Crystallography Open Database
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Searching volume of publication is 13
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| 1567188 | CIF | C28 H25 N3 O3 | P 1 21/c 1 | 12.6477; 12.7165; 19.2801 90; 130.968; 90 | 2341.4 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567189 | CIF | C11 H10 N O P S | P 1 21 1 | 8.8091; 14.2922; 15.6275 90; 97.274; 90 | 1951.69 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567190 | CIF | C28 H26 N3 O3 | P 1 21 1 | 8.647; 20.509; 8.854 90; 101.501; 90 | 1538.7 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567191 | CIF | C29 H27 N3 O3 | P 21 21 21 | 9.75496; 13.6686; 18.7757 90; 90; 90 | 2503.49 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567192 | CIF | C144 H82 N12 O32 S6 Zr6 | F d -3 m :2 | 39.3006; 39.3006; 39.3006 90; 90; 90 | 60701.2 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567193 | CIF | C84 H44 N6 O16 S3 Zr3 | F d -3 m :2 | 39.2392; 39.2392; 39.2392 90; 90; 90 | 60417.2 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567194 | CIF | C14 H10 N6 S Zn | P 1 21/n 1 | 7.0203; 10.3506; 24.2607 90; 95.442; 90 | 1754.94 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567195 | CIF | C12 H6 N6 S Zn | I 41 | 16.549; 16.549; 12.4563 90; 90; 90 | 3411.4 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567196 | CIF | C112 H64 N16 O17 Se4 Zn4 | P -1 | 10.4136; 15.0054; 15.7481 88.538; 87.931; 81.423 | 2431.19 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567197 | CIF | C112 H64 N16 O17 S4 Zn4 | P -1 | 10.4363; 15.0079; 15.7667 88.157; 88.133; 81.78 | 2441.9 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567201 | CIF | C60 H144 Cs N3 O16 Si8 U2 | P -1 | 14.1418; 16.3515; 22.1403 107.364; 92.5382; 108.194 | 4588.44 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567202 | CIF | C67 H152 K3 N5 O16 Si8 U2 | P 1 21/n 1 | 17.5895; 26.3839; 21.325 90; 99.763; 90 | 9753.2 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567203 | CIF | C60 H144 Cs N3 O16 Si8 U2 | P -1 | 13.9128; 16.1167; 21.8294 80.346; 83.8; 71.074 | 4557 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567204 | CIF | C60 H144 Cs2 N3 O16 Si8 U2 | P -1 | 13.707; 13.7678; 29.7454 94.2273; 97.0402; 117.487 | 4887.79 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567205 | CIF | C72 H174 K2 N5 O14 Si10 U2 | P 1 21/c 1 | 20.57855; 19.40862; 26.9671 90; 91.6235; 90 | 10766.4 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567206 | CIF | C49.2 H129 K N5 O8.3 Si10 U2 | P 1 21/n 1 | 12.81649; 23.44652; 27.38157 90; 100.985; 90 | 8077.44 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567207 | CIF | C66 H162 K6 N6 O16 Si10 U2 | P 1 21/n 1 | 15.102; 29.934; 27.0037 90; 99.035; 90 | 12055.9 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567208 | CIF | C84 H198 K2 N9 O20 Si10 U2 | P -1 | 13.8976; 14.741; 18.5692 106.635; 103.811; 95.243 | 3487.04 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567209 | CIF | C60 H144 K N3 O16 Si8 U2 | P -1 | 14.1046; 16.153; 22.2432 108.265; 92.266; 107.449 | 4540.8 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567210 | CIF | C96 H234 K6 N10 O24 Si14 U4 | P -1 | 13.65686; 17.961; 20.0238 93.8055; 91.6994; 112.135 | 4531.67 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567211 | CIF | C36 H90 K N2 O8 Si6 U | P -1 | 13.5839; 20.4057; 22.3874 66.602; 83.686; 85.153 | 5655 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567212 | CIF | C66 H158 K2 N3 O16 Si8 U2 | P 1 21/c 1 | 14.10134; 30.68723; 46.2387 90; 92.8994; 90 | 19983.3 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567255 | CIF | C44 H73 N2 O4 Y | P -1 | 9.938; 12.053; 19.598 94.27; 104.5; 90.69 | 2265.3 | Duan, Yu-Lai; Guo, Qian; Liu, Gui-Yang; Yi, Zhong-Zhou; Feng, Shao-Ping; Huang, Yong Highly heteroselective ring-opening polymerization of rac-lactide initiated by rare-earth alkoxides bearing chiral [NNOO]-type amine-bis(phenolate) ligands Polymer Chemistry, 2022, 13, 4249-4259 |
| 1567256 | CIF | C50 H86 N2 O4.25 Y | I 1 2 1 | 21.9272; 11.1967; 41.785 90; 92.244; 90 | 10250.9 | Duan, Yu-Lai; Guo, Qian; Liu, Gui-Yang; Yi, Zhong-Zhou; Feng, Shao-Ping; Huang, Yong Highly heteroselective ring-opening polymerization of rac-lactide initiated by rare-earth alkoxides bearing chiral [NNOO]-type amine-bis(phenolate) ligands Polymer Chemistry, 2022, 13, 4249-4259 |
| 1567276 | CIF | C232 H122 F16 N20 O48 S5 Y12 | C m m m | 40.568; 41.959; 19.6114 90; 90; 90 | 33382 | Xia, Hai-Lun; Zhou, Kang; Guo, Jiandong; Zhang, Jian; Huang, Xiaoxi; Luo, Dawei; Liu, Xiao-Yuan; Li, Jing Amino group induced structural diversity and near-infrared emission of yttrium-tetracarboxylate frameworks Chemical Science, 2022, 13, 9321-9328 |
| 1567277 | CIF | C47.48 H22.51 F4 N3 O12.97 S Y3 | C m m m | 21.358; 35.038; 20.494 90; 90; 90 | 15337 | Xia, Hai-Lun; Zhou, Kang; Guo, Jiandong; Zhang, Jian; Huang, Xiaoxi; Luo, Dawei; Liu, Xiao-Yuan; Li, Jing Amino group induced structural diversity and near-infrared emission of yttrium-tetracarboxylate frameworks Chemical Science, 2022, 13, 9321-9328 |
| 1567283 | CIF | C15 H16 N2 O2 | P 1 21/m 1 | 8.4884; 6.7183; 11.755 90; 108.39; 90 | 636.1 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567284 | CIF | C30 H40 Cu F6 N8 P | I 1 2/a 1 | 22.442; 10.441; 41.64 90; 91.84; 90 | 9752 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567285 | CIF | C16 H23 N5 | P n a 21 | 15.194; 11.576; 8.9945 90; 90; 90 | 1582 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567286 | CIF | C32 H40 Cu F6 N8 O6 S2 | P -1 | 10.318; 12.507; 16.034 98.43; 95.28; 113.19 | 1855.7 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567287 | CIF | C31 H40 Cu F3 N8 O3 S | I 1 2/a 1 | 22.769; 10.613; 42.709 90; 90.75; 90 | 10320 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567288 | CIF | C18 H26 N4 | P -1 | 6.8997; 10.446; 12.234 103.63; 98.86; 93.79 | 841.9 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567289 | CIF | C36 H46 B2 Cu F8 N10 O4 | P 1 21/c 1 | 13.585; 25.27; 12.065 90; 91.75; 90 | 4139.9 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567290 | CIF | C41 H58 Cl2 Cu F6 N8 P | P -1 | 13.117; 13.265; 15.609 73.5; 76.04; 61.06 | 2261.4 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567291 | CIF | C32 H40 Cu F6 N8 O4 P | P 1 21/c 1 | 7.76; 13.9; 32.3 90; 92.6; 90 | 3480.4 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567292 | CIF | C15 H20 N4 | P -1 | 6.8391; 14.447; 15.756 64.51; 89.05; 86.95 | 1403.2 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567293 | CIF | C32 H46 B Cu F4 N10 | P 1 21/c 1 | 11.779; 19.544; 15.389 90; 94.9; 90 | 3529.7 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567294 | CIF | C30 H40 B2 Cu F8 N8 | P 1 21/c 1 | 17.171; 8.9412; 22.701 90; 108.94; 90 | 3296.6 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567295 | CIF | C42 H56 Cu F6 N8 O6 S2 | P b c n | 12.407; 21.571; 16.723 90; 90; 90 | 4475.6 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567296 | CIF | C38 H46 Cu F6 N10 O10 S2 | P 1 21/c 1 | 13.547; 12.641; 26.447 90; 93.99; 90 | 4518 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567297 | CIF | C34 H46 Cu F6 N10 O6 S2 | P b c a | 12.27; 19.141; 36.523 90; 90; 90 | 8578 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567298 | CIF | C78 H176 O25 Rb2 Si6 U2 | P 1 21/n 1 | 14.04416; 29.0153; 27.517 90; 91.0486; 90 | 11211.2 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567299 | CIF | C72 H162 O25 Rb Si6 U2 | P -1 | 13.7997; 16.508; 25.0252 71.888; 81.133; 71.005 | 5114.5 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567300 | CIF | C72 H162 Na O25 Si6 U2 | P 1 21 1 | 13.8302; 31.0949; 14.0653 90; 118.148; 90 | 5333.4 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567301 | CIF | C79 H170 Cs2 O26 Si6 U2 | P -1 | 14.3992; 14.5329; 30.7352 88.132; 79.13; 60.661 | 5492.7 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567302 | CIF | C86 H178 O26 Rb2 Si6 U2 | P -1 | 14.484; 17.573; 25.4883 79.6962; 89.4157; 67.026 | 5863.83 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567303 | CIF | C72 H162 Cs4 N2 O25 Si6 U2 | P -1 | 14.2492; 30.7972; 30.9557 115.848; 95.2709; 98.8528 | 11885.2 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567304 | CIF | C72 H162 N2 O25 Rb2 Si6 U2 | P 1 | 14.0149; 17.5229; 24.7263 83.4471; 83.4537; 70.099 | 5654 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567305 | CIF | C72 H162 Cs2 O25 Si6 U2 | I 41/a :2 | 25.3833; 25.3833; 65.6666 90; 90; 90 | 42309.8 | Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Cation assisted binding and cleavage of dinitrogen by uranium complexes Chemical Science, 2022, 13, 9232-9242 |
| 1567306 | CIF | C38 H48 N2 O2 | P -1 | 10.0611; 11.5414; 15.8166 77.316; 74.707; 65.801 | 1602.9 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567307 | CIF | C46 H64 N2 O2 | I 1 2/m 1 | 13.809; 8.7376; 17.19 90; 99.585; 90 | 2045.1 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567308 | CIF | C18 H10 O2 S | P 1 21/c 1 | 7.0219; 20.7503; 17.221 90; 91.096; 90 | 2508.8 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567309 | CIF | C38 H48 N2 O2 | P -1 | 6.142; 9.094; 15.431 106.415; 93.806; 97.936 | 813.8 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567310 | CIF | C30 H28 O2 S | P c a 21 | 19.7648; 7.4276; 16.1962 90; 90; 90 | 2377.7 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567311 | CIF | C31 H24 O2 S | P b c n | 15.4383; 20.371; 7.3501 90; 90; 90 | 2311.6 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567312 | CIF | C54 H84 Cl Cr N2 O5 | C 1 2/c 1 | 27.514; 12.1313; 32.252 90; 99.556; 90 | 10615.7 | Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W. Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design Chemical Science, 2022, 13, 9595-9606 |
| 1567313 | CIF | C48.5 H34 F10 Ir N4 O2 P | P -1 | 12.373; 19.541; 21.137 63.579; 75.787; 71.958 | 4317 | Wu, Yanyu; Sutton, Gregory D.; Halamicek, Michael D. S.; Xing, Xinxin; Bao, Jiming; Teets, Thomas S. Cyclometalated iridium-coumarin ratiometric oxygen sensors: improved signal resolution and tunable dynamic ranges Chemical Science, 2022, 13, 8804-8812 |
| 1567314 | CIF | C55 H39 F10 Ir N4 O4 P | P -1 | 12.0293; 13.6426; 15.8219 79.16; 81.948; 71.953 | 2415.43 | Wu, Yanyu; Sutton, Gregory D.; Halamicek, Michael D. S.; Xing, Xinxin; Bao, Jiming; Teets, Thomas S. Cyclometalated iridium-coumarin ratiometric oxygen sensors: improved signal resolution and tunable dynamic ranges Chemical Science, 2022, 13, 8804-8812 |
| 1567315 | CIF | C50 H30 F10 Ir N4 O4 P | P -1 | 11.885; 13.195; 16.517 105.127; 97.59; 101.773 | 2400.4 | Wu, Yanyu; Sutton, Gregory D.; Halamicek, Michael D. S.; Xing, Xinxin; Bao, Jiming; Teets, Thomas S. Cyclometalated iridium-coumarin ratiometric oxygen sensors: improved signal resolution and tunable dynamic ranges Chemical Science, 2022, 13, 8804-8812 |
| 1567326 | CIF | C33 H23 B F5 O2 S3 | P -1 | 7.3149; 8.4664; 25.63 93.482; 94.312; 100.726 | 1550.6 | Li, Ziyong; Zhang, Ji-Rui; Tian, Xu-Ke; Yang, Shuren; Chen, Si; Zhou, Hui; Yang, Xiao-Gang Green-/NIR-light-controlled rapid photochromism featuring reversible thermally activated delayed fluorescence and photoelectronic switching Chemical Science, 2022, 13, 9381-9386 |
| 1567327 | CIF | C35 H48 Au F6 N4 O6 Sb | P -1 | 11.63; 12.52; 15.71 76.35; 72.58; 65.54 | 1970 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567328 | CIF | C14 H18 O3 | P 21 21 21 | 6.3989; 7.1432; 27.0217 90; 90; 90 | 1235.12 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567329 | CIF | C37.26 H44.26 F6 I0.11 N4 O0.89 Sb | P 1 21/n 1 | 12.29; 16.44; 19.22 90; 101.35; 90 | 3807 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567330 | CIF | C31 H38 Au Cl N4 | P 1 21/n 1 | 9.9684; 23.6287; 12.9108 90; 101.309; 90 | 2982 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567331 | CIF | C37 H46 Cl N5 O2 | P 1 21/c 1 | 11.589; 11.486; 26.6 90; 97.78; 90 | 3508 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567332 | CIF | C32 H42 Au Cl N5 O0.46 | P -1 | 9.426; 12.481; 15.289 108.17; 91.2; 110.83 | 1580 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567333 | CIF | C35 H50 Au Cl2 F6 N4 O2 Sb | P -1 | 12.502; 15.3475; 22.3529 83.846; 81.645; 79.159 | 4153.6 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567334 | CIF | C46 H55 Au Cl N5 O | P -1 | 12.25; 15.5; 23.22 89.58; 84.7; 85.16 | 4374 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567335 | CIF | C72 H82 Au2 F12 N10 Sb2 | P b c n | 25.668; 11.721; 25.249 90; 90; 90 | 7596 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567336 | CIF | C42 H45 Au F6 N5 Sb | P 1 21/n 1 | 17.0009; 11.783; 19.9923 90; 98.26; 90 | 3963.3 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567337 | CIF | C67 H88 Au2 Cl2 F12 N8 O Sb2 | P 1 21/c 1 | 16.5318; 17.9336; 25.9388 90; 107.017; 90 | 7353.5 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567338 | CIF | C167 H215 Au4 B4 Cl4 F16 N21 O9 | P -1 | 16.4149; 23.5323; 24.8306 64.105; 80.992; 81.246 | 8484.1 | Font, Pau; Valdés, Hugo; Guisado-Barrios, Gregorio; Ribas, Xavi Hemilabile MIC^N ligands allow oxidant-free Au(i)/Au(iii) arylation-lactonization of γ-alkenoic acids Chemical Science, 2022, 13, 9351-9360 |
| 1567382 | CIF | C11 H8 Au Br F4 N2 | P 1 21/c 1 | 14.0862; 15.4831; 12.9171 90; 106.586; 90 | 2700 | Feng, Chi; Seki, Tomohiro; Sakamoto, Shunichi; Sasaki, Toshiyuki; Takamizawa, Satoshi; Ito, Hajime Mechanical deformation and multiple thermal restoration of organic crystals: reversible multi-stage shape-changing effect with luminescence-color changes Chemical Science, 2022, 13, 9544-9551 |
| 1567383 | CIF | C11 H8 Au Br F4 N2 | P n m a | 12.9752; 6.8244; 15.5938 90; 90; 90 | 1380.8 | Feng, Chi; Seki, Tomohiro; Sakamoto, Shunichi; Sasaki, Toshiyuki; Takamizawa, Satoshi; Ito, Hajime Mechanical deformation and multiple thermal restoration of organic crystals: reversible multi-stage shape-changing effect with luminescence-color changes Chemical Science, 2022, 13, 9544-9551 |
| 1567384 | CIF | C11 H8 Au Br F4 N2 | P n m a | 12.9715; 6.8326; 15.6063 90; 90; 90 | 1383.17 | Feng, Chi; Seki, Tomohiro; Sakamoto, Shunichi; Sasaki, Toshiyuki; Takamizawa, Satoshi; Ito, Hajime Mechanical deformation and multiple thermal restoration of organic crystals: reversible multi-stage shape-changing effect with luminescence-color changes Chemical Science, 2022, 13, 9544-9551 |
| 1567385 | CIF | C11 H8 Au Br F4 N2 | P 1 21/c 1 | 14.0976; 15.4992; 12.9484 90; 106.584; 90 | 2711.56 | Feng, Chi; Seki, Tomohiro; Sakamoto, Shunichi; Sasaki, Toshiyuki; Takamizawa, Satoshi; Ito, Hajime Mechanical deformation and multiple thermal restoration of organic crystals: reversible multi-stage shape-changing effect with luminescence-color changes Chemical Science, 2022, 13, 9544-9551 |
| 1567386 | CIF | C11 H8 Au Br F4 N2 | P 1 21/c 1 | 7.685; 15.3186; 12.9425 90; 120.622; 90 | 1311.16 | Feng, Chi; Seki, Tomohiro; Sakamoto, Shunichi; Sasaki, Toshiyuki; Takamizawa, Satoshi; Ito, Hajime Mechanical deformation and multiple thermal restoration of organic crystals: reversible multi-stage shape-changing effect with luminescence-color changes Chemical Science, 2022, 13, 9544-9551 |
| 1567387 | CIF | C11 H8 Au Br F4 N2 | P 1 21/c 1 | 7.6985; 15.3528; 12.9738 90; 120.533; 90 | 1320.79 | Feng, Chi; Seki, Tomohiro; Sakamoto, Shunichi; Sasaki, Toshiyuki; Takamizawa, Satoshi; Ito, Hajime Mechanical deformation and multiple thermal restoration of organic crystals: reversible multi-stage shape-changing effect with luminescence-color changes Chemical Science, 2022, 13, 9544-9551 |
| 1567393 | CIF | C20 H24 Fe O6 | P 1 2/c 1 | 34.6729; 5.8345; 19.159 90; 106.03; 90 | 3725.1 | Oberle, Kjersti G.; Whitman, Elizabeth L.; Jolly, Charles S.; Webster, Katherine A.; Marx, Benjamin S.; Howard, Christopher M.; Hanger, Clara A.; Ramey, Erin E.; Zou, Yutong; Lowe, Jared C.; Turlington, Mark; Turlington, Christopher R. Metallopolymers in minutes via organocatalysis at room temperature Polymer Chemistry, 2022, 13, 4747-4751 |
| 1567397 | CIF | C18 H27 O7 P | P 21 21 21 | 6.3864; 7.8416; 39.8125 90; 90; 90 | 1993.79 | Ren, Xinkun; Chandgude, Ajay L.; Carminati, Daniela M.; Shen, Zhuofan; Khare, Sagar D.; Fasan, Rudi Highly stereoselective and enantiodivergent synthesis of cyclopropylphosphonates with engineered carbene transferases Chemical Science, 2022, 13, 8550-8556 |
| 1567398 | CIF | C43 H67 Br2 Mn N7 O Si2 | P b c a | 16.5285; 17.378; 34.2234 90; 90; 90 | 9830.06 | Kalra, Shweta; Pividori, Daniel; Fehn, Dominik; Dai, Chenshu; Dong, Shicheng; Yao, Shenglai; Zhu, Jun; Meyer, Karsten; Driess, Matthias A bis(silylene)pyridine pincer ligand can stabilize mononuclear manganese(0) complexes: facile access to isolable analogues of the elusive d7-Mn(CO)5 radical Chemical Science, 2022, 13, 8634-8641 |
| 1567399 | CIF | C48 H65 Mn N7 O3 Si2 | P 1 21 1 | 10.1252; 18.0882; 13.3966 90; 103.606; 90 | 2384.69 | Kalra, Shweta; Pividori, Daniel; Fehn, Dominik; Dai, Chenshu; Dong, Shicheng; Yao, Shenglai; Zhu, Jun; Meyer, Karsten; Driess, Matthias A bis(silylene)pyridine pincer ligand can stabilize mononuclear manganese(0) complexes: facile access to isolable analogues of the elusive d7-Mn(CO)5 radical Chemical Science, 2022, 13, 8634-8641 |
| 1567400 | CIF | C45 H75 Mn N7 P2 Si2 | P 1 21 1 | 9.522; 18.7589; 13.6576 90; 97.022; 90 | 2421.25 | Kalra, Shweta; Pividori, Daniel; Fehn, Dominik; Dai, Chenshu; Dong, Shicheng; Yao, Shenglai; Zhu, Jun; Meyer, Karsten; Driess, Matthias A bis(silylene)pyridine pincer ligand can stabilize mononuclear manganese(0) complexes: facile access to isolable analogues of the elusive d7-Mn(CO)5 radical Chemical Science, 2022, 13, 8634-8641 |
| 1567401 | CIF | C48 H82 Mn N7 P2 Si2 | P 1 21/c 1 | 13.5113; 13.8328; 28.2254 90; 92.402; 90 | 5270.67 | Kalra, Shweta; Pividori, Daniel; Fehn, Dominik; Dai, Chenshu; Dong, Shicheng; Yao, Shenglai; Zhu, Jun; Meyer, Karsten; Driess, Matthias A bis(silylene)pyridine pincer ligand can stabilize mononuclear manganese(0) complexes: facile access to isolable analogues of the elusive d7-Mn(CO)5 radical Chemical Science, 2022, 13, 8634-8641 |
| 1567402 | CIF | C37 H30 Cl2 F18 Mo N2 O4 | P -1 | 11.8411; 12.4718; 15.3713 80.252; 81.208; 66.112 | 2036.64 | Musso, Janis V.; De Jesus Silva, Jordan; Benedikter, Mathis J.; Groos, Jonas; Frey, Wolfgang; Copéret, Christophe; Buchmeiser, Michael R. Cationic molybdenum oxo alkylidenes stabilized by N-heterocyclic carbenes: from molecular systems to efficient supported metathesis catalysts Chemical Science, 2022, 13, 8649-8656 |
| 1567403 | CIF | C53 H44 Al Cl F41 Mo N2 O7 | P -1 | 12.9654; 13.8876; 19.3009 79.898; 78.994; 86.057 | 3356.2 | Musso, Janis V.; De Jesus Silva, Jordan; Benedikter, Mathis J.; Groos, Jonas; Frey, Wolfgang; Copéret, Christophe; Buchmeiser, Michael R. Cationic molybdenum oxo alkylidenes stabilized by N-heterocyclic carbenes: from molecular systems to efficient supported metathesis catalysts Chemical Science, 2022, 13, 8649-8656 |
| 1567414 | CIF | C26 H18 N2 O3 | P 1 21 1 | 6.3457; 12.49324; 29.7405 90; 93.4861; 90 | 2353.41 | Li, Ao; Gao, Yang; Lu, Jian-Bin; Chen, Zhi-Chao; Du, Wei; Chen, Ying-Chun Asymmetric higher-order [10 + n] cycloadditions of palladium-containing 10π-cycloaddends Chemical Science, 2022, 13, 9265-9270 |
| 1567415 | CIF | C48 H70 Al Fe N2 | P 1 21/n 1 | 16.196; 12.016; 23.162 90; 93.907; 90 | 4497 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567416 | CIF | C45 H61 Al Fe I2 N2 | P 1 21/c 1 | 16.6116; 14.202; 20.0432 90; 103.503; 90 | 4597.8 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567417 | CIF | C104 H146 Al2 Fe2 I2 N4 | P 1 21/n 1 | 16.797; 16.275; 19.697 90; 112.357; 90 | 4980 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567418 | CIF | C96 H136 Al2 Fe2 I2 N4 | P -1 | 15.8692; 16.9522; 18.67859 112.089; 93.6385; 100.472 | 4530.35 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567419 | CIF | C97 H130 Al2 Fe2 I2 N4 | P 1 21/n 1 | 22.1651; 19.7884; 23.3393 90; 113.136; 90 | 9413.59 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567420 | CIF | C96 H136 Al2 Fe2 N4 | P 1 21/n 1 | 15.996; 29.021; 19.433 90; 91.562; 90 | 9018 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567421 | CIF | C90 H122 Al2 Fe2 N4 | P 1 21/c 1 | 19.856; 14.8; 29.131 90; 105.079; 90 | 8266 | Dhara, Debabrata; Fantuzzi, Felipe; Härterich, Marcel; Dewhurst, Rian D.; Krummenacher, Ivo; Arrowsmith, Merle; Pranckevicius, Conor; Braunschweig, Holger Stepwise reduction of a base-stabilised ferrocenyl aluminium(iii) dihalide for the synthesis of structurally-diverse dialane species Chemical Science, 2022, 13, 9693-9700 |
| 1567422 | CIF | C32 H24 N2 O2 S2 | P b c a | 14.187; 13.429; 27.488 90; 90; 90 | 5237 | Ge, Lingbing; Hou, Songjun; Chen, Yaorong; Wu, Qingqing; Long, Lanxin; Yang, Xingzhou; Ji, Yu; Lin, Luchun; Xue, Guodong; Liu, Junyang; Liu, Xiaodong; Lambert, Colin J.; Hong, Wenjing; Zheng, Yonghao Hydrogen-bond-induced quantum interference in single-molecule junctions of regioisomers Chemical Science, 2022, 13, 9552-9559 |
| 1567423 | CIF | C32 H24 N2 O2 S2 | P -1 | 4.88; 10.531; 12.724 105.72; 91.51; 99.05 | 620 | Ge, Lingbing; Hou, Songjun; Chen, Yaorong; Wu, Qingqing; Long, Lanxin; Yang, Xingzhou; Ji, Yu; Lin, Luchun; Xue, Guodong; Liu, Junyang; Liu, Xiaodong; Lambert, Colin J.; Hong, Wenjing; Zheng, Yonghao Hydrogen-bond-induced quantum interference in single-molecule junctions of regioisomers Chemical Science, 2022, 13, 9552-9559 |
| 1567425 | CIF | C21 H24 O4 S | P 1 21 1 | 11.826; 7.8223; 12.199 90; 118.99; 90 | 987.1 | He, Fu-Sheng; Zhang, Chun; Jiang, Minghui; Lou, Lujun; Wu, Jie; Ye, Shengqing Access to chiral β-sulfonyl carbonyl compounds via photoinduced organocatalytic asymmetric radical sulfonylation with sulfur dioxide Chemical Science, 2022, 13, 8834-8839 |
| 1567429 | CIF | C20 H12 Cl4 N8 Na2 O14 Pd | P b c a | 9.2426; 18.4473; 35.708 90; 90; 90 | 6088.3 | Panja, Subir; Ahsan, Salman; Pal, Tanay; Kolb, Simon; Ali, Wajid; Sharma, Sulekha; Das, Chandan; Grover, Jagrit; Dutta, Arnab; Werz, Daniel B.; Paul, Amit; Maiti, Debabrata Non-directed Pd-catalysed electrooxidative olefination of arenes Chemical Science, 2022, 13, 9432-9439 |
| 1567439 | CIF | C25 H40 N2 O4 | P -1 | 9.3339; 9.6044; 14.535 81.54; 78.191; 89.814 | 1261.1 | Mondal, Debashis; Dandekar, Bhupendra R.; Ahmad, Manzoor; Mondal, Abhishek; Mondal, Jagannath; Talukdar, Pinaki Selective and rapid water transportation across a self-assembled peptide-diol channel via the formation of a dual water array Chemical Science, 2022, 13, 9614-9623 |
| 1567440 | CIF | C23 H40 N2 O5 | C 1 2 1 | 37.83; 4.929; 12.845 90; 97.014; 90 | 2377 | Mondal, Debashis; Dandekar, Bhupendra R.; Ahmad, Manzoor; Mondal, Abhishek; Mondal, Jagannath; Talukdar, Pinaki Selective and rapid water transportation across a self-assembled peptide-diol channel via the formation of a dual water array Chemical Science, 2022, 13, 9614-9623 |
| 1567442 | CIF | C41 H63 Fe N3 | P -1 | 9.6054; 19.7203; 20.7848 104.662; 92.247; 90.183 | 3805.6 | Yang, Po-Chun; Yu, Kuan-Po; Hsieh, Chi-Tien; Zou, Junjie; Fang, Chia-Te; Liu, Hsin-Kuan; Pao, Chih-Wen; Deng, Liang; Cheng, Mu-Jeng; Lin, Chun-Yi Stabilization of a high-spin three-coordinate Fe(iii) imidyl complex by radical delocalization Chemical Science, 2022, 13, 9637-9643 |
| 1567443 | CIF | C32 H52 Li2 N2 | P -1 | 8.9896; 9.3153; 10.4649 74.635; 87.557; 62.337 | 745.1 | Yang, Po-Chun; Yu, Kuan-Po; Hsieh, Chi-Tien; Zou, Junjie; Fang, Chia-Te; Liu, Hsin-Kuan; Pao, Chih-Wen; Deng, Liang; Cheng, Mu-Jeng; Lin, Chun-Yi Stabilization of a high-spin three-coordinate Fe(iii) imidyl complex by radical delocalization Chemical Science, 2022, 13, 9637-9643 |
| 1567444 | CIF | C32 H52 Fe N2 | C 1 2/c 1 | 9.3375; 15.828; 21.069 90; 96.519; 90 | 3093.7 | Yang, Po-Chun; Yu, Kuan-Po; Hsieh, Chi-Tien; Zou, Junjie; Fang, Chia-Te; Liu, Hsin-Kuan; Pao, Chih-Wen; Deng, Liang; Cheng, Mu-Jeng; Lin, Chun-Yi Stabilization of a high-spin three-coordinate Fe(iii) imidyl complex by radical delocalization Chemical Science, 2022, 13, 9637-9643 |
| 1567445 | CIF | C42 H67 Fe N3 | P 1 21/n 1 | 9.9409; 36.563; 10.6275 90; 95.047; 90 | 3847.8 | Yang, Po-Chun; Yu, Kuan-Po; Hsieh, Chi-Tien; Zou, Junjie; Fang, Chia-Te; Liu, Hsin-Kuan; Pao, Chih-Wen; Deng, Liang; Cheng, Mu-Jeng; Lin, Chun-Yi Stabilization of a high-spin three-coordinate Fe(iii) imidyl complex by radical delocalization Chemical Science, 2022, 13, 9637-9643 |
| 1567447 | CIF | C40 H26 B N3 O2 | P 21 21 21 | 9.9788; 15.3329; 19.7187 90; 90; 90 | 3017.04 | van Vliet, Sven; Alachouzos, Georgios; de Vries, Folkert; Pfeifer, Lukas; Feringa, Ben L. Visible light activated BINOL-derived chiroptical switches based on boron integrated hydrazone complexes Chemical Science, 2022, 13, 9713-9718 |
| 1567448 | CIF | C40 H28 B Cl2 N3 O2 | P 1 21 1 | 13.375; 6.5182; 18.2995 90; 98.281; 90 | 1578.73 | van Vliet, Sven; Alachouzos, Georgios; de Vries, Folkert; Pfeifer, Lukas; Feringa, Ben L. Visible light activated BINOL-derived chiroptical switches based on boron integrated hydrazone complexes Chemical Science, 2022, 13, 9713-9718 |
| 1567449 | CIF | C58 H4 Al2 F80 O22 Ru3 | P -1 | 11.298; 14.164; 15.698 71.621; 71.685; 73.388 | 2214 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567450 | CIF | C2.76 H0.19 Al0.1 F3.81 O1.05 Os0.14 | P -1 | 11.283; 14.143; 15.714 71.674; 71.73; 73.486 | 2211.9 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567451 | CIF | C29 Al F36 N O17 Ru4 | P 1 21/c 1 | 15.639; 15.156; 41.36 90; 95.87; 90 | 9752 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567452 | CIF | C38 Al2 Cl2 F63 O6 | P 1 21/n 1 | 14.514; 10.566; 18.161 90; 98.81; 90 | 2752 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567453 | CIF | C68 H2 Al4 F114 O26 Os3 | P -1 | 11.81; 12.939; 19.507 102.689; 103.941; 92.667 | 2806.8 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567454 | CIF | C22 Al F36 I3 O10 Ru2 | P n m a | 18.581; 13.756; 16.816 90; 90; 90 | 4298.2 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567455 | CIF | C57 H3 Ag Al2 F61 O30 Os6 | P 1 21/c 1 | 20.504; 17.81; 25.217 90; 107.09; 90 | 8802 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567456 | CIF | C21 Al F36 I O9 Ru | P 4/n :2 | 13.768; 13.768; 9.5388 90; 90; 90 | 1808.2 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567457 | CIF | C68 H2 Al4 F114 O26 Ru3 | P -1 | 11.819; 12.94; 19.477 102.636; 103.912; 92.736 | 2805.5 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567458 | CIF | C46 H2 Ag Al F40 O28 Ru6 | P -1 | 12.349; 12.385; 23.041 90.85; 94.031; 93.152 | 3509 | Sellin, Malte; Friedmann, Christian; Mayländer, Maximilian; Richert, Sabine; Krossing, Ingo Towards clustered carbonyl cations [M3(CO)14]2+ (M = Ru, Os): the need for innocent deelectronation Chemical Science, 2022, 13, 9147-9158 |
| 1567461 | CIF | C19 H21 N O2 | P 1 21/c 1 | 9.0815; 11.6927; 14.7988 90; 102.05; 90 | 1536.82 | Plöger, Stefanie; Mück-Lichtenfeld, Christian; Daniliuc, Constantin G.; Studer, Armido Azodioxy compounds as precursors for C-radicals and their application in thermal styrene difunctionalization Chemical Science, 2022, 13, 9749-9754 |
| 1567476 | CIF | C62 H49 F12.1 N6 Ni2 O6 | P 21 21 21 | 15.4863; 16.5824; 22.2267 90; 90; 90 | 5707.82 | Delamare, Aline; Naulet, Guillaume; Kauffmann, Brice; Guichard, Gilles; Compain, Guillaume Hexafluoroisobutylation of enolates through a tandem elimination/allylic shift/hydrofluorination reaction Chemical Science, 2022, 13, 9507-9514 |
| 1567477 | CIF | C8 H8 F6 O2 | I 1 a 1 | 6.2917; 16.636; 9.166 90; 102.361; 90 | 937.15 | Delamare, Aline; Naulet, Guillaume; Kauffmann, Brice; Guichard, Gilles; Compain, Guillaume Hexafluoroisobutylation of enolates through a tandem elimination/allylic shift/hydrofluorination reaction Chemical Science, 2022, 13, 9507-9514 |
| 1567478 | CIF | C31 H25 F7 N3 Ni O3 | P 21 21 21 | 11.0205; 13.9185; 19.0776 90; 90; 90 | 2926.29 | Delamare, Aline; Naulet, Guillaume; Kauffmann, Brice; Guichard, Gilles; Compain, Guillaume Hexafluoroisobutylation of enolates through a tandem elimination/allylic shift/hydrofluorination reaction Chemical Science, 2022, 13, 9507-9514 |
| 1567479 | CIF | C7 H4 F6 N2 | P 1 21/c 1 | 13.7855; 5.6753; 11.6678 90; 103.923; 90 | 886.03 | Delamare, Aline; Naulet, Guillaume; Kauffmann, Brice; Guichard, Gilles; Compain, Guillaume Hexafluoroisobutylation of enolates through a tandem elimination/allylic shift/hydrofluorination reaction Chemical Science, 2022, 13, 9507-9514 |
| 1567487 | CIF | C16 H17 N O2 S2 | P 21 21 21 | 6.2635; 11.4411; 20.8675 90; 90; 90 | 1495.4 | Lai, Junshan; Reid, Jolene P. Interrogating the thionium hydrogen bond as a noncovalent stereocontrolling interaction in chiral phosphate catalysis Chemical Science, 2022, 13, 11065-11073 |
| 1567538 | CIF | C33 H39 N O4 | P 1 21 1 | 9.28; 17.0143; 10.0461 90; 115.351; 90 | 1433.5 | Balanna, Kuruva; Barik, Soumen; Shee, Sayan; Gonnade, Rajesh G.; Biju, Akkattu T. Dynamic kinetic resolution of γ,γ-disubstituted indole 2-carboxaldehydes <i>via</i> NHC-Lewis acid cooperative catalysis for the synthesis of tetracyclic ε-lactones. Chemical science, 2022, 13, 11513-11518 |
| 1567539 | CIF | C52 H84 Ag14 F24 N6 O22 S6 | C 1 2/c 1 | 21.4916; 18.1316; 23.7184 90; 91.945; 90 | 9237.2 | Luo, Xi-Ming; Huang, Shuo; Luo, Peng; Ma, Kai; Wang, Zhao-Yang; Dong, Xi-Yan; Zang, Shuang-Quan Snapshots of key intermediates unveiling the growth from silver ions to Ag70 nanoclusters Chemical Science, 2022, 13, 11110-11118 |
| 1567540 | CIF | C68 H112 Ag24 F30 N8 O28 S9 | P -1 | 14.2139; 15.6549; 17.3498 94.12; 110.998; 104.208 | 3439.1 | Luo, Xi-Ming; Huang, Shuo; Luo, Peng; Ma, Kai; Wang, Zhao-Yang; Dong, Xi-Yan; Zang, Shuang-Quan Snapshots of key intermediates unveiling the growth from silver ions to Ag70 nanoclusters Chemical Science, 2022, 13, 11110-11118 |
| 1567541 | CIF | C62 H77 Ag24 F50 N5 O25 S9 | P -1 | 14.9116; 16.3962; 18.2438 97.091; 112.841; 104.162 | 3864.89 | Luo, Xi-Ming; Huang, Shuo; Luo, Peng; Ma, Kai; Wang, Zhao-Yang; Dong, Xi-Yan; Zang, Shuang-Quan Snapshots of key intermediates unveiling the growth from silver ions to Ag70 nanoclusters Chemical Science, 2022, 13, 11110-11118 |
| 1567548 | CIF | C22 H17 N O | P -1 | 7.4998; 11.4895; 18.504 98.672; 96.018; 90.007 | 1567.3 | Muraoka, Masanobu; Goto, Masahide; Minami, Masaki; Zhou, Dayang; Suzuki, Takeyuki; Yajima, Tatsuo; Hayashi, Jun'ichi; Sogawa, Hiromitsu; Sanda, Fumio Ethynylene-linked multifunctional benzoxazines: the effect of the ethynylene group and packing on thermal behavior Polymer Chemistry, 2022, 13, 5590-5596 |
| 1567549 | CIF | C8 H7 N O2 | F d d 2 | 11.8514; 30.185; 7.533 90; 90; 90 | 2694.8 | Wang, Bin; Ren, Hongyuan; Cao, Hou-Ji; Lu, Changsheng; Yan, Hong A switchable redox annulation of 2-nitroarylethanols affording N-heterocycles: photoexcited nitro as a multifunctional handle Chemical Science, 2022, 13, 11074-11082 |
| 1567550 | CIF | C16 H11 N O | R -3 :H | 35.383; 35.383; 5.235 90; 90; 120 | 5675.9 | Wang, Bin; Ren, Hongyuan; Cao, Hou-Ji; Lu, Changsheng; Yan, Hong A switchable redox annulation of 2-nitroarylethanols affording N-heterocycles: photoexcited nitro as a multifunctional handle Chemical Science, 2022, 13, 11074-11082 |
| 1567551 | CIF | C34 H25 N | P 1 21/n 1 | 9.928; 9.4716; 52.455 90; 90.791; 90 | 4932.1 | Wang, Bin; Ren, Hongyuan; Cao, Hou-Ji; Lu, Changsheng; Yan, Hong A switchable redox annulation of 2-nitroarylethanols affording N-heterocycles: photoexcited nitro as a multifunctional handle Chemical Science, 2022, 13, 11074-11082 |
| 1567552 | CIF | C21 H19 N O3 | C 1 c 1 | 14.0103; 35.603; 11.376 90; 117.174; 90 | 5048.1 | Wang, Bin; Ren, Hongyuan; Cao, Hou-Ji; Lu, Changsheng; Yan, Hong A switchable redox annulation of 2-nitroarylethanols affording N-heterocycles: photoexcited nitro as a multifunctional handle Chemical Science, 2022, 13, 11074-11082 |
| 1567572 | CIF | C44 H40 Br4 Co2 N4 O6 | P -1 | 9.4017; 10.5681; 12.696 66.4289; 77.1738; 84.9305 | 1127.35 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567573 | CIF | C31 H44 Co N3 O2 | P 1 21/c 1 | 11.59303; 11.77994; 21.25835 90; 91.1883; 90 | 2902.53 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567574 | CIF | C68 H68 Co2 N4 O6 | P b c a | 10.9817; 17.1391; 31.4588 90; 90; 90 | 5921.1 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567575 | CIF | C84 H100 Co2 N4 O6 | P -1 | 11.1838; 12.1674; 15.6011 72.164; 70.4512; 89.2308 | 1895.03 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567576 | CIF | C52 H60 Co2 N4 O6 | P -1 | 11.1341; 13.1609; 17.4589 81.674; 71.6133; 84.1723 | 2397.89 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567577 | CIF | C57 H72 Co2 N4 O10 | P 1 21/c 1 | 14.3182; 12.0109; 15.9104 90; 97.507; 90 | 2712.73 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567578 | CIF | C60 H80 Co2 N8 O6 | P -1 | 13.2692; 15.2605; 16.5352 77.6834; 76.0242; 66.204 | 2947.53 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567579 | CIF | C54 H58 Co2 N4 O6 | P 1 21/c 1 | 13.5589; 35.2233; 16.1183 90; 105.07; 90 | 7433.2 | Takebayashi, Satoshi; Fayzullin, Robert R.; Bansal, Richa Direct observation of reversible bond homolysis by 2D EXSY NMR Chemical Science, 2022, 13, 9202-9209 |
| 1567580 | CIF | C53 H76 N2 O | P -1 | 14.2247; 18.7107; 19.0753 109.83; 93.98; 103.16 | 4590.5 | Théry, Valentin; Molton, Florian; Sirach, Selim; Tillet, Neven; Pécaut, Jacques; Tomás-Mendivil, Eder; Martin, David The curious case of a sterically crowded Stenhouse salt Chemical Science, 2022, 13, 9755-9760 |
| 1567581 | CIF | C53 H79 Cl N2 O2 | P 1 21/c 1 | 13.0058; 18.6532; 20.2559 90; 107.607; 90 | 4683.9 | Théry, Valentin; Molton, Florian; Sirach, Selim; Tillet, Neven; Pécaut, Jacques; Tomás-Mendivil, Eder; Martin, David The curious case of a sterically crowded Stenhouse salt Chemical Science, 2022, 13, 9755-9760 |
| 1567582 | CIF | C57 H84 F3 N2 O4.5 S | I 1 2/a 1 | 17.3378; 16.0403; 38.924 90; 95.096; 90 | 10782.1 | Théry, Valentin; Molton, Florian; Sirach, Selim; Tillet, Neven; Pécaut, Jacques; Tomás-Mendivil, Eder; Martin, David The curious case of a sterically crowded Stenhouse salt Chemical Science, 2022, 13, 9755-9760 |
| 1567583 | CIF | C54 H78 Cl2 F12 N2 O P2 | P 1 21/n 1 | 12.152; 31.9515; 14.2567 90; 97.129; 90 | 5492.7 | Théry, Valentin; Molton, Florian; Sirach, Selim; Tillet, Neven; Pécaut, Jacques; Tomás-Mendivil, Eder; Martin, David The curious case of a sterically crowded Stenhouse salt Chemical Science, 2022, 13, 9755-9760 |
| 1567601 | CIF | C60 H68 Ga N4 P | P 1 21/n 1 | 11.5827; 15.4151; 27.061 90; 90.708; 90 | 4831.3 | Sigmund, Lukas M.; Engels, Eliane; Richert, Nick; Greb, Lutz Calix[4]pyrrolato gallate: square planar-coordinated gallium(iii) and its metal–ligand cooperative reactivity with CO2 and alcohols Chemical Science, 2022, 13, 11215-11220 |
| 1567602 | CIF | C52.5 H53 Cl Ga N4 P | P 1 21/c 1 | 25.411; 16.6359; 23.7139 90; 107.797; 90 | 9545 | Sigmund, Lukas M.; Engels, Eliane; Richert, Nick; Greb, Lutz Calix[4]pyrrolato gallate: square planar-coordinated gallium(iii) and its metal–ligand cooperative reactivity with CO2 and alcohols Chemical Science, 2022, 13, 11215-11220 |
| 1567603 | CIF | C56 H60 Ga N4 O P | P 1 21/c 1 | 13.0677; 21.406; 17.1423 90; 108.63; 90 | 4543.9 | Sigmund, Lukas M.; Engels, Eliane; Richert, Nick; Greb, Lutz Calix[4]pyrrolato gallate: square planar-coordinated gallium(iii) and its metal–ligand cooperative reactivity with CO2 and alcohols Chemical Science, 2022, 13, 11215-11220 |
| 1567608 | CIF | C23 H29 N | P 1 21 1 | 10.9102; 6.1038; 14.7452 90; 99.5; 90 | 968.47 | Sun, Yue; Ma, Chun; Li, Zhiming; Zhang, Junliang Palladium/GF-Phos-catalyzed asymmetric carbenylative amination to access chiral pyrrolidines and piperidines Chemical Science, 2022, 13, 11150-11155 |
| 1567609 | CIF | C23 H16 I3 N | P b c n | 21.1343; 13.7339; 7.328 90; 90; 90 | 2127 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567610 | CIF | C22 H14 I3 N | P -1 | 8.0838; 11.8898; 12.2871 64.355; 77.901; 77.39 | 1030.02 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567611 | CIF | C23 H14 F3 I2 N O3 S | P -1 | 8.5783; 11.1636; 13.3063 74.307; 71.324; 79.269 | 1155.23 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567612 | CIF | C22 H15 I3 N2 | P b c n | 21.0883; 13.773; 7.3022 90; 90; 90 | 2120.9 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567613 | CIF | C22 H14 I3 N | P b c n | 21.0383; 13.782; 7.3031 90; 90; 90 | 2117.5 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567614 | CIF | C24 H16 F3 I2 N O3 S | P -1 | 7.2077; 12.3954; 14.0967 98.565; 101.823; 91.413 | 1216.98 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567615 | CIF | C23 H14 F3 I2 N O3 S | P -1 | 7.1362; 12.3559; 14.2656 98.46; 103.067; 94.936 | 1202.63 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567616 | CIF | C23 H15 F3 I2 N2 O3 S | P -4 21 c | 22.544; 22.544; 9.5927 90; 90; 90 | 4875.3 | Decato, Daniel A.; Sun, Jiyu; Boller, Madeleine R.; Berryman, Orion B. Pushing the limits of the hydrogen bond enhanced halogen bond—the case of the C–H hydrogen bond Chemical Science, 2022, 13, 11156-11162 |
| 1567617 | CIF | C59 H51 F6 N5 O6 S2 | C 1 2/c 1 | 22.116; 17.029; 16.379 90; 124.27; 90 | 5098 | Karak, Pirudhan; Choudhury, Joyanta Conformationally flexible heterohelicenes as stimuli-controlled soft molecular springs Chemical Science, 2022, 13, 11163-11173 |
| 1567618 | CIF | C51 H45 N5 | P 1 21/n 1 | 8.4766; 15.6816; 28.099 90; 95.655; 90 | 3716.9 | Karak, Pirudhan; Choudhury, Joyanta Conformationally flexible heterohelicenes as stimuli-controlled soft molecular springs Chemical Science, 2022, 13, 11163-11173 |
| 1567619 | CIF | C57 H49 Cl4 N5 | P 1 21/n 1 | 17.0926; 16.467; 17.5046 90; 113.674; 90 | 4512.3 | Karak, Pirudhan; Choudhury, Joyanta Conformationally flexible heterohelicenes as stimuli-controlled soft molecular springs Chemical Science, 2022, 13, 11163-11173 |
| 1567620 | CIF | C59 H55 Cl6 I2 N5 Rh2 | C 1 2/c 1 | 15.6999; 18.4945; 20.4988 90; 91.779; 90 | 5949.2 | Karak, Pirudhan; Choudhury, Joyanta Conformationally flexible heterohelicenes as stimuli-controlled soft molecular springs Chemical Science, 2022, 13, 11163-11173 |
| 1567621 | CIF | C57 H55 Cl2 F6 N5 O6 S2 | P 1 21/c 1 | 16.175; 18.4493; 18.016 90; 102.497; 90 | 5248.9 | Karak, Pirudhan; Choudhury, Joyanta Conformationally flexible heterohelicenes as stimuli-controlled soft molecular springs Chemical Science, 2022, 13, 11163-11173 |
| 1567622 | CIF | C18 H21 N O6 | P -1 | 8.1602; 10.1021; 11.5212 88.2151; 69.4794; 72.0806 | 843.2 | Koo, Bonwoo; Kim, Dopil; Song, Da Yong; Han, Woo Joo; Kim, Dongwook; Park, Jae Woo; Kim, Min; Kim, Cheoljae The formation of photodegradable nitrophenylene polymers via ring-opening metathesis polymerization Polymer Chemistry, 2022, 13, 6268-6273 |
| 1567623 | CIF | C16 H17 N O6 | P 1 21/c 1 | 12.998; 7.7936; 15.3862 90; 106.506; 90 | 1494.41 | Koo, Bonwoo; Kim, Dopil; Song, Da Yong; Han, Woo Joo; Kim, Dongwook; Park, Jae Woo; Kim, Min; Kim, Cheoljae The formation of photodegradable nitrophenylene polymers via ring-opening metathesis polymerization Polymer Chemistry, 2022, 13, 6268-6273 |
| 1567624 | CIF | C18 H21 N O6 | C 1 c 1 | 5.03; 20.5537; 16.8829 90; 97.379; 90 | 1730.99 | Koo, Bonwoo; Kim, Dopil; Song, Da Yong; Han, Woo Joo; Kim, Dongwook; Park, Jae Woo; Kim, Min; Kim, Cheoljae The formation of photodegradable nitrophenylene polymers via ring-opening metathesis polymerization Polymer Chemistry, 2022, 13, 6268-6273 |
| 1567625 | CIF | C18 H21 N O6 | P 1 21/c 1 | 17.15; 9.733; 10.702 90; 106.541; 90 | 1712.5 | Koo, Bonwoo; Kim, Dopil; Song, Da Yong; Han, Woo Joo; Kim, Dongwook; Park, Jae Woo; Kim, Min; Kim, Cheoljae The formation of photodegradable nitrophenylene polymers via ring-opening metathesis polymerization Polymer Chemistry, 2022, 13, 6268-6273 |
| 1567626 | CIF | C16 H17 N O6 | P 1 21/c 1 | 8.1387; 24.2934; 8.5069 90; 117.414; 90 | 1493.08 | Koo, Bonwoo; Kim, Dopil; Song, Da Yong; Han, Woo Joo; Kim, Dongwook; Park, Jae Woo; Kim, Min; Kim, Cheoljae The formation of photodegradable nitrophenylene polymers via ring-opening metathesis polymerization Polymer Chemistry, 2022, 13, 6268-6273 |
| 1567627 | CIF | C16 H17 N O6 | P 1 21/n 1 | 7.8712; 16.4752; 11.757 90; 91.5968; 90 | 1524.05 | Koo, Bonwoo; Kim, Dopil; Song, Da Yong; Han, Woo Joo; Kim, Dongwook; Park, Jae Woo; Kim, Min; Kim, Cheoljae The formation of photodegradable nitrophenylene polymers via ring-opening metathesis polymerization Polymer Chemistry, 2022, 13, 6268-6273 |
| 1567630 | CIF | C22 H13 F2 N O | C 1 2/c 1 | 24.1916; 9.9649; 14.5436 90; 112.784; 90 | 3232.4 | Wang, Gang; Li, Wenqi; Liu, Tianxiang; Zhang, Yonghong; Wang, Bin; Xue, Fei; Jin, Weiwei; Ma, Caiyan; Xia, Yu; Liu, Chenjiang Palladium-catalyzed intramolecular Heck dearomative <i>gem</i>-difluorovinylation of indoles. Chemical science, 2022, 13, 11594-11599 |
| 1567631 | CIF | C17 H11 F2 N O | P 1 21/n 1 | 13.16; 7.282; 14.2 90; 99.631; 90 | 1341.6 | Wang, Gang; Li, Wenqi; Liu, Tianxiang; Zhang, Yonghong; Wang, Bin; Xue, Fei; Jin, Weiwei; Ma, Caiyan; Xia, Yu; Liu, Chenjiang Palladium-catalyzed intramolecular Heck dearomative <i>gem</i>-difluorovinylation of indoles. Chemical science, 2022, 13, 11594-11599 |
| 1567632 | CIF | C25 H30 N2 O2 | P -4 21 c | 20.192; 20.192; 11.043 90; 90; 90 | 4502.4 | Wang, Gang; Li, Wenqi; Liu, Tianxiang; Zhang, Yonghong; Wang, Bin; Xue, Fei; Jin, Weiwei; Ma, Caiyan; Xia, Yu; Liu, Chenjiang Palladium-catalyzed intramolecular Heck dearomative <i>gem</i>-difluorovinylation of indoles. Chemical science, 2022, 13, 11594-11599 |
| 1567633 | CIF | C96 H85 N3 O4 S2 | P 1 21/c 1 | 20.891; 8.271; 44.433 90; 102.813; 90 | 7486 | Zhu, Jiangyu; Li, Wenhao; Zhang, Ning; An, Dongyue; Zhao, Yan; Lu, Xuefeng; Liu, Yunqi Size-dependent properties and unusual reactivity of novel nonplanar heterocycloarenes Chemical Science, 2022, 13, 11174-11182 |
| 1567634 | CIF | C80 H48 Cl6 N2 O8 S2 | P -1 | 12.745; 14.782; 19.522 82.434; 83.954; 80.211 | 3579.8 | Zhu, Jiangyu; Li, Wenhao; Zhang, Ning; An, Dongyue; Zhao, Yan; Lu, Xuefeng; Liu, Yunqi Size-dependent properties and unusual reactivity of novel nonplanar heterocycloarenes Chemical Science, 2022, 13, 11174-11182 |
| 1567637 | CIF | C20 H27 N O2 | P 1 21/c 1 | 6.3182; 39.6141; 7.7124 90; 111.769; 90 | 1792.68 | Cooper, Phillippa; Dalling, Andrew G.; Farrar, Elliot H. E.; Aldhous, Timothy P.; Grélaud, Simon; Lester, Eleanor; Feron, Lyman J.; Kemmitt, Paul D.; Grayson, Matthew N.; Bower, John F. Atom and step economical synthesis of acyclic quaternary centers via iridium-catalyzed hydroarylative cross-coupling of 1,1-disubstituted alkenes Chemical Science, 2022, 13, 11183-11189 |
| 1567641 | CIF | C21 H29 Br O4 | P -1 | 6.36017; 7.8529; 20.1551 91.523; 91.016; 93.88 | 1003.81 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567642 | CIF | C21 H29 Br O4 | P b c a | 10.6941; 8.218; 46.3766 90; 90; 90 | 4075.8 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567643 | CIF | C21 H29 Br O4 | P -1 | 6.41587; 12.0405; 13.3039 94.139; 91.6023; 101.288 | 1004.29 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567644 | CIF | C14 H26 O3 | P 1 21/n 1 | 5.8614; 15.5412; 14.8746 90; 90.764; 90 | 1354.85 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567645 | CIF | C21 H29 Br O4 | P 1 21/c 1 | 14.0432; 7.0309; 21.1186 90; 100.447; 90 | 2050.61 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567646 | CIF | C35 H38 O4 | P -1 | 6.28197; 12.2599; 19.1503 89.562; 87.114; 78.209 | 1441.93 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567647 | CIF | C21 H29 Br O4 | P -1 | 7.44418; 11.53654; 12.84945 69.1422; 81.678; 84.3027 | 1018.98 | Chen, Hao; Li, Tian-Ren; Sakai, Naomi; Besnard, Celine; Guénée, Laure; Pupier, Marion; Viger-Gravel, Jasmine; Tiefenbacher, Konrad; Matile, Stefan Decoded fingerprints of hyperresponsive, expanding product space: polyether cascade cyclizations as tools to elucidate supramolecular catalysis Chemical Science, 2022, 13, 10273-10280 |
| 1567648 | CIF | C25 H25 N O3 | P 1 21 1 | 10.5777; 41.8595; 10.6059 90; 115.198; 90 | 4249.18 | Guo, Wengang; Jiang, Feng; Li, Shijia; Sun, Jianwei Organocatalytic asymmetric azidation of sulfoxonium ylides: mild synthesis of enantioenriched α-azido ketones bearing a labile tertiary stereocenter. Chemical science, 2022, 13, 11648-11655 |
| 1567649 | CIF | C24 H48 Cl2 Cr2 Si4 | P 1 21/c 1 | 13.2426; 7.9314; 15.6465 90; 101.402; 90 | 1610.96 | Trummer, David; Nobile, Anna Giorgia; Payard, Pierre-Adrien; Ashuiev, Anton; Kakiuchi, Yuya; Klose, Daniel; Jeschke, Gunnar; Copéret, Christophe Union carbide polymerization catalysts: from uncovering active site structures to designing molecularly-defined analogs Chemical Science, 2022, 13, 11091-11098 |
| 1567650 | CIF | C26 H36 Cr | P 1 21/n 1 | 9.3657; 16.7589; 14.5402 90; 105.649; 90 | 2197.6 | Trummer, David; Nobile, Anna Giorgia; Payard, Pierre-Adrien; Ashuiev, Anton; Kakiuchi, Yuya; Klose, Daniel; Jeschke, Gunnar; Copéret, Christophe Union carbide polymerization catalysts: from uncovering active site structures to designing molecularly-defined analogs Chemical Science, 2022, 13, 11091-11098 |
| 1567652 | CIF | C29.5 H31 Cl N2 | I 1 2/a 1 | 22.0567; 7.5133; 32.5379 90; 109.612; 90 | 5079.32 | Cui, Xian-Chao; Zhang, Hu; Wang, Yi-Ping; Qu, Jian-Ping; Kang, Yan-Biao Synthesis of carbinoxamine via α-C(sp3)–H 2-pyridylation of O, S or N-containing compounds enabled by non-D–A-type super organoreductants and sulfoxide- or sulfide HAT reagents Chemical Science, 2022, 13, 11246-11251 |
| 1567653 | CIF | C27 H26 N2 O | P -1 | 7.8864; 9.9577; 15.3148 75.304; 85.678; 67.535 | 1074.74 | Cui, Xian-Chao; Zhang, Hu; Wang, Yi-Ping; Qu, Jian-Ping; Kang, Yan-Biao Synthesis of carbinoxamine via α-C(sp3)–H 2-pyridylation of O, S or N-containing compounds enabled by non-D–A-type super organoreductants and sulfoxide- or sulfide HAT reagents Chemical Science, 2022, 13, 11246-11251 |
| 1567654 | CIF | C21 H16 Cl N | P 1 21/n 1 | 10.7317; 5.511; 27.4878 90; 99.361; 90 | 1604.05 | Li, Quanzhe; Gu, Xintao; Wei, Yin; Shi, Min Visible-light-induced indole synthesis <i>via</i> intramolecular C-N bond formation: desulfonylative C(sp<sup>2</sup>)-H functionalization. Chemical science, 2022, 13, 11623-11632 |
| 1567655 | CIF | C24 H28 Br4 N4 O4 | I 1 2/a 1 | 20.6359; 5.1809; 27.7349 90; 104.528; 90 | 2870.4 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567656 | CIF | C18 H14 I4 N2 O4 | P 1 21/c 1 | 14.0017; 8.2362; 19.1456 90; 104.636; 90 | 2136.24 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567657 | CIF | C14 H8 I4 N8 | P -1 | 11.9316; 12.2715; 15.2444 73.159; 73.857; 79.026 | 2037.41 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567658 | CIF | C26 H34 N2 O4 S4 | P -1 | 7.2152; 8.0923; 12.5451 87.957; 82.964; 66.841 | 668.32 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567659 | CIF | C24 H30 F2 N4 O4 | P -1 | 10.1072; 11.4012; 11.5402 94.868; 95.841; 112.726 | 1208.99 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567660 | CIF | C16 H18 N2 Se4 | P 1 2/n 1 | 15.5783; 7.9499; 29.5587 90; 90.3204; 90 | 3660.67 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567661 | CIF | C22 H26 N2 O4 Se4 | P b c n | 16.0349; 15.8463; 19.0464 90; 90; 90 | 4839.57 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567662 | CIF | C16 H18 N2 S4 | P 1 2/n 1 | 15.105; 7.8801; 28.9196 90; 90.6804; 90 | 3442.03 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567663 | CIF | C14 H12 F2 N2 Te2 | P 1 21/n 1 | 6.4567; 8.6728; 13.3795 90; 92.32; 90 | 748.61 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567664 | CIF | C16 H18 N2 Te4 | P 1 21 1 | 10.7335; 10.5743; 18.0208 90; 95.2723; 90 | 2036.69 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567665 | CIF | C34 H44 Br0 N4 O4 | P -1 | 4.7183; 12.508; 13.014 78.569; 86.876; 82.105 | 745.4 | Bansal, Deepak; Kundu, Arup; Singh, Vijay Pal; Pal, Arun K.; Datta, Ayan; Dasgupta, Jyotishman; Mukhopadhyay, Pritam A highly contorted push-pull naphthalenediimide dimer and evidence of intramolecular singlet exciton fission. Chemical science, 2022, 13, 11506-11512 |
| 1567666 | CIF | C56 H64 N8 O8 | P 43 21 2 | 14.7104; 14.7104; 23.995 90; 90; 90 | 5192.4 | Bansal, Deepak; Kundu, Arup; Singh, Vijay Pal; Pal, Arun K.; Datta, Ayan; Dasgupta, Jyotishman; Mukhopadhyay, Pritam A highly contorted push-pull naphthalenediimide dimer and evidence of intramolecular singlet exciton fission. Chemical science, 2022, 13, 11506-11512 |
| 1567667 | CIF | Cd S4 Si Sr | A m a 2 | 10.2821; 10.1551; 6.3699 90; 90; 90 | 665.12 | Yang, He-Di; Ran, Mao-Yin; Zhou, Sheng-Hua; Wu, Xin-Tao; Lin, Hua; Zhu, Qi-Long Rational design via dual-site aliovalent substitution leads to an outstanding IR nonlinear optical material with well-balanced comprehensive properties Chemical Science, 2022, 13, 10725-10733 |
| 1567668 | CIF | Ga2 S4 Sr | F d d d :2 | 12.2216; 20.5008; 20.8426 90; 90; 90 | 5222.2 | Yang, He-Di; Ran, Mao-Yin; Zhou, Sheng-Hua; Wu, Xin-Tao; Lin, Hua; Zhu, Qi-Long Rational design via dual-site aliovalent substitution leads to an outstanding IR nonlinear optical material with well-balanced comprehensive properties Chemical Science, 2022, 13, 10725-10733 |
| 1567671 | CIF | C19 H17 N O3 | P 1 21/n 1 | 8.9115; 18.9555; 9.6086 90; 104.43; 90 | 1571.9 | Tavernier, Romain; Granado, Lérys; Tillard, Monique; Van Renterghem, Louis; Métro, Thomas-Xavier; Lamaty, Frédéric; Bonnaud, Leïla; Raquez, Jean-Marie; David, Ghislain; Caillol, Sylvain Solvent-free synthesis of a formaldehyde-free benzoxazine monomer: study of its curing acceleration effect for commercial benzoxazine Polymer Chemistry, 2022, 13, 5745-5756 |
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