O8 Rh2 | P 1 21/n 1 | 10.7128; 12.9374; 32.667 90; 96.259; 90 | 4500.5 | Das, Anuvab; Wang, Chen-Hao; Van Trieste, 3rd, Gerard P; Sun, Cheng-Jun; Chen, Yu-Sheng; Reibenspies, Joseph H.; Powers, David C. <i>In Crystallo</i> Snapshots of Rh<sub>2</sub>-Catalyzed C-H Amination. Journal of the American Chemical Society, 2020, 142, 19862-19867 |
| 4135360 | CIF | C58 H60 Cl6 N6 O8 Rh2 | P 1 21/n 1 | 12.8813; 12.9498; 18.331 90; 102.871; 90 | 2981 | Das, Anuvab; Wang, Chen-Hao; Van Trieste, 3rd, Gerard P; Sun, Cheng-Jun; Chen, Yu-Sheng; Reibenspies, Joseph H.; Powers, David C. <i>In Crystallo</i> Snapshots of Rh<sub>2</sub>-Catalyzed C-H Amination. Journal of the American Chemical Society, 2020, 142, 19862-19867 |
| 4135361 | CIF | C184 H204 Cl24 N4 O32 Rh8 | P -1 | 15.6237; 17.2551; 19.6274 111.577; 94.521; 96.215 | 4851.2 | Das, Anuvab; Wang, Chen-Hao; Van Trieste, 3rd, Gerard P; Sun, Cheng-Jun; Chen, Yu-Sheng; Reibenspies, Joseph H.; Powers, David C. <i>In Crystallo</i> Snapshots of Rh<sub>2</sub>-Catalyzed C-H Amination. Journal of the American Chemical Society, 2020, 142, 19862-19867 |
| 4135362 | CIF | C45 H51 Cl2 N3 O8 Rh2 | P 1 21/c 1 | 10.9316; 12.9312; 32.433 90; 99.31; 90 | 4524.3 | Das, Anuvab; Wang, Chen-Hao; Van Trieste, 3rd, Gerard P; Sun, Cheng-Jun; Chen, Yu-Sheng; Reibenspies, Joseph H.; Powers, David C. <i>In Crystallo</i> Snapshots of Rh<sub>2</sub>-Catalyzed C-H Amination. Journal of the American Chemical Society, 2020, 142, 19862-19867 |
| 4135363 | CIF | C58 H60 Cl6 N4.28 O8 Rh2 | P 1 21/n 1 | 12.961; 12.909; 18.381 90; 100.334; 90 | 3025.5 | Das, Anuvab; Wang, Chen-Hao; Van Trieste, 3rd, Gerard P; Sun, Cheng-Jun; Chen, Yu-Sheng; Reibenspies, Joseph H.; Powers, David C. <i>In Crystallo</i> Snapshots of Rh<sub>2</sub>-Catalyzed C-H Amination. Journal of the American Chemical Society, 2020, 142, 19862-19867 |
| 4135364 | CIF | C20 H26 N O2 P | P 21 21 21 | 7.9196; 8.505; 27.304 90; 90; 90 | 1839.09 | Li, Yan-Bo; Tian, Hu; Yin, Liang Copper(I)-Catalyzed Asymmetric 1,4-Conjugate Hydrophosphination of α,β-Unsaturated Amides. Journal of the American Chemical Society, 2020, 142, 20098-20106 |
| 4135365 | CIF | C21 H28 N O2 P | C 1 2 1 | 16.0085; 7.8446; 16.2448 90; 93.22; 90 | 2036.81 | Li, Yan-Bo; Tian, Hu; Yin, Liang Copper(I)-Catalyzed Asymmetric 1,4-Conjugate Hydrophosphination of α,β-Unsaturated Amides. Journal of the American Chemical Society, 2020, 142, 20098-20106 |
| 4135366 | CIF | C40 H41 Cl N2 O4 P2 Pd | P 1 21 1 | 10.6291; 31.7456; 11.4376 90; 92.961; 90 | 3854.2 | Li, Yan-Bo; Tian, Hu; Yin, Liang Copper(I)-Catalyzed Asymmetric 1,4-Conjugate Hydrophosphination of α,β-Unsaturated Amides. Journal of the American Chemical Society, 2020, 142, 20098-20106 |
| 4135367 | CIF | C32 H22 Mn2 Ni O10 S4 | P 61 | 19.3198; 19.3198; 20.7955 90; 90; 120 | 6722.1 | Zhou, Yan; Hu, Qin; Yu, Fei; Ran, Guang-Ying; Wang, Hai-Ying; Shepherd, Nicholas D.; D'Alessandro, Deanna M; Kurmoo, Mohamedally; Zuo, Jing-Lin A Metal-Organic Framework Based on a Nickel Bis(dithiolene) Connector: Synthesis, Crystal Structure, and Application as an Electrochemical Glucose Sensor. Journal of the American Chemical Society, 2020, 142, 20313-20317 |
| 4135368 | CIF | C27 H20 N2 O2 | C 1 2/c 1 | 13.408; 18.225; 7.9041 90; 94.302; 90 | 1926 | Kasemthaveechok, Sitthichok; Abella, Laura; Jean, Marion; Cordier, Marie; Roisnel, Thierry; Vanthuyne, Nicolas; Guizouarn, Thierry; Cador, Olivier; Autschbach, Jochen; Crassous, Jeanne; Favereau, Ludovic Axially and Helically Chiral Cationic Radical Bicarbazoles: SOMO-HOMO Level Inversion and Chirality Impact on the Stability of Mono- and Diradical Cations. Journal of the American Chemical Society, 2020, 142, 20409-20418 |
| 4135369 | CIF | C35 H36 N2 O2 | P 1 21/n 1 | 16.902; 9.9528; 17.758 90; 99.9; 90 | 2942.8 | Kasemthaveechok, Sitthichok; Abella, Laura; Jean, Marion; Cordier, Marie; Roisnel, Thierry; Vanthuyne, Nicolas; Guizouarn, Thierry; Cador, Olivier; Autschbach, Jochen; Crassous, Jeanne; Favereau, Ludovic Axially and Helically Chiral Cationic Radical Bicarbazoles: SOMO-HOMO Level Inversion and Chirality Impact on the Stability of Mono- and Diradical Cations. Journal of the American Chemical Society, 2020, 142, 20409-20418 |
| 4135370 | CIF | C36 H40 N2 O2 | P 1 21/n 1 | 13.139; 34.437; 13.4698 90; 92.046; 90 | 6090.8 | Kasemthaveechok, Sitthichok; Abella, Laura; Jean, Marion; Cordier, Marie; Roisnel, Thierry; Vanthuyne, Nicolas; Guizouarn, Thierry; Cador, Olivier; Autschbach, Jochen; Crassous, Jeanne; Favereau, Ludovic Axially and Helically Chiral Cationic Radical Bicarbazoles: SOMO-HOMO Level Inversion and Chirality Impact on the Stability of Mono- and Diradical Cations. Journal of the American Chemical Society, 2020, 142, 20409-20418 |
| 4135371 | CIF | C28 H24 N2 O2 | P -1 | 9.5316; 9.9882; 12.1305 74.757; 77.144; 74.314 | 1058.4 | Kasemthaveechok, Sitthichok; Abella, Laura; Jean, Marion; Cordier, Marie; Roisnel, Thierry; Vanthuyne, Nicolas; Guizouarn, Thierry; Cador, Olivier; Autschbach, Jochen; Crassous, Jeanne; Favereau, Ludovic Axially and Helically Chiral Cationic Radical Bicarbazoles: SOMO-HOMO Level Inversion and Chirality Impact on the Stability of Mono- and Diradical Cations. Journal of the American Chemical Society, 2020, 142, 20409-20418 |
| 4135372 | CIF | C19 H23 N3 O2 | P -1 | 10.1005; 11.4816; 15.6108 84.1313; 74.5085; 70.8989 | 1648.34 | Jeon, Jinwon; Lee, Changseok; Seo, Huiyeong; Hong, Sungwoo NiH-Catalyzed Proximal-Selective Hydroamination of Unactivated Alkenes. Journal of the American Chemical Society, 2020, 142, 20470-20480 |
| 4135373 | CIF | C20 H25 N3 O2 | P 1 21/c 1 | 12.1484; 12.2854; 24.5486 90; 98.0774; 90 | 3627.5 | Jeon, Jinwon; Lee, Changseok; Seo, Huiyeong; Hong, Sungwoo NiH-Catalyzed Proximal-Selective Hydroamination of Unactivated Alkenes. Journal of the American Chemical Society, 2020, 142, 20470-20480 |
| 4135382 | CIF | C27 H39 Al N3 O2 P2 Rh | P n m a | 15.0983; 19.1026; 10.0922 90; 90; 90 | 2910.76 | Lai, Qingheng; Bhuvanesh, Nattamai; Ozerov, Oleg V. Unexpected B/Al Transelementation within a Rh Pincer Complex. Journal of the American Chemical Society, 2020, 142, 20920-20923 |
| 4135383 | CIF | C22 H34 B N2 O2 P2 Rh | P 1 21/c 1 | 12.21; 14.684; 14.725 90; 111.369; 90 | 2458.6 | Lai, Qingheng; Bhuvanesh, Nattamai; Ozerov, Oleg V. Unexpected B/Al Transelementation within a Rh Pincer Complex. Journal of the American Chemical Society, 2020, 142, 20920-20923 |
| 4135384 | CIF | C51 H76 Al2 N4 O4 P4 Rh2 | P 1 21/n 1 | 15.278; 9.6009; 19.5396 90; 93.389; 90 | 2861.11 | Lai, Qingheng; Bhuvanesh, Nattamai; Ozerov, Oleg V. Unexpected B/Al Transelementation within a Rh Pincer Complex. Journal of the American Chemical Society, 2020, 142, 20920-20923 |
| 4135385 | CIF | C16 H16 Br N O2 | P 1 21/c 1 | 9.22979; 12.58246; 12.86856 90; 91.0663; 90 | 1494.21 | Luan, Zi-Hong; Qu, Jian-Ping; Kang, Yan-Biao Discovery of Oxygen α-Nucleophilic Addition to α,β-Unsaturated Amides Catalyzed by Redox-Neutral Organic Photoreductant. Journal of the American Chemical Society, 2020, 142, 20942-20947 |
| 4135386 | CIF | C17 H19 N O3 | P 21 21 21 | 8.70779; 9.8648; 18.3289 90; 90; 90 | 1574.46 | Luan, Zi-Hong; Qu, Jian-Ping; Kang, Yan-Biao Discovery of Oxygen α-Nucleophilic Addition to α,β-Unsaturated Amides Catalyzed by Redox-Neutral Organic Photoreductant. Journal of the American Chemical Society, 2020, 142, 20942-20947 |
| 4135387 | CIF | C33 H23 N | P 1 21/n 1 | 13.6755; 5.2979; 31.08 90; 92.838; 90 | 2249 | Luan, Zi-Hong; Qu, Jian-Ping; Kang, Yan-Biao Discovery of Oxygen α-Nucleophilic Addition to α,β-Unsaturated Amides Catalyzed by Redox-Neutral Organic Photoreductant. Journal of the American Chemical Society, 2020, 142, 20942-20947 |
| 4135388 | CIF | C15 H15 N O2 | P 1 21/c 1 | 12.5632; 10.1388; 10.1456 90; 96.467; 90 | 1284.08 | Luan, Zi-Hong; Qu, Jian-Ping; Kang, Yan-Biao Discovery of Oxygen α-Nucleophilic Addition to α,β-Unsaturated Amides Catalyzed by Redox-Neutral Organic Photoreductant. Journal of the American Chemical Society, 2020, 142, 20942-20947 |
| 4135389 | CIF | C20 H28 Si3 | P 1 21/c 1 | 12.0621; 11.3639; 15.1141 90; 90.006; 90 | 2071.73 | Lu, Lingxiang; Siu, Juno C.; Lai, Yihuan; Lin, Song An Electroreductive Approach to Radical Silylation via the Activation of Strong Si-Cl Bond. Journal of the American Chemical Society, 2020, 142, 21272-21278 |
| 4135390 | CIF | C33.75 H36 Cl N2 Ni P2 | P -4 21 c | 15.4791; 15.4791; 26.403 90; 90; 90 | 6326.2 | Hwang, Seung Jun; Tanushi, Akira; Radosevich, Alexander T. Enthalpy-Controlled Insertion of a "Nonspectator" Tricoordinate Phosphorus Ligand into Group 10 Transition Metal-Carbon Bonds. Journal of the American Chemical Society, 2020, 142, 21285-21291 |
| 4135391 | CIF | C62 H68 Cl2 N6 P4 Pt2 | P 1 21/c 1 | 21.249; 18.319; 14.6841 90; 101.772; 90 | 5595.7 | Hwang, Seung Jun; Tanushi, Akira; Radosevich, Alexander T. Enthalpy-Controlled Insertion of a "Nonspectator" Tricoordinate Phosphorus Ligand into Group 10 Transition Metal-Carbon Bonds. Journal of the American Chemical Society, 2020, 142, 21285-21291 |
| 4135392 | CIF | C40 H37 N3 O P2 | P 1 21 1 | 18.9534; 8.4688; 21.9113 90; 107.14; 90 | 3360.8 | Hwang, Seung Jun; Tanushi, Akira; Radosevich, Alexander T. Enthalpy-Controlled Insertion of a "Nonspectator" Tricoordinate Phosphorus Ligand into Group 10 Transition Metal-Carbon Bonds. Journal of the American Chemical Society, 2020, 142, 21285-21291 |
| 4135393 | CIF | C131 H141 Cl4 F3 N12 P8 Pd4 | P -4 21 c | 15.426; 15.426; 26.835 90; 90; 90 | 6386 | Hwang, Seung Jun; Tanushi, Akira; Radosevich, Alexander T. Enthalpy-Controlled Insertion of a "Nonspectator" Tricoordinate Phosphorus Ligand into Group 10 Transition Metal-Carbon Bonds. Journal of the American Chemical Society, 2020, 142, 21285-21291 |
| 4135394 | CIF | C18 Fe4 O24 | P m -3 | 10.5457; 10.5457; 10.5457 90; 90; 90 | 1172.81 | Chen, Gan; Gee, Leland B.; Xu, Wenqian; Zhu, Yanbing; Lezama-Pacheco, Juan S; Huang, Zhehao; Li, Zongqi; Babicz, Jr, Jeffrey T; Choudhury, Snehashis; Chang, Ting-Hsiang; Reed, Evan; Solomon, Edward I.; Bao, Zhenan Valence-Dependent Electrical Conductivity in a 3D Tetrahydroxyquinone-Based Metal-Organic Framework. Journal of the American Chemical Society, 2020, 142, 21243-21248 |
| 4135395 | CIF | C162 H257 B3 Si9 | P -1 | 11.5159; 26.624; 28.024 75.516; 86.674; 89.643 | 8304.7 | Heitkemper, Tobias; Sarcevic, Julijan; Sindlinger, Christian P. A Neutral Silicon(II) Half-Sandwich Compound. Journal of the American Chemical Society, 2020, 142, 21304-21309 |
| 4135396 | CIF | C148 H192 Al2 B2 Cl8 F72 O10 Si6 | P 1 21/c 1 | 46.461; 19.6539; 20.108 90; 91.637; 90 | 18353.9 | Heitkemper, Tobias; Sarcevic, Julijan; Sindlinger, Christian P. A Neutral Silicon(II) Half-Sandwich Compound. Journal of the American Chemical Society, 2020, 142, 21304-21309 |
| 4135397 | CIF | C60 H101 B Li2 O2 Si2 | P -1 | 10.6412; 13.78; 21.703 73.982; 80.257; 88.739 | 3013.7 | Heitkemper, Tobias; Sarcevic, Julijan; Sindlinger, Christian P. A Neutral Silicon(II) Half-Sandwich Compound. Journal of the American Chemical Society, 2020, 142, 21304-21309 |
| 4135398 | CIF | C29 H18 As F6 N7 Pt | P 1 21/n 1 | 17.3585; 7.8792; 21.9818 90; 112.747; 90 | 2772.63 | Gangadharappa, Sathish Chatnahalli; Maisuls, Iván; Schwab, Dominik A.; Kösters, Jutta; Doltsinis, Nikos L.; Strassert, Cristian A. Compensation of Hybridization Defects in Phosphorescent Complexes with Pnictogen-Based Ligands-A Structural, Photophysical, and Theoretical Case-Study with Predictive Character. Journal of the American Chemical Society, 2020, 142, 21353-21367 |
| 4135399 | CIF | C71 H72 As2 Cl2 N14 Pt2 | C 1 2/c 1 | 26.3591; 15.2165; 19.67 90; 118.351; 90 | 6943.2 | Gangadharappa, Sathish Chatnahalli; Maisuls, Iván; Schwab, Dominik A.; Kösters, Jutta; Doltsinis, Nikos L.; Strassert, Cristian A. Compensation of Hybridization Defects in Phosphorescent Complexes with Pnictogen-Based Ligands-A Structural, Photophysical, and Theoretical Case-Study with Predictive Character. Journal of the American Chemical Society, 2020, 142, 21353-21367 |
| 4135400 | CIF | C29 H18 F6 N7 P Pt | P 1 21/n 1 | 17.3133; 7.8025; 21.8762 90; 112.753; 90 | 2725.22 | Gangadharappa, Sathish Chatnahalli; Maisuls, Iván; Schwab, Dominik A.; Kösters, Jutta; Doltsinis, Nikos L.; Strassert, Cristian A. Compensation of Hybridization Defects in Phosphorescent Complexes with Pnictogen-Based Ligands-A Structural, Photophysical, and Theoretical Case-Study with Predictive Character. Journal of the American Chemical Society, 2020, 142, 21353-21367 |
| 4135401 | CIF | C35.5 H36 Cl N7 Pt Sb | C 1 2/c 1 | 27.3367; 15.1157; 19.6084 90; 116.709; 90 | 7237.9 | Gangadharappa, Sathish Chatnahalli; Maisuls, Iván; Schwab, Dominik A.; Kösters, Jutta; Doltsinis, Nikos L.; Strassert, Cristian A. Compensation of Hybridization Defects in Phosphorescent Complexes with Pnictogen-Based Ligands-A Structural, Photophysical, and Theoretical Case-Study with Predictive Character. Journal of the American Chemical Society, 2020, 142, 21353-21367 |
| 4135402 | CIF | C29 H18 F6 N7 Pt Sb | P 1 21/n 1 | 17.3569; 8.0541; 21.9642 90; 113.066; 90 | 2825 | Gangadharappa, Sathish Chatnahalli; Maisuls, Iván; Schwab, Dominik A.; Kösters, Jutta; Doltsinis, Nikos L.; Strassert, Cristian A. Compensation of Hybridization Defects in Phosphorescent Complexes with Pnictogen-Based Ligands-A Structural, Photophysical, and Theoretical Case-Study with Predictive Character. Journal of the American Chemical Society, 2020, 142, 21353-21367 |
| 4135403 | CIF | C38 H34 Cl6 N2 O6 | P -1 | 11.6432; 12.2106; 15.1043 94.218; 105.721; 114.863 | 1831.8 | Saal, Fridolin; Zhang, Fangyuan; Holzapfel, Marco; Stolte, Matthias; Michail, Evripidis; Moos, Michael; Schmiedel, Alexander; Krause, Ana-Maria; Lambert, Christoph; Würthner, Frank; Ravat, Prince [<i>n</i>]Helicene Diimides (<i>n</i> = 5, 6, and 7): Through-Bond versus Through-Space Conjugation. Journal of the American Chemical Society, 2020, 142, 21298-21303 |
| 4135404 | CIF | C40 H34 N2 O6 | C 1 2/c 1 | 24.9274; 10.0744; 13.9318 90; 117.911; 90 | 3091.7 | Saal, Fridolin; Zhang, Fangyuan; Holzapfel, Marco; Stolte, Matthias; Michail, Evripidis; Moos, Michael; Schmiedel, Alexander; Krause, Ana-Maria; Lambert, Christoph; Würthner, Frank; Ravat, Prince [<i>n</i>]Helicene Diimides (<i>n</i> = 5, 6, and 7): Through-Bond versus Through-Space Conjugation. Journal of the American Chemical Society, 2020, 142, 21298-21303 |
| 4135405 | CIF | C7 H13 F N O4 Re | A m m 2 | 6.2249; 8.8294; 9.3691 90; 90; 90 | 514.95 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135406 | CIF | C7 H13 F N O4 Re | A m m 2 | 6.1587; 8.8322; 9.3515 90; 90; 90 | 508.674 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135407 | CIF | C7 H13 F N O4 Re | P 1 n 1 | 8.788; 5.9866; 9.2245 90; 90.03; 90 | 485.3 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135408 | CIF | C7 H13 F N O4 Re | P 1 n 1 | 8.8349; 6.0723; 9.3144 90; 90.03; 90 | 499.7 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135409 | CIF | C7 H13 F N O4 Re | P 1 n 1 | 8.8138; 6.0127; 9.259 90; 90.03; 90 | 490.678 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135410 | CIF | C7 H11 F N O5 Re | P 1 21/n 1 | 6.5123; 7.987; 19.602 90; 91.48; 90 | 1019.2 | Tang, Yuan-Yuan; Xie, Yongfa; Ai, Yong; Liao, Wei-Qiang; Li, Peng-Fei; Nakamura, Takayoshi; Xiong, Ren-Gen Organic Ferroelectric Vortex-Antivortex Domain Structure. Journal of the American Chemical Society, 2020, 142, 21932-21937 |
| 4135411 | CIF | C22 H25 N3 O3 S | P 1 21/n 1 | 9.134; 14.443; 15.714 90; 91.365; 90 | 2072.4 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135412 | CIF | C15 H19 N3 O2 S | P 1 21/n 1 | 7.9874; 16.3053; 11.7305 90; 93.629; 90 | 1524.7 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135413 | CIF | C13.99 H17.25 Cl0.35 F3 N2 O2 S | P 1 21/n 1 | 9.4287; 14.026; 25.9572 90; 98.656; 90 | 3393.7 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135414 | CIF | C18 H25 F3 N2 | P 1 21/n 1 | 11.9671; 10.6451; 13.0472 90; 95.151; 90 | 1655.38 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135415 | CIF | C27.9 H22.9 Cl2.72 F17 N3 O2 S | P 1 21/c 1 | 28.9093; 6.1109; 19.8414 90; 104.537; 90 | 3393 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135416 | CIF | C24 H28 F3 N3 O4 | P 1 21/n 1 | 15.5602; 9.1547; 18.4847 90; 110.478; 90 | 2466.73 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135417 | CIF | C24 H17 F17 N2 | P 1 21/c 1 | 24.7462; 8.7463; 11.885 90; 98.217; 90 | 2545.95 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135418 | CIF | C12 H13 F3 N2 O | P 1 21/c 1 | 9.3765; 23.4519; 10.6409 90; 90.0379; 90 | 2339.9 | Chandrachud, Preeti P.; Wojtas, Lukasz; Lopchuk, Justin M. Decarboxylative Amination: Diazirines as Single and Double Electrophilic Nitrogen Transfer Reagents. Journal of the American Chemical Society, 2020, 142, 21743-21750 |
| 4135542 | CIF | C53 H68 N2 O3 Ru | P -1 | 11.506; 12.614; 17.118 75.681; 71.28; 88.66 | 2276 | Xu, Yan; Wong, Jonathan J.; Samkian, Adrian E.; Ko, Jeong Hoon; Chen, Shuming; Houk, K. N.; Grubbs, Robert H. Efficient Z-Selective Olefin-Acrylamide Cross-Metathesis Enabled by Sterically Demanding Cyclometalated Ruthenium Catalysts Journal of the American Chemical Society, 2020, 142, 20987-20993 |
| 6000349 | CIF | Ba5.1 O54 Sm8.6 Ti18 | P b n m | 12.1715; 22.3772; 7.6752 90; 90; 90 | 2090.46 | Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H. Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure Journal of Solid State Chemistry, 1999, 142, 336-343 |
| 6000350 | CIF | Ba4.5 O54 Sm9 Ti18 | P b n m | 12.1568; 22.3253; 7.663 90; 90; 90 | 2079.77 | Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H. Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure Journal of Solid State Chemistry, 1999, 142, 336-343 |
| 6000351 | CIF | Ba4 O54 Sm9.33 Ti18 | P b n m | 12.1472; 22.2972; 7.6534 90; 90; 90 | 2072.91 | Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H. Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure Journal of Solid State Chemistry, 1999, 142, 336-343 |
| 6000352 | CIF | Ba3.87 O54 Sm9.42 Ti18 | P b n m | 12.1452; 22.3029; 7.6501 90; 90; 90 | 2072.2 | Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H. Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure Journal of Solid State Chemistry, 1999, 142, 336-343 |
| 6000359 | CIF | La7 Mo7 O30 | R -3 m | 17.0051; 17.0051; 6.8607 90; 90; 90 | 1983.93 | Goutenoire, F.; Retoux, R.; Suard, E.; Lacorre, P. Ab initio determination of the novel perovskite-related structure of La7Mo7O30 from powder diffraction Journal of Solid State Chemistry, 1999, 142, 228-235 |
| 8103413 | CIF | Ag7.44 Al12 O63.6 Si12 | P m -3 m | 12.3; 12.3; 12.3 90; 90; 90 | 1860.87 | Thoeni, W. The crystal structure of hydrated zeolites Tl-A, Ca-A and Ag-A Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 142, 142-160 |
| 8103870 | CIF | Cr H Hg O4.5 | C 1 2/c 1 | 11.832; 5.2616; 14.637 90; 121.01; 90 | 780.995 | Aurivillius, K.; Stalhandske, C. Neutron diffraction study of mercury(II) chromate hemihydrate, Hg Cr O4 (H2 O)0.5 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 142, 129-141 |
| 8103994 | CIF | K2 N12 Zn | P b c a | 14.4; 11.7; 11.29 90; 90; 90 | 1902.14 | Brunner, A.C.; Krischner, H. Die Kristallstruktur von Kaliumzinkazid K2 Zn (N3)4 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 142, 24-34 |
| 8104086 | CIF | Bi3.14 Cu2.58 S6 | C 1 2/m 1 | 17.52; 3.926; 15.261 90; 100.18; 90 | 1033.18 | Ozawa, T.; Nowacki, W. The crystal structure of, and the bismuth-copper distribution in synthetic cuprobismuthite Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 142, 161-176 |
| 8104106 | CIF | As8 Cu2.88 Hg9.12 S24 Tl0.96 | I -4 3 m | 10.379; 10.379; 10.379 90; 90; 90 | 1118.06 | Divjakovic, V.; Nowacki, W. Die Kristallstruktur von Galchait (Hg0.76 (Cu, Zn)0.24)12 Tl0.96 (As S3)8 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 142, 262-270 |
| 8104298 | CIF | As8 Cu1.44 Hg9.12 S24 Tl0.96 Zn1.44 | I -4 3 m | 10.379; 10.379; 10.379 90; 90; 90 | 1118.06 | Divjakovic, V.; Nowacki, W. Die Kristallstruktur von Galchait (Hg0.76 (Cu, Zn)0.24)12 Tl0.96 (As S3)8 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1975, 142, 262-270 |
| 8104352 | CIF | Al12 H30.2 N9.4 Na22.1 O91.3 Si12 | P m -3 m | 12.39; 12.39; 12.39 90; 90; 90 | 1902.02 | Barrer, R.M.; Villiger, H. The structure of the inclusion complex of sodium nitrate in zeolite A Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 142, 82-98 |
| 9009529 | CIF | Ca0.17 Ce0.68 Fe0.06 Mn0.02 Nb1.01 O6 Th0.01 Ti0.99 | P b n m | 5.37; 11.08; 7.56 90; 90; 90 | 449.817 | Aleksandrov, V. B. The crystal structure of aeschynite Doklady Akademii Nauk SSSR, 1962, 142, 181-184 |
| 9014749 | CIF | Al3.312 Ca0.848 H26.44 K0.652 Mg0.66 O37.22 Si8.688 | R -3 m :R | 9.382; 9.382; 9.382 94.57; 94.57; 94.57 | 817.498 | Passaglia, E.; Ferro, O. Occurrence and crystal structure of magnesian chabazite Studies in Surface Science and Catalysis, 2002, 142, 1729-1735 |
| 9016182 | CIF | C Fe3 | P b n m | 4.5144; 5.0787; 6.7297 90; 90; 90 | 154.294 | Lipson, H.; Petch, N. J. The crystal structure of cementite, Fe3C The Journal of the Iron and Steel Institute, 1940, 142, 95-103 |
| 9017837 | CIF | C Fe Na3 O7 P | P 1 21/m 1 | 5.137; 6.644; 8.908 90; 90.554; 90 | 304.018 | Krivovichev, S. V.; Chernyatieva, A. Y.; Britvin, S. N.; Yakovenchuk, V. N.; Krivovichev, V. G. Refinement of the crystal structure of bonshtedtite Na3Fe(PO4)(CO3) Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva, 2013, 142, 46-54 |
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