Crystallography Open Database
Search results
Result: there are 1634 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Chemical Science' volume of publication is 14
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1570347 | CIF | C28 H44 Cl2 Ga N5 | P 1 21/n 1 | 12.1606; 15.186; 16.3042 90; 90.497; 90 | 3010.8 | Parsons, Leo W. T.; Fettinger, James C.; Berben, Louise A. Group 13 ion coordination to pyridyl breaks the reduction potential <i>vs.</i> hydricity scaling relationship for dihydropyridinates. Chemical science, 2023, 14, 13944-13950 |
| 1570348 | CIF | C25 H38 Cl2 Ga N5 | P 1 21/c 1 | 13.1613; 13.2286; 15.7223 90; 93.54; 90 | 2732.1 | Parsons, Leo W. T.; Fettinger, James C.; Berben, Louise A. Group 13 ion coordination to pyridyl breaks the reduction potential <i>vs.</i> hydricity scaling relationship for dihydropyridinates. Chemical science, 2023, 14, 13944-13950 |
| 1570350 | CIF | C32 H52 Cl2 N8 Ni2 O9 | P 1 21/n 1 | 10.2398; 15.3856; 12.1399 90; 102.111; 90 | 1870.02 | Guo, Xin; Zhang, Lei; Hu, Jiesheng; Szilágyi, Balázs; Yu, Meng; Chen, Shizhen; Tircsó, Gyula; Zhou, Xin; Tao, Jun Improving the potential of paraCEST through magnetic-coupling induced line sharpening. Chemical science, 2023, 14, 14157-14165 |
| 1570351 | CIF | C38 H62 N8 Ni2 O13 | C 1 2/c 1 | 15.3815; 18.3733; 16.725 90; 111.493; 90 | 4398 | Guo, Xin; Zhang, Lei; Hu, Jiesheng; Szilágyi, Balázs; Yu, Meng; Chen, Shizhen; Tircsó, Gyula; Zhou, Xin; Tao, Jun Improving the potential of paraCEST through magnetic-coupling induced line sharpening. Chemical science, 2023, 14, 14157-14165 |
| 1570352 | CIF | C33 H48 Br Ga N8 Ni O7 | C 1 2/c 1 | 29.4737; 14.7532; 20.5922 90; 103.741; 90 | 8697.9 | Guo, Xin; Zhang, Lei; Hu, Jiesheng; Szilágyi, Balázs; Yu, Meng; Chen, Shizhen; Tircsó, Gyula; Zhou, Xin; Tao, Jun Improving the potential of paraCEST through magnetic-coupling induced line sharpening. Chemical science, 2023, 14, 14157-14165 |
| 1570353 | CIF | C82 H48 B2 F24 N2 P4 W | P 1 21/n 1 | 13.6255; 28.1927; 22.8261 90; 101.761; 90 | 8584.3 | Specklin, David; Boegli, Marie-Christine; Coffinet, Anaïs; Escomel, Léon; Vendier, Laure; Grellier, Mary; Simonneau, Antoine An orbitally adapted push-pull template for N<sub>2</sub> activation and reduction to diazene-diide. Chemical science, 2023, 14, 14262-14270 |
| 1570354 | CIF | C60 H59 B2 F24 N4 P4 W | P 1 21/n 1 | 12.833; 24.785; 19.899 90; 91.015; 90 | 6328 | Specklin, David; Boegli, Marie-Christine; Coffinet, Anaïs; Escomel, Léon; Vendier, Laure; Grellier, Mary; Simonneau, Antoine An orbitally adapted push-pull template for N<sub>2</sub> activation and reduction to diazene-diide. Chemical science, 2023, 14, 14262-14270 |
| 1570355 | CIF | C54 H51 B2 F27 N5 O P4 W | P 1 21/n 1 | 15.1504; 23.4318; 19.2226 90; 93.953; 90 | 6807.8 | Specklin, David; Boegli, Marie-Christine; Coffinet, Anaïs; Escomel, Léon; Vendier, Laure; Grellier, Mary; Simonneau, Antoine An orbitally adapted push-pull template for N<sub>2</sub> activation and reduction to diazene-diide. Chemical science, 2023, 14, 14262-14270 |
| 1570356 | CIF | C38 H50 B F15 N2 P4 W | P 1 21/c 1 | 10.9692; 20.0639; 20.4791 90; 101.51; 90 | 4416.5 | Specklin, David; Boegli, Marie-Christine; Coffinet, Anaïs; Escomel, Léon; Vendier, Laure; Grellier, Mary; Simonneau, Antoine An orbitally adapted push-pull template for N<sub>2</sub> activation and reduction to diazene-diide. Chemical science, 2023, 14, 14262-14270 |
| 1570357 | CIF | C50 H50 B2 F24 N2 P4 W | P 1 21/c 1 | 20.1462; 11.8225; 22.9963 90; 92.163; 90 | 5473.3 | Specklin, David; Boegli, Marie-Christine; Coffinet, Anaïs; Escomel, Léon; Vendier, Laure; Grellier, Mary; Simonneau, Antoine An orbitally adapted push-pull template for N<sub>2</sub> activation and reduction to diazene-diide. Chemical science, 2023, 14, 14262-14270 |
| 1570358 | CIF | C19 H22 F3 N O4 | P 21 21 21 | 9.15002; 14.0725; 14.39225 90; 90; 90 | 1853.2 | Yuan, Ding; Goodfellow, Alister S.; Kasten, Kevin; Duan, Zhuan; Kang, Tengfei; Cordes, David B.; McKay, Aidan P.; Bühl, Michael; Boyce, Gregory R.; Smith, Andrew D. Understanding divergent substrate stereoselectivity in the isothiourea-catalysed conjugate addition of cyclic α-substituted β-ketoesters to α,β-unsaturated aryl esters. Chemical science, 2023, 14, 14146-14156 |
| 1570359 | CIF | C23 H21 Cl F2 N2 O5 | P 21 21 21 | 9.32874; 14.9932; 16.18409 90; 90; 90 | 2263.63 | Yuan, Ding; Goodfellow, Alister S.; Kasten, Kevin; Duan, Zhuan; Kang, Tengfei; Cordes, David B.; McKay, Aidan P.; Bühl, Michael; Boyce, Gregory R.; Smith, Andrew D. Understanding divergent substrate stereoselectivity in the isothiourea-catalysed conjugate addition of cyclic α-substituted β-ketoesters to α,β-unsaturated aryl esters. Chemical science, 2023, 14, 14146-14156 |
| 1570360 | CIF | C23 H22 F3 N O4 | P 21 21 21 | 9.9425; 18.8834; 22.242 90; 90; 90 | 4175.9 | Yuan, Ding; Goodfellow, Alister S.; Kasten, Kevin; Duan, Zhuan; Kang, Tengfei; Cordes, David B.; McKay, Aidan P.; Bühl, Michael; Boyce, Gregory R.; Smith, Andrew D. Understanding divergent substrate stereoselectivity in the isothiourea-catalysed conjugate addition of cyclic α-substituted β-ketoesters to α,β-unsaturated aryl esters. Chemical science, 2023, 14, 14146-14156 |
| 1570361 | CIF | C52 H36 F6 N4 O Pt2 S | P 1 21/c 1 | 8.8576; 32.2146; 31.0202 90; 92.363; 90 | 8843.9 | Hashimoto, Yoshihisa; Katagiri, Yuri; Tanaka, Yuya; Yoshizawa, Michito Solution-state mechanochromic luminescence of Pt(ii)-complexes displayed within micellar aromatic capsules. Chemical science, 2023, 14, 14211-14216 |
| 1570370 | CIF | C32 H53 B O2 Sn | P 1 21 1 | 10.8925; 19.7704; 15.6033 90; 109.867; 90 | 3160.17 | Binayeva, Meruyert; Ma, Xinghua; Ghaemimohammadi, Pejman; Biscoe, Mark R. A general approach to stereospecific Pd-catalyzed cross-coupling reactions of benzylic stereocenters. Chemical science, 2023, 14, 14124-14130 |
| 1570371 | CIF | C16 H18 Mn N8 O6 S2 | A 1 n 1 | 14.3651; 14.91024; 13.24655 90; 117.406; 90 | 2518.81 | Lupa-Myszkowska, Magdalena; Oszajca, Marcin; Matoga, Dariusz From non-conductive MOF to proton-conducting metal-HOFs: a new class of reversible transformations induced by solvent-free mechanochemistry. Chemical science, 2023, 14, 14176-14181 |
| 1570372 | CIF | C16 H20 Mn N6 O6 S2 | P 1 21/c 1 | 10.4862; 15.4994; 7.56251 90; 98.534; 90 | 1215.52 | Lupa-Myszkowska, Magdalena; Oszajca, Marcin; Matoga, Dariusz From non-conductive MOF to proton-conducting metal-HOFs: a new class of reversible transformations induced by solvent-free mechanochemistry. Chemical science, 2023, 14, 14176-14181 |
| 1570374 | CIF | C5 H6.16 Cl2.84 I N2 O2 | P -1 | 7.5387; 8.2803; 8.4979 83.344; 89.699; 70.311 | 495.76 | Chen, Qian-Qian; Hu, Chun-Li; Zhang, Ming-Zhi; Mao, Jiang-Gao (C<sub>5</sub>H<sub>6.16</sub>N<sub>2</sub>Cl<sub>0.84</sub>)(IO<sub>2</sub>Cl<sub>2</sub>): a birefringent crystal featuring unprecedented (IO<sub>2</sub>Cl<sub>2</sub>)<sup>-</sup> anions and π-conjugated organic cations. Chemical science, 2023, 14, 14302-14307 |
| 1570376 | CIF | C26 H24 O3 | P 21 21 21 | 7.9089; 15.0721; 17.4446 90; 90; 90 | 2079.46 | Zeng, Hongkun; Wang, Lifeng; Su, Zhishan; Ying, Meijia; Lin, Lili; Feng, Xiaoming Chiral cobalt(ii) complex-promoted asymmetric <i>para</i>-Claisen rearrangement of allyl α-naphthol ethers. Chemical science, 2023, 14, 13979-13985 |
| 1570377 | CIF | C31 H26 O3 | P 21 21 21 | 7.8307; 15.5594; 21.1844 90; 90; 90 | 2581.13 | Zeng, Hongkun; Wang, Lifeng; Su, Zhishan; Ying, Meijia; Lin, Lili; Feng, Xiaoming Chiral cobalt(ii) complex-promoted asymmetric <i>para</i>-Claisen rearrangement of allyl α-naphthol ethers. Chemical science, 2023, 14, 13979-13985 |
| 1570385 | CIF | C39 H63 Cl N O P Pd | P 1 21/n 1 | 12.5212; 17.2596; 18.8102 90; 98.389; 90 | 4021.6 | Waddell, Peter M.; Tian, Lei; Scavuzzo, Anthony R.; Venigalla, Lalu; Scholes, Gregory D.; Carrow, Brad P. Visible light-induced palladium-carbon bond weakening in catalytically relevant T-shaped complexes. Chemical science, 2023, 14, 14217-14228 |
| 1570386 | CIF | C13 H30 Br P Pd | P -1 | 8.5537; 9.5525; 10.1463 91.5542; 91.4639; 94.101 | 826.31 | Waddell, Peter M.; Tian, Lei; Scavuzzo, Anthony R.; Venigalla, Lalu; Scholes, Gregory D.; Carrow, Brad P. Visible light-induced palladium-carbon bond weakening in catalytically relevant T-shaped complexes. Chemical science, 2023, 14, 14217-14228 |
| 1570387 | CIF | C16 H38 Cl P Pd Si | P 1 21/c 1 | 10.33; 15.1751; 14.0651 90; 110.126; 90 | 2070.2 | Waddell, Peter M.; Tian, Lei; Scavuzzo, Anthony R.; Venigalla, Lalu; Scholes, Gregory D.; Carrow, Brad P. Visible light-induced palladium-carbon bond weakening in catalytically relevant T-shaped complexes. Chemical science, 2023, 14, 14217-14228 |
| 1570388 | CIF | C31 H48 Cl P Pd | P -1 | 12.1765; 14.8521; 16.3152 86.928; 74.898; 77.45 | 2780.6 | Waddell, Peter M.; Tian, Lei; Scavuzzo, Anthony R.; Venigalla, Lalu; Scholes, Gregory D.; Carrow, Brad P. Visible light-induced palladium-carbon bond weakening in catalytically relevant T-shaped complexes. Chemical science, 2023, 14, 14217-14228 |
| 1570389 | CIF | C21 H45 Br N O P Pd | C 1 2/c 1 | 31.4611; 8.1772; 23.0772 90; 124.577; 90 | 4888.3 | Waddell, Peter M.; Tian, Lei; Scavuzzo, Anthony R.; Venigalla, Lalu; Scholes, Gregory D.; Carrow, Brad P. Visible light-induced palladium-carbon bond weakening in catalytically relevant T-shaped complexes. Chemical science, 2023, 14, 14217-14228 |
| 1570390 | CIF | C21 H45 Cl N O P Pd | P 1 21/c 1 | 14.7317; 12.1009; 14.8868 90; 115.664; 90 | 2392.03 | Waddell, Peter M.; Tian, Lei; Scavuzzo, Anthony R.; Venigalla, Lalu; Scholes, Gregory D.; Carrow, Brad P. Visible light-induced palladium-carbon bond weakening in catalytically relevant T-shaped complexes. Chemical science, 2023, 14, 14217-14228 |
| 1570454 | CIF | C184 H210 O39 Ti8 | C 1 2/c 1 | 39.32; 32.41; 37.78 90; 115.25; 90 | 43545 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570455 | CIF | C96 H118 Cl O16 Ti4 | I 4 2 2 | 38.021; 38.021; 19.702 90; 90; 90 | 28481 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570456 | CIF | C756 H896 Br8 O148 Ti32 | C 1 2/c 1 | 39.278; 32.838; 37.8 90; 115.147; 90 | 44134 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570457 | CIF | C376 H454 N8 Na4 O84 Ti16 | C 1 2/c 1 | 39.187; 33.088; 37.42 90; 115.189; 90 | 43906 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570458 | CIF | C360 H432 O74.81 Ti16 | C 1 2/c 1 | 38.634; 32.619; 37.291 90; 114.837; 90 | 42648 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570459 | CIF | C382 H479 N3 O80 Ti16 | C 1 2/c 1 | 37.993; 33.265; 37.218 90; 113.35; 90 | 43185 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570460 | CIF | C364 H502 Na4 O113 Ti16 | C 1 2/c 1 | 37.982; 33.195; 36.904 90; 113.349; 90 | 42719 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570461 | CIF | C396 H484 Cl2 N4 O68 Ti16 | C 1 2/c 1 | 53.303; 19.9467; 50.645 90; 121.288; 90 | 46016 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570462 | CIF | C380 H552 Cl4 O122 Ti16 | C 1 2/c 1 | 39.051; 32.81; 37.614 90; 115.05; 90 | 43660 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570463 | CIF | C390 H474 N2 O71 Ti16 | C 1 2/c 1 | 39.0491; 32.3507; 37.9914 90; 115.329; 90 | 43379 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570464 | CIF | C368 H428 N4 Na2 O70 Ti16 | C 1 2/c 1 | 38.447; 32.9077; 37.172 90; 114.933; 90 | 42647 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570465 | CIF | C382 H450 F12 N4 O72 Ti16 | C 1 2/c 1 | 54.372; 20.162; 50.494 90; 121.984; 90 | 46951 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570466 | CIF | C380 H456 O72 Ti16 | C 1 2/c 1 | 37.9325; 32.9482; 37.0574 90; 113.305; 90 | 42536 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570467 | CIF | C198 H235 Na O46 Ti8 | C 1 2/c 1 | 39.095; 33.277; 37.714 90; 114.888; 90 | 44508 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570468 | CIF | C396 H486 N2 O72 Ti16 | C 1 2/c 1 | 39.19; 32.5046; 38.1646 90; 115.461; 90 | 43894 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570469 | CIF | C372 H426 N2 O76 Ti16 | C 1 2/c 1 | 38.8238; 32.5568; 37.8922 90; 115.418; 90 | 43259 | Tian, Yi-Qi; Dai, Lin-Fang; Mu, Wen-Lei; Yu, Wei-Dong; Yan, Jun; Liu, Chao Atomically accurate site-specific ligand tailoring of highly acid- and alkali-resistant Ti(iv)-based metallamacrocycle for enhanced CO<sub>2</sub> photoreduction. Chemical science, 2023, 14, 14280-14289 |
| 1570651 | CIF | C56 H40 N6 O | P 1 21/c 1 | 13.956; 13.033; 23.58 90; 93.21; 90 | 4282.2 | Chatterjee, Abhijit; Chatterjee, Joy; Sappati, Subrahmanyam; Tanwar, Riteeka; Ambhore, Madan D.; Arfin, Habibul; Umesh, Rintu M.; Lahiri, Mayurika; Mandal, Pankaj; Hazra, Partha Engineering TADF, mechanochromism, and second harmonic up-conversion properties in regioisomeric substitution space. Chemical science, 2023, 14, 13832-13841 |
| 1570652 | CIF | C57 H42 Cl2 N6 | P 21 21 21 | 9.771; 21.156; 22.933 90; 90; 90 | 4741 | Chatterjee, Abhijit; Chatterjee, Joy; Sappati, Subrahmanyam; Tanwar, Riteeka; Ambhore, Madan D.; Arfin, Habibul; Umesh, Rintu M.; Lahiri, Mayurika; Mandal, Pankaj; Hazra, Partha Engineering TADF, mechanochromism, and second harmonic up-conversion properties in regioisomeric substitution space. Chemical science, 2023, 14, 13832-13841 |
| 1570653 | CIF | C58 H44 Cl4 N6 | P 1 21/c 1 | 12.415; 11.6613; 17.594 90; 109.655; 90 | 2398.8 | Chatterjee, Abhijit; Chatterjee, Joy; Sappati, Subrahmanyam; Tanwar, Riteeka; Ambhore, Madan D.; Arfin, Habibul; Umesh, Rintu M.; Lahiri, Mayurika; Mandal, Pankaj; Hazra, Partha Engineering TADF, mechanochromism, and second harmonic up-conversion properties in regioisomeric substitution space. Chemical science, 2023, 14, 13832-13841 |
| 1570654 | CIF | V | P m m m | 10; 2.7732; 1.51 90; 90; 90 | 41.875 | Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical science, 2023, 14, 12984-12994 |
| 1570655 | CIF | S | C 2 2 21 | 3.63202; 3.32551; 2.5554 90; 90; 90 | 30.865 | Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical science, 2023, 14, 12984-12994 |
| 1570656 | CIF | S | C 2 2 21 | 4.20442; 3.37278; 3.16417 90; 90; 90 | 44.87 | Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical science, 2023, 14, 12984-12994 |
| 1570657 | CIF | S | R 3 2 :H | 4.2493; 4.2493; 1.73409 90; 90; 120 | 27.117 | Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical science, 2023, 14, 12984-12994 |
| 1570658 | CIF | O4 S3 | P m m m | 5.2785; 5.2785; 5.2785 90; 90; 90 | 147.073 | Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical science, 2023, 14, 12984-12994 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!