Crystallography Open Database
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Searching year of publication is 2021
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1560807 | CIF | C20 H26 O5 | P 1 21 1 | 7.5625; 11.8123; 21.2504 90; 94.252; 90 | 1893.08 | Xue, Peng-Hui; Zhang, Nan; Liu, Da; Zhang, Qing-Ran; Duan, Jing-Shi; Yu, Ya-Qin; Li, Jin-Yan; Cao, Shi-Jie; Zhao, Feng; Kang, Ning; Qiu, Feng Cytotoxic and Anti-Inflammatory Sesquiterpenes from the Whole Plants of <i>Centipeda minima</i>. Journal of natural products, 2021, 84, 247-258 |
| 1560808 | CIF | C32 H28 N4 O4 | P 1 21/n 1 | 4.5196; 37.0928; 7.9294 90; 96.848; 90 | 1319.84 | Goodlett, Dustin W.; Sindt, Ammon J.; Hossain, Muhammad Saddam; Merugu, Rajkumar; Smith, Mark D.; Garashchuk, Sophya; Gudmundsdottir, Anna D.; Shimizu, Linda S. From Incident Light to Persistent and Regenerable Radicals of Urea-Assembled Benzophenone Frameworks: A Structural Investigation. The journal of physical chemistry. A, 2021, 125, 1336-1344 |
| 1560809 | CIF | C35 H36 Cl N5 O16 | P 1 21/c 1 | 21.1662; 7.2822; 23.8529 90; 95.675; 90 | 3658.58 | Devarapalli, Ramesh; Indukuri, Anjaneyaraju; Bollineni, Manjunath; Mondal, Amit; Reddy, C. Malla; Chennuru, Ramanaiah Investigation of Poor Solubility of a Salt-Cocrystal Hydrate: A Case Study of the Common-Ion Effect in Betrixaban, an Anticoagulant Drug. Molecular pharmaceutics, 2021, 18, 1138-1149 |
| 1560810 | CIF | C27 H26 Cl N5 O7 | P -1 | 10.2717; 14.008; 19.5347 73.184; 75.634; 89.646 | 2599.91 | Devarapalli, Ramesh; Indukuri, Anjaneyaraju; Bollineni, Manjunath; Mondal, Amit; Reddy, C. Malla; Chennuru, Ramanaiah Investigation of Poor Solubility of a Salt-Cocrystal Hydrate: A Case Study of the Common-Ion Effect in Betrixaban, an Anticoagulant Drug. Molecular pharmaceutics, 2021, 18, 1138-1149 |
| 1560811 | CIF | C39 H48 Cl2 N4 O4 S | P -1 | 10.9239; 13.7852; 14.6224 116.386; 91.271; 108.043 | 1842.2 | Gui, Yue; McCann, Erin C.; Yao, Xin; Li, Yuhui; Jones, Karen J.; Yu, Lian Amorphous Drug-Polymer Salt with High Stability under Tropical Conditions and Fast Dissolution: The Case of Clofazimine and Poly(acrylic acid). Molecular pharmaceutics, 2021, 18, 1364-1372 |
| 1560812 | CIF | C100 H160 B2 O8 | P 1 21/c 1 | 19.262; 12.5345; 21.0985 90; 110.846; 90 | 4760.6 | Congrave, Daniel G.; Drummond, Bluebell H.; Gray, Victor; Bond, Andrew D.; Rao, Akshay; Friend, Richard H.; Bronstein, Hugo Suppressing aggregation induced quenching in anthracene based conjugated polymers Polymer Chemistry, 2021, 12, 1830-1836 |
| 1560813 | CIF | C10 H18 N2 O | P 1 21/n 1 | 9.8352; 9.3209; 11.4836 90; 108.743; 90 | 996.91 | Wiesenfeldt, Mario P.; Moock, Daniel; Paul, Daniel; Glorius, Frank Enantioselective hydrogenation of annulated arenes: controlled formation of multiple stereocenters in adjacent rings Chemical Science, 2021, 12, 5611-5615 |
| 1560814 | CIF | C10 H20 Cl2 N2 O | P 1 21 1 | 8.3482; 6.0629; 13.2849 90; 106.642; 90 | 644.24 | Wiesenfeldt, Mario P.; Moock, Daniel; Paul, Daniel; Glorius, Frank Enantioselective hydrogenation of annulated arenes: controlled formation of multiple stereocenters in adjacent rings Chemical Science, 2021, 12, 5611-5615 |
| 1560815 | CIF | C33 H36 Br N O2 | P 1 21/n 1 | 10.8109; 10.3081; 25.2697 90; 98.2242; 90 | 2787.09 | MARFO-OWUSU, Emmanuel; THOMPSON, Amber L. The Crystal Structure of a Benzyltriethylammonium Bromide Complex with <i>rac</i>-1,1′-Binaphthalene-2,2′-diol: The Inclusion of an Arylammonium Salt by an Assembly of Binaphthol Groups X-ray Structure Analysis Online, 2021, 37, 7-8 |
| 1560816 | CIF | C41 H56 Br2 Mn2 N8 O12 | P n m a | 14.89; 20.903; 14.7765 90; 90; 90 | 4599.1 | MIKURIYA, Masahiro; ONO, Sayuri; KOYAMA, Yoshiki; MITSUHASHI, Ryoji; TSUBOI, Motohiro Crystal Structure of μ-Oxido-μ-phenolato-bridged Dinuclear Manganese(III) Complex of Schiff-base Ligand with Bromido Coordination X-ray Structure Analysis Online, 2021, 37, 9-11 |
| 1560837 | CIF | C62 H56 Co3 N8 O16 S6 | P 1 21/c 1 | 10.852; 25.406; 12.801 90; 109.74; 90 | 3321.9 | Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. 3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties. Molecules (Basel, Switzerland), 2021, 26, 1269 |
| 1560838 | CIF | C48 H58 Co3 N6 O20 S6 | P 1 21/c 1 | 11.96; 25.867; 11.461 90; 106.49; 90 | 3400 | Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. 3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties. Molecules (Basel, Switzerland), 2021, 26, 1269 |
| 1560839 | CIF | C52 H61 Co3 N8 O19.5 S6 | F d d d :2 | 11.746; 42.15; 51.849 90; 90; 90 | 25670 | Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. 3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties. Molecules (Basel, Switzerland), 2021, 26, 1269 |
| 1560840 | CIF | C37 H25 N O | P 1 21/n 1 | 16.7002; 8.989; 17.8237 90; 96.9476; 90 | 2656 | Zhang, He; Lin, Dong-Qing; Li, Bo; Liu, Hui-Fang; Wang, Sha-Sha; Wang, Yong-Xia; Sun, Ming-Li; Lin, Zong-Qiong; Yan, Yong; Yu, Meng-Na; Xie, Ling-Hai; Huang, Wei Organic Micro-/Nanocrystals of SFX-Based Attractor‒Repulsor Molecules with the Feature of Crystal-Induced Luminescence Enhancement The Journal of Physical Chemistry C, 2021, 125, 6249-6259 |
| 1560841 | CIF | C49 H34 N2 O | P -1 | 10.445; 11.048; 15.689 97.771; 96.286; 94.504 | 1775 | Zhang, He; Lin, Dong-Qing; Li, Bo; Liu, Hui-Fang; Wang, Sha-Sha; Wang, Yong-Xia; Sun, Ming-Li; Lin, Zong-Qiong; Yan, Yong; Yu, Meng-Na; Xie, Ling-Hai; Huang, Wei Organic Micro-/Nanocrystals of SFX-Based Attractor‒Repulsor Molecules with the Feature of Crystal-Induced Luminescence Enhancement The Journal of Physical Chemistry C, 2021, 125, 6249-6259 |
| 1560842 | CIF | C18 H24 O7 S | P 1 21 1 | 13.1341; 5.5371; 15.0402 90; 113.768; 90 | 1001.03 | Kammer, Lisa Marie; Badir, Shorouk O.; Hu, Ren-Ming; Molander, Gary A. Photoactive Electron Donor-Acceptor Complex Platform for Ni-Mediated C(sp3)‒C(sp2) Bond Formation Chemical Science, 2021 |
| 1560843 | CIF | C37 H39 Cl Ge N P Si | P -1 | 11; 12.1; 13.5 96; 93; 109 | 1682.5 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560844 | CIF | C43 H45 Br Ge N P Si | P -1 | 11.33; 13.51; 13.61 79.1; 86.7; 69.6 | 1917.3 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560845 | CIF | C31 H44 N P Si | C 1 2/c 1 | 35.733; 9.74; 17.97 90; 107.22; 90 | 5974 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560846 | CIF | C74 H78 Br6 Ge2 N2 Ni2 P2 Si2 | C 1 2/c 1 | 40.613; 9.87; 23.16 90; 101.59; 90 | 9094 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560847 | CIF | C48 H63 K N2 O2 P Si | P -1 | 11.28; 13.73; 15.61 84.3; 83.7; 72.9 | 2291 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560848 | CIF | C34 H46 Cl Ge N P Si | P 1 21/c 1 | 15.55; 19.91; 21.82 90; 95.6; 90 | 6723 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560849 | CIF | C73 H71 Ge N2 Ni P3 Si | P -1 | 12.18; 13.55; 20.86 75.1; 88.3; 70.4 | 3128.1 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560850 | CIF | C31 H43 Br Ge N P Si | P -1 | 11.11; 17.26; 18.29 65.1; 88.4; 85.3 | 3170.5 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560851 | CIF | C73 H69 Br Ge N Ni P3 Si | P -1 | 12.68; 15.53; 19.47 98.6; 92; 91.3 | 3787.1 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560852 | CIF | C71 H83 Cl Ge N Ni O P3 Si | P 1 21/c 1 | 17.37; 19.77; 19.41 90; 102.7; 90 | 6502 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560853 | CIF | C71 H84 Ge N Ni O2 P3 Si | P 1 21/c 1 | 17.43; 19.84; 19.41 90; 103.4; 90 | 6529 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560854 | CIF | C41 H44 Br2 Cl Ge N3 Ni P Si | P 1 21/c 1 | 20.25; 11.15; 18.55 90; 94.5; 90 | 4175.4 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560855 | CIF | C73 H69 Br0.19 Cl0.81 Ge N Ni P3 Si | P -1 | 12.16; 13.52; 20.8 75.4; 89; 70.9 | 3119.1 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560856 | CIF | C77 H80 Ge N Ni O2 P3 Si | P 1 21/c 1 | 17.68; 19.18; 20.65 90; 108.8; 90 | 6629 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560857 | CIF | C41 H49 Cl Ge N O P Si | P -1 | 11.25; 17.78; 20.52 88.3; 75.7; 73.3 | 3805.8 | Keil, Philip M.; Szilvási, Tibor; Hadlington, Terrance J. Reversible metathesis of ammonia in an acyclic germylene‒Ni0 complex Chemical Science, 2021, 12, 5582-5590 |
| 1560858 | CIF | C30 H17 Co3 N4 O14 | I m -3 m | 33.2828; 33.2828; 33.2828 90; 90; 90 | 36868.8 | Zhang, Lei; Li, Fangfang; You, Jianjun; Hua, Nengbin; Wang, Qianting; Si, Junhui; Chen, Wenzhe; Wang, Wenjing; Wu, Xiaoyuan; Yang, Wenbin; Yuan, Daqiang; Lu, Canzhong; Liu, Yanrong; Al-Enizi, Abdullah M; Nafady, Ayman; Ma, Shengqian A window-space-directed assembly strategy for the construction of supertetrahedron-based zeolitic mesoporous metal-organic frameworks with ultramicroporous apertures for selective gas adsorption. Chemical science, 2021, 12, 5767-5773 |
| 1560859 | CIF | C30 H17 N4 Ni3 O14 | I m -3 m | 32.9754; 32.9754; 32.9754 90; 90; 90 | 35856.7 | Zhang, Lei; Li, Fangfang; You, Jianjun; Hua, Nengbin; Wang, Qianting; Si, Junhui; Chen, Wenzhe; Wang, Wenjing; Wu, Xiaoyuan; Yang, Wenbin; Yuan, Daqiang; Lu, Canzhong; Liu, Yanrong; Al-Enizi, Abdullah M; Nafady, Ayman; Ma, Shengqian A window-space-directed assembly strategy for the construction of supertetrahedron-based zeolitic mesoporous metal-organic frameworks with ultramicroporous apertures for selective gas adsorption. Chemical science, 2021, 12, 5767-5773 |
| 1560860 | CIF | C30 H17 Co2 N4 O14 Ti | I m -3 m | 33.2244; 33.2244; 33.2244 90; 90; 90 | 36675.1 | Zhang, Lei; Li, Fangfang; You, Jianjun; Hua, Nengbin; Wang, Qianting; Si, Junhui; Chen, Wenzhe; Wang, Wenjing; Wu, Xiaoyuan; Yang, Wenbin; Yuan, Daqiang; Lu, Canzhong; Liu, Yanrong; Al-Enizi, Abdullah M; Nafady, Ayman; Ma, Shengqian A window-space-directed assembly strategy for the construction of supertetrahedron-based zeolitic mesoporous metal-organic frameworks with ultramicroporous apertures for selective gas adsorption. Chemical science, 2021, 12, 5767-5773 |
| 1560861 | CIF | C26 H32 N2 Ni O2 | P -1 | 6.4256; 7.7129; 11.9856 98.709; 101.8; 104.3 | 550.52 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
| 1560862 | CIF | C26 H32 Cu N2 O2 | P -1 | 6.4641; 7.7224; 11.9925 97.647; 101.861; 105.261 | 553.99 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
| 1560863 | CIF | C34 H36 N2 Ni O2 | P 1 21/n 1 | 6.0847; 10.5704; 20.8597 90; 97.882; 90 | 1328.97 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
| 1560864 | CIF | C34 H36 Cu N2 O2 | P 1 21/n 1 | 11.0325; 5.6889; 21.554 90; 99.41; 90 | 1334.59 | Shiryaev, Alexey A.; Burkhanova, Tatyana M.; Mitoraj, Mariusz P.; Kukulka, Mercedes; Sagan, Filip; Mahmoudi, Ghodrat; Babashkina, Maria G.; Bolte, Michael; Safin, Damir A. Supramolecular structures of NiII and CuII with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions IUCrJ, 2021, 8 |
| 1560944 | CIF | C40 H53 N O6 | P 1 21 1 | 10.8272; 9.0795; 19.3623 90; 103.029; 90 | 1854.42 | Zheng, Dan; Jiang, Jia-Ming; Chen, Si-Min; Wan, Shi-Jie; Ren, Han-Gui; Chen, Gan; Xu, Gang; Zhou, Hua; Zhang, Hong; Xu, Hong-Xi Structural Revision of Guttiferone F and 30-epi-Cambogin Journal of Natural Products, 2021 |
| 1560945 | CIF | C38 H50 O6 | P 1 21 1 | 14.5894; 11.1597; 20.4193 90; 93.628; 90 | 3317.87 | Zheng, Dan; Jiang, Jia-Ming; Chen, Si-Min; Wan, Shi-Jie; Ren, Han-Gui; Chen, Gan; Xu, Gang; Zhou, Hua; Zhang, Hong; Xu, Hong-Xi Structural Revision of Guttiferone F and 30-epi-Cambogin Journal of Natural Products, 2021 |
| 1560946 | CIF | C35 H40 O10 | P 21 21 21 | 11.3224; 17.2445; 17.924 90; 90; 90 | 3499.6 | Mu, Hongyan; Tang, Shuai; Zuo, Quan; Huang, Min; Zhao, Weimin Dihydro-β-agarofuran-Type Sesquiterpenoids from the Seeds of <i>Celastrus virens</i> and Their Multidrug Resistance Reversal Activity against the KB/VCR Cell Line. Journal of natural products, 2021, 84, 588-600 |
| 1560947 | CIF | C28 H25 Br O6 | P 21 21 21 | 9.6194; 15.911; 16.492 90; 90; 90 | 2524.2 | Xu, Chaoran; Qiao, Jianglin; Dong, Shunxi; Zhou, Yuqiao; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of dihydro-1,3-dioxepines by Rh(II)/Sm(III) relay catalytic three-component tandem [4+3]-cycloaddition Chemical Science, 2021 |
| 1560948 | CIF | C45 H70 F9 N4 O15 S3 Sm | P 1 21 1 | 10.8034; 13.3417; 21.6804 90; 91.981; 90 | 3123.1 | Xu, Chaoran; Qiao, Jianglin; Dong, Shunxi; Zhou, Yuqiao; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of dihydro-1,3-dioxepines by Rh(II)/Sm(III) relay catalytic three-component tandem [4+3]-cycloaddition Chemical Science, 2021 |
| 1560949 | CIF | C28 H26 O6 | R -3 :H | 34.7546; 34.7546; 9.9252 90; 90; 120 | 10382.3 | Xu, Chaoran; Qiao, Jianglin; Dong, Shunxi; Zhou, Yuqiao; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of dihydro-1,3-dioxepines by Rh(II)/Sm(III) relay catalytic three-component tandem [4+3]-cycloaddition Chemical Science, 2021 |
| 1560950 | CIF | C96 H152 F18 N8 O30 S6 Sm2 | P 1 21 1 | 11.2756; 18.6968; 36.0442 90; 91.416; 90 | 7596.4 | Xu, Chaoran; Qiao, Jianglin; Dong, Shunxi; Zhou, Yuqiao; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of dihydro-1,3-dioxepines by Rh(II)/Sm(III) relay catalytic three-component tandem [4+3]-cycloaddition Chemical Science, 2021 |
| 1560951 | CIF | C88 H136 F18 N8 O30 S6 Sm2 | P 1 21 1 | 13.6883; 20.9229; 21.4877 90; 103.98; 90 | 5971.8 | Xu, Chaoran; Qiao, Jianglin; Dong, Shunxi; Zhou, Yuqiao; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of dihydro-1,3-dioxepines by Rh(II)/Sm(III) relay catalytic three-component tandem [4+3]-cycloaddition Chemical Science, 2021 |
| 1560984 | CIF | C119 H109.1 N12 O23 | C 1 2 1 | 31.9058; 17.2344; 20.9913 90; 102.315; 90 | 11277 | Huang, Hsin-Hua; Song, Kyung Seob; Prescimone, Alessandro; Aster, Alexander; Cohen, Gabriel; Mannancherry, Rajesh; Vauthey, Eric; Coskun, Ali; Šolomek, Tomáš Porous shape-persistent rylene imine cages with tunable optoelectronic properties and delayed fluorescence Chemical Science, 2021, 12, 5275-5285 |
| 1560985 | CIF | C115.5 H108.1 N17 O23.2 | C 1 2 1 | 31.8864; 17.2148; 20.9689 90; 102.403; 90 | 11241.6 | Huang, Hsin-Hua; Song, Kyung Seob; Prescimone, Alessandro; Aster, Alexander; Cohen, Gabriel; Mannancherry, Rajesh; Vauthey, Eric; Coskun, Ali; Šolomek, Tomáš Porous shape-persistent rylene imine cages with tunable optoelectronic properties and delayed fluorescence Chemical Science, 2021, 12, 5275-5285 |
| 1560986 | CIF | C15 H29 N O3 | P 1 21/c 1 | 12.3834; 10.9459; 12.0235 90; 90.342; 90 | 1629.7 | Simlandy, Amit K.; Sardini, Stephen; Brown, M. Kevin Construction of Congested Csp3-Csp3 Bonds by a Formal Ni-Catalyzed Alkylboration Chemical Science, 2021 |
| 1560987 | CIF | C12 H24 Cl4 N10 O4 Pb | P 1 21/c 1 | 19.052; 7.75; 8.289 90; 93.016; 90 | 1222.2 | Lédée, Ferdinand; Audebert, Pierre; Trippé-Allard, Gaëlle; Galmiche, Laurent; Garrot, Damien; Marrot, Jérôme; Lauret, Jean-Sébastien; Deleporte, Emmanuelle; Katan, Claudine; Even, Jacky; Quarti, Claudio Tetrazine molecules as an efficient electronic diversion channel in 2D organic‒inorganic perovskites Materials Horizons, 2021, 8, 1547-1560 |
| 1561001 | CIF | C28 H24 N6 O9 | P 21 21 21 | 9.1686; 11.5792; 25.431 90; 90; 90 | 2699.9 | Saha, Monochura; Bandyopadhyay, Subhajit Stimuli Responsive Stable Radical Anion for Conductance Switching The Journal of Physical Chemistry C, 2021, 125, 6427-6432 |
| 1561002 | CIF | C48.1 H105.26 N4 O24.52 V6 | P 1 21/c 1 | 12.6947; 15.5293; 18.1049 90; 109.99; 90 | 3354.2 | Fertig, Alex A.; Rabbani, S. M. Gulam; Koch, Melissa D.; Brennessel, William W.; Miró, Pere; Matson, Ellen M. Physicochemical implications of surface alkylation of high-valent, Lindqvist-type polyoxovanadate-alkoxide clusters. Nanoscale, 2021, 13, 6162-6173 |
| 1561003 | CIF | C25 H51 N3 O23 V6 | P 1 21/n 1 | 13.8593; 17.3129; 17.6954 90; 100.618; 90 | 4173.22 | Fertig, Alex A.; Rabbani, S. M. Gulam; Koch, Melissa D.; Brennessel, William W.; Miró, Pere; Matson, Ellen M. Physicochemical implications of surface alkylation of high-valent, Lindqvist-type polyoxovanadate-alkoxide clusters. Nanoscale, 2021, 13, 6162-6173 |
| 1561004 | CIF | C27 H57 O19 P V6 | C 1 2/c 1 | 13.0905; 16.6569; 18.2558 90; 92.394; 90 | 3977.2 | Fertig, Alex A.; Rabbani, S. M. Gulam; Koch, Melissa D.; Brennessel, William W.; Miró, Pere; Matson, Ellen M. Physicochemical implications of surface alkylation of high-valent, Lindqvist-type polyoxovanadate-alkoxide clusters. Nanoscale, 2021, 13, 6162-6173 |
| 1561005 | CIF | C46 H99 N3 O19 V6 | P 1 21/n 1 | 18.13612; 16.90558; 19.59064 90; 100.831; 90 | 5899.52 | Fertig, Alex A.; Rabbani, S. M. Gulam; Koch, Melissa D.; Brennessel, William W.; Miró, Pere; Matson, Ellen M. Physicochemical implications of surface alkylation of high-valent, Lindqvist-type polyoxovanadate-alkoxide clusters. Nanoscale, 2021, 13, 6162-6173 |
| 1561006 | CIF | C14 H8 Co3 N2 O10 | C 1 2/c 1 | 19.6026; 9.2014; 11.0368 90; 99.434; 90 | 1963.8 | Iacomi, Paul; Lee, Ji Sun; Vanduyfhuys, Louis; Cho, Kyung Ho; Fertey, Pierre; Wieme, Jelle; Granier, Dominique; Maurin, Guillaume; Van Speybroeck, Veronique; Chang, Jong-San; Yot, Pascal G. Crystals springing into action: metal‒organic framework CUK-1 as a pressure-driven molecular spring Chemical Science, 2021, 12, 5682-5687 |
| 1561007 | CIF | C14 H8 Co3 N2 O10 | C 1 2/c 1 | 18.974; 11.0427; 10.9677 90; 100.796; 90 | 2257.3 | Iacomi, Paul; Lee, Ji Sun; Vanduyfhuys, Louis; Cho, Kyung Ho; Fertey, Pierre; Wieme, Jelle; Granier, Dominique; Maurin, Guillaume; Van Speybroeck, Veronique; Chang, Jong-San; Yot, Pascal G. Crystals springing into action: metal‒organic framework CUK-1 as a pressure-driven molecular spring Chemical Science, 2021, 12, 5682-5687 |
| 1561008 | CIF | C14 H8 Co3 N2 O10 | C 1 2/c 1 | 19.6011; 9.2018; 11.036 90; 99.435; 90 | 1963.6 | Iacomi, Paul; Lee, Ji Sun; Vanduyfhuys, Louis; Cho, Kyung Ho; Fertey, Pierre; Wieme, Jelle; Granier, Dominique; Maurin, Guillaume; Van Speybroeck, Veronique; Chang, Jong-San; Yot, Pascal G. Crystals springing into action: metal‒organic framework CUK-1 as a pressure-driven molecular spring Chemical Science, 2021, 12, 5682-5687 |
| 1561009 | CIF | C6 N3 O27 P6 Zn3 | P -1 | 7.4765; 14.1513; 15.0795 115.507; 99.363; 99.595 | 1369.63 | Ma, Nattapol; Kosasang, Soracha; Yoshida, Atsushi; Horike, Satoshi Proton-conductive coordination polymer glass for solid-state anhydrous proton batteries Chemical Science, 2021, 12, 5818-5824 |
| 1561024 | CIF | C33 H48 I2 N2 O7 Zn2 | P 1 21 1 | 10.3649; 17.385; 10.4787 90; 93.802; 90 | 1884.04 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561025 | CIF | C33 H48 Ca I2 N2 O7 Zn | P b c a | 13.906; 14.3422; 37.8508 90; 90; 90 | 7549.06 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561026 | CIF | C25 H32 Br Li Mg N2 O5 | P 1 21/c 1 | 12.3544; 10.9625; 19.5187 90; 90.048; 90 | 2643.52 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561027 | CIF | C63 H72 Mg3 N6 O12 | P n a 21 | 26.6385; 12.1506; 18.5863 90; 90; 90 | 6015.9 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561028 | CIF | C42 H48 Li4 N4 O8 | P 41 21 2 | 11.2287; 11.2287; 32.691 90; 90; 90 | 4121.8 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561029 | CIF | C25 H32 I Li N2 O5 Zn | P 1 21/c 1 | 12.2484; 11.1331; 19.8508 90; 91.174; 90 | 2706.34 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561030 | CIF | C42 H48 N4 O8 Zn2 | P 1 21/c 1 | 10.7086; 20.5174; 8.9876 90; 98.462; 90 | 1953.19 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561031 | CIF | C25 H30 Cd I2 Mg N4 O4 | P 1 21/c 1 | 10.7707; 17.2439; 19.6341 90; 90.981; 90 | 3646.1 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561032 | CIF | C33 H46 I2 N2 O7 Zn2 | P 1 21 1 | 10.3649; 17.385; 10.4787 90; 93.802; 90 | 1884.04 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561033 | CIF | C29 H40 Cd I2 N2 O6 Zn | P -1 | 10.1985; 10.9552; 15.6105 86.416; 87.592; 73.094 | 1664.95 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561034 | CIF | C33 H48 I N2 Na O7 Zn | P 1 21/c 1 | 21.0024; 10.5844; 15.9024 90; 91.002; 90 | 3534.53 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561035 | CIF | C37 H56 Br2 Mg2 N2 O8 | P 1 21/n 1 | 10.7118; 20.0019; 18.6537 90; 91.671; 90 | 3994.97 | Deacy, Arron C.; Durr, Christopher B.; Kerr, Ryan W. F.; Williams, Charlotte K. Heterodinuclear catalysts Zn(ii)/M and Mg(ii)/M, where M = Na(i), Ca(ii) or Cd(ii), for phthalic anhydride/cyclohexene oxide ring opening copolymerisation Catalysis Science & Technology, 2021, 11, 3109-3118 |
| 1561043 | CIF | C122 H74 B F24 N3 O2 Pd | P -1 | 17.8161; 17.9108; 19.3137 82.81; 78.691; 86.591 | 5992 | Zhang, Yuxing; Jian, Zhongbao Polar Additive Triggered Branching Switch and Block Polyolefin Topology in Living Ethylene Polymerization Macromolecules, 2021 |
| 1561044 | CIF | C44 H50 F2 N2 O6 S4 | P 21 21 21 | 9.7957; 14.9403; 30.1708 90; 90; 90 | 4415.5 | Karmakar, Ananta; Nimje, Roshan Y.; Silamkoti, Arundutt; Pitchai, Manivel; Basha, Mushkin; Singarayer, Christuraj; Ramasamy, Duraisamy; Babu, G. T. Venkatesh; Samikannu, Ramesh; Subramaniam, Srinath; Anjanappa, Prakash; Vetrichelvan, Muthalagu; Kumar, Hemantha; Dikundwar, Amol G.; Gupta, Anuradha; Gupta, Arun Kumar; Rampulla, Richard; Dhar, T. G. Murali; Mathur, Arvind Practical Synthesis of (3aR, 9bR)-8-Fluoro-7-(perfluoropropan-2-yl)-9b-(phenylsulfonyl)-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]indole: An Advanced Intermediate to Access the RORγt Inverse Agonist BMT-362265 Organic Process Research & Development, 2021 |
| 1561045 | CIF | C25 H23 N3 O2 | P -1 | 7.7539; 10.3038; 13.462 107.202; 98.294; 96.619 | 1002.39 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561046 | CIF | C25 H22 N2 O2 | P 1 21/c 1 | 9.5752; 12.0481; 17.8268 90; 101.373; 90 | 2016.17 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561047 | CIF | C44.5 H45 Cl N4 O6 | P -1 | 12.3351; 13.1435; 13.7758 93.491; 101.268; 116.875 | 1925.16 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561048 | CIF | C19 H17 N3 O | P 1 21/c 1 | 8.5899; 18.3551; 10.2741 90; 102.416; 90 | 1582.02 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561049 | CIF | C19 H20 N2 O | P -1 | 8.5841; 10.1481; 10.2458 112.745; 103.325; 99.118 | 769.88 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561050 | CIF | C25 H21 Br N2 O2 | P 21 21 21 | 9.8948; 10.3781; 20.5618 90; 90; 90 | 2111.5 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561051 | CIF | C22 H22.3 N2 O3.15 | P 1 21/c 1 | 20.9936; 10.3069; 17.309 90; 99.457; 90 | 3694.4 | Lynch-Colameta, Tessa; Greta, Sarah; Snyder, Scott A. Synthesis of Aza-Quaternary Centers via Pictet‒Spengler Reactions of Ketonitrones Chemical Science, 2021 |
| 1561085 | CIF | C27 H29 B O | P 1 c 1 | 16.902; 9.4331; 15.2863 90; 113.371; 90 | 2237.26 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561086 | CIF | C28 H32 B N | P 21 21 21 | 9.3999; 11.8608; 20.7807 90; 90; 90 | 2316.8 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561087 | CIF | C16 H10 B2 O2 | P 1 21/n 1 | 7.9871; 4.6704; 16.324 90; 101.395; 90 | 596.93 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561088 | CIF | C51 H58 B2 O3 | C 1 2/c 1 | 33.3265; 6.9745; 23.9282 90; 125.567; 90 | 4524.1 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561089 | CIF | C28 H32 B4 O6 | P 42/n :2 | 19.5614; 19.5614; 6.7125 90; 90; 90 | 2568.5 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561090 | CIF | C32.5 H34.5 B O | P -1 | 12.8766; 14.0599; 15.4098 96.874; 102.28; 90.643 | 2704.5 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561091 | CIF | C31 H30 B F3 O2 | C 1 2/c 1 | 35.674; 10.716; 29.67 90; 98.307; 90 | 11223.3 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561092 | CIF | C31 H28 Br F3 | P b c a | 19.2423; 10.9228; 26.3907 90; 90; 90 | 5546.8 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561093 | CIF | C37 H42 B F3 O2 | C 1 2/c 1 | 32.1592; 9.1287; 24.8768 90; 112.858; 90 | 6729.6 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561094 | CIF | C32 H34 B N | P 1 21/n 1 | 14.4318; 9.4346; 19.482 90; 91.219; 90 | 2652 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561095 | CIF | C48 H52 B2 O2 | P -1 | 8.5512; 11.0326; 12.6835 67.901; 89.033; 67.825 | 1015.7 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561096 | CIF | C27 H29 B O | P b c a | 23.7421; 21.8444; 8.6139 90; 90; 90 | 4467.4 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561097 | CIF | C22 H19 Br | P 1 21/c 1 | 26.944; 6.2564; 22.5176 90; 113.082; 90 | 3492 | Ouadoudi, Omar; Kaehler, Tanja; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias One tool to bring them all: Au-catalyzed synthesis of B,O- and B,N-doped PAHs from boronic and borinic acids Chemical Science, 2021, 12, 5898-5909 |
| 1561098 | CIF | C10 H17 Am N2 O11 | P 1 21/n 1 | 6.7963; 15.0543; 20.4812 90; 97.297; 90 | 2078.53 | Jones, Zachary R.; Livshits, Maksim Y.; White, Frankie D.; Dalodière, Elodie; Ferrier, Maryline G.; Lilley, Laura M.; Knope, Karah E.; Kozimor, Stosh A.; Mocko, Veronika; Scott, Brian L.; Stein, Benjamin W.; Wacker, Jennifer N.; Woen, David H. Advancing understanding of actinide(iii) (Ac, Am, Cm) aqueous complexation chemistry Chemical Science, 2021, 12, 5638-5654 |
| 1561099 | CIF | C10 H25 Cm N2 O11 | P 1 21/n 1 | 6.7801; 15.0056; 20.489 90; 97.24; 90 | 2067.92 | Jones, Zachary R.; Livshits, Maksim Y.; White, Frankie D.; Dalodière, Elodie; Ferrier, Maryline G.; Lilley, Laura M.; Knope, Karah E.; Kozimor, Stosh A.; Mocko, Veronika; Scott, Brian L.; Stein, Benjamin W.; Wacker, Jennifer N.; Woen, David H. Advancing understanding of actinide(iii) (Ac, Am, Cm) aqueous complexation chemistry Chemical Science, 2021, 12, 5638-5654 |
| 1561100 | CIF | C10 H17 Eu N2 O11 | P 1 21/n 1 | 6.7137; 14.8928; 20.2772 90; 97.157; 90 | 2011.6 | Jones, Zachary R.; Livshits, Maksim Y.; White, Frankie D.; Dalodière, Elodie; Ferrier, Maryline G.; Lilley, Laura M.; Knope, Karah E.; Kozimor, Stosh A.; Mocko, Veronika; Scott, Brian L.; Stein, Benjamin W.; Wacker, Jennifer N.; Woen, David H. Advancing understanding of actinide(iii) (Ac, Am, Cm) aqueous complexation chemistry Chemical Science, 2021, 12, 5638-5654 |
| 1561101 | CIF | C56 H46 N4 O8 | P 1 21/n 1 | 9.0183; 10.8486; 22.331 90; 92.992; 90 | 2181.8 | Gimeno, Ignacio; Urtizberea, Ainhoa; Román-Roche, Juan; Zueco, David; Camón, Agustín; Alonso, Pablo J.; Roubeau, Olivier; Luis, Fernando Broad-band spectroscopy of a vanadyl porphyrin: a model electronuclear spin qudit Chemical Science, 2021, 12, 5621-5630 |
| 1561102 | CIF | C56 H45 N4 O8.5 Ti0.5 | P 1 21/n 1 | 9.4036; 10.8957; 22.319 90; 90.524; 90 | 2286.7 | Gimeno, Ignacio; Urtizberea, Ainhoa; Román-Roche, Juan; Zueco, David; Camón, Agustín; Alonso, Pablo J.; Roubeau, Olivier; Luis, Fernando Broad-band spectroscopy of a vanadyl porphyrin: a model electronuclear spin qudit Chemical Science, 2021, 12, 5621-5630 |
| 1561103 | CIF | C56 H44 N4 O9 V | P 1 21/n 1 | 9.3937; 10.8559; 22.317 90; 93.508; 90 | 2271.6 | Gimeno, Ignacio; Urtizberea, Ainhoa; Román-Roche, Juan; Zueco, David; Camón, Agustín; Alonso, Pablo J.; Roubeau, Olivier; Luis, Fernando Broad-band spectroscopy of a vanadyl porphyrin: a model electronuclear spin qudit Chemical Science, 2021, 12, 5621-5630 |
| 1561104 | CIF | C40 H26 | P 1 21/n 1 | 8.1285; 22.6403; 14.3177 90; 90.586; 90 | 2634.77 | Baig, Noorullah; Shetty, Suchetha; Al-Mousawi, Saleh; Alameddine, Bassam Conjugated microporous polymers using a copper-catalyzed [4 + 2] cyclobenzannulation reaction: promising materials for iodine and dye adsorption Polymer Chemistry, 2021, 12, 2282-2292 |
| 1561105 | CIF | C60 H50 | P -1 | 12.906; 17.5583; 22.216 92.437; 94.87; 90.603 | 5011.1 | Baig, Noorullah; Shetty, Suchetha; Al-Mousawi, Saleh; Alameddine, Bassam Conjugated microporous polymers using a copper-catalyzed [4 + 2] cyclobenzannulation reaction: promising materials for iodine and dye adsorption Polymer Chemistry, 2021, 12, 2282-2292 |
| 1561127 | CIF | Na Ni O6 Pr W | P 1 21 1 | 5.4858; 5.4827; 7.81681 90; 90.123; 90 | 235.11 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561128 | CIF | Na Nd Ni O6 W | P 1 21 1 | 5.45987; 5.4814; 7.81308 90; 90.164; 90 | 233.827 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561129 | CIF | Gd Na Ni O6 W | P 1 21 1 | 5.37618; 5.48688; 7.78128 90; 90.2441; 90 | 229.534 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561130 | CIF | Na Ni O6 Sm W | P 1 21 1 | 5.41399; 5.47939; 7.7985 90; 90.2542; 90 | 231.343 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561131 | CIF | Na Ni O6 Tb W | P 1 21 1 | 5.35966; 5.48918; 7.77309 90; 90.2581; 90 | 228.683 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561132 | CIF | Eu Na Ni O6 W | P 1 21 1 | 5.39582; 5.48536; 7.79284 90; 90.2646; 90 | 230.65 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561133 | CIF | La Na Ni O6 W | P 1 21 1 | 5.5156; 5.5153; 7.83952 90; 90.137; 90 | 238.48 | P N, Ravi Shankar; Orlandi, Fabio; Manuel, Pascal; Zhang, Weiguo; Halaysyamani, P. Shiv; Sundaresan, A. Structural, Magnetic, and Electrical Properties of Doubly Ordered Perovskites NaLnNiWO6 (Ln = La, Pr, Nd, Sm, Eu, Gd, and Tb) The Journal of Physical Chemistry C, 2021, 125, 6749-6757 |
| 1561134 | CIF | C20 H21 I N2 O3 | P 1 21 1 | 13.465; 9.554; 15.7286 90; 93.8204; 90 | 2018.9 | su, guanglong; Thompson, Connor J.; Yamazaki, Ken; Rozsar, Daniel; Christensen, Kirsten; Hamlin, Trevor A.; Dixon, Darren A Bifunctional Iminophosphorane Squaramide Catalyzed Enantioselective Synthesis of Hydroquinazolines via Intramolecular Aza-Michael Reaction to α,β-Unsaturated Esters Chemical Science, 2021 |
| 1561172 | CIF | C38 H25 N1.75 O2 S | P -1 | 9.341; 11.8743; 14.2 103.803; 92; 108.233 | 1442.47 | Shankar, Majji; Saha, Arijit; Sau, Somratan; Ghosh, Arghadip; Gandon, Vincent; Sahoo, Akhila Kumar Harnessing Sulfur and Nitrogen in the Cobalt (III)-Catalyzed Unsymmetrical Double Annulation of Thioamides: Probing the Origin of Chemo- and Regioselectivity Chemical Science, 2021 |
| 1561173 | CIF | C36 H25 N O S | P 1 21/c 1 | 13.577; 9.7186; 21.3735 90; 102.957; 90 | 2748.41 | Shankar, Majji; Saha, Arijit; Sau, Somratan; Ghosh, Arghadip; Gandon, Vincent; Sahoo, Akhila Kumar Harnessing Sulfur and Nitrogen in the Cobalt (III)-Catalyzed Unsymmetrical Double Annulation of Thioamides: Probing the Origin of Chemo- and Regioselectivity Chemical Science, 2021 |
| 1561174 | CIF | C37 H21 Cl4 N O2 S | P -1 | 9.0387; 12.2872; 15.4499 70.572; 83.642; 86.486 | 1607.7 | Shankar, Majji; Saha, Arijit; Sau, Somratan; Ghosh, Arghadip; Gandon, Vincent; Sahoo, Akhila Kumar Harnessing Sulfur and Nitrogen in the Cobalt (III)-Catalyzed Unsymmetrical Double Annulation of Thioamides: Probing the Origin of Chemo- and Regioselectivity Chemical Science, 2021 |
| 1561175 | CIF | Ca0.94 Ce0.04 Fe0.11 Na0.02 Nb0.13 O3 Ti0.76 | P b n m | 5.403; 5.4723; 7.6781 90; 90; 90 | 227.017 | Kitahara, G.; Yoshiasa, A.; Tokuda, M.; Tobase, T.; Sugiyama, K. XANES analyses on minor elements and X-ray single crystal structure analyses of Ce- and Nb-perovskite Journal of Mineralogical and Petrological Sciences, 2021, 116, 45-55 |
| 1561176 | CIF | Ca0.83 Ce0.09 Fe0.02 Na0.08 Nb0.02 O3 Ti0.96 | P b n m | 5.4158; 5.4838; 7.7039 90; 90; 90 | 228.8 | Kitahara, G.; Yoshiasa, A.; Tokuda, M.; Tobase, T.; Sugiyama, K. XANES analyses on minor elements and X-ray single crystal structure analyses of Ce- and Nb-perovskite Journal of Mineralogical and Petrological Sciences, 2021, 116, 45-55 |
| 1561177 | CIF | C53.5 H84 Ge2 N4 Si3 | P -1 | 11.7931; 14.429; 17.6548 92.7304; 91.345; 111.889 | 2781.69 | Müller, Thomas; Dong, Zhaowen; Schmidtmann, Marc; Winkler, Jan Mathis Three-membered cyclic digermylenes stabilized by an N-heterocyclic carbene Chemical Science, 2021 |
| 1561178 | CIF | C52 H88 Ge2 N4 O2 Si3 | P -1 | 14.5456; 14.7302; 15.0458 70.717; 84.15; 76.059 | 2952.3 | Müller, Thomas; Dong, Zhaowen; Schmidtmann, Marc; Winkler, Jan Mathis Three-membered cyclic digermylenes stabilized by an N-heterocyclic carbene Chemical Science, 2021 |
| 1561179 | CIF | C73 H113.5 Ge2 N4 O1.75 Si6 | P -1 | 11.9129; 15.088; 22.7675 76.4735; 84.561; 80.734 | 3919.9 | Müller, Thomas; Dong, Zhaowen; Schmidtmann, Marc; Winkler, Jan Mathis Three-membered cyclic digermylenes stabilized by an N-heterocyclic carbene Chemical Science, 2021 |
| 1561180 | CIF | C84 H108 O16 Se4 Te2 | P 1 21/n 1 | 18.8279; 27.9082; 32.268 90; 106.815; 90 | 16230 | Wang, Shitao; Yan, Chaoxian; Zhao, Wenlong; Liu, Xiaolan; Yuan, Cheng-Shan; Zhang, Hao-Li; Shao, Xiangfeng A tellura-Baeyer‒Villiger oxidation: one-step transformation of tellurophene into chiral tellurinate lactone Chemical Science, 2021, 12, 5811-5817 |
| 1561181 | CIF | C42 H54 Cl2 O7 Se2 Te | P -1 | 9.902; 14.643; 16.12 106.116; 104.058; 96.56 | 2136.4 | Wang, Shitao; Yan, Chaoxian; Zhao, Wenlong; Liu, Xiaolan; Yuan, Cheng-Shan; Zhang, Hao-Li; Shao, Xiangfeng A tellura-Baeyer‒Villiger oxidation: one-step transformation of tellurophene into chiral tellurinate lactone Chemical Science, 2021, 12, 5811-5817 |
| 1561182 | CIF | C98 H124 Cl2 O17 Te2 | C 1 2/c 1 | 37.942; 17.3698; 29.2185 90; 105.56; 90 | 18550.6 | Wang, Shitao; Yan, Chaoxian; Zhao, Wenlong; Liu, Xiaolan; Yuan, Cheng-Shan; Zhang, Hao-Li; Shao, Xiangfeng A tellura-Baeyer‒Villiger oxidation: one-step transformation of tellurophene into chiral tellurinate lactone Chemical Science, 2021, 12, 5811-5817 |
| 1561183 | CIF | C84 H116 O16 Te2 | C 1 2/c 1 | 39.1328; 20.3253; 29.544 90; 136.459; 90 | 16187.8 | Wang, Shitao; Yan, Chaoxian; Zhao, Wenlong; Liu, Xiaolan; Yuan, Cheng-Shan; Zhang, Hao-Li; Shao, Xiangfeng A tellura-Baeyer‒Villiger oxidation: one-step transformation of tellurophene into chiral tellurinate lactone Chemical Science, 2021, 12, 5811-5817 |
| 1561184 | CIF | C84 H108 O16 S4 Te2 | P -1 | 19.1567; 35.2402; 49.703 97.646; 90.535; 92.72 | 33214 | Wang, Shitao; Yan, Chaoxian; Zhao, Wenlong; Liu, Xiaolan; Yuan, Cheng-Shan; Zhang, Hao-Li; Shao, Xiangfeng A tellura-Baeyer‒Villiger oxidation: one-step transformation of tellurophene into chiral tellurinate lactone Chemical Science, 2021, 12, 5811-5817 |
| 1561185 | CIF | C42 H54 Cl2 O7 S2 Te | P -1 | 9.8421; 14.6373; 16.1252 107.209; 103.814; 97.239 | 2105.86 | Wang, Shitao; Yan, Chaoxian; Zhao, Wenlong; Liu, Xiaolan; Yuan, Cheng-Shan; Zhang, Hao-Li; Shao, Xiangfeng A tellura-Baeyer‒Villiger oxidation: one-step transformation of tellurophene into chiral tellurinate lactone Chemical Science, 2021, 12, 5811-5817 |
| 1561186 | CIF | C72 H162 K N O24 Si6 U2 | P 1 21/c 1 | 14.21; 28.1537; 27.91 90; 104.632; 90 | 10804 | Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds. Chemical science, 2021, 12, 6153-6158 |
| 1561187 | CIF | C73 H162 K2 N2 O24 S2 Si6 U2 | P 1 21 1 | 13.9065; 18.2338; 22.181 90; 92.45; 90 | 5619.3 | Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds. Chemical science, 2021, 12, 6153-6158 |
| 1561188 | CIF | C73 H162 K2 N2 O26 Si6 U2 | P 1 21 1 | 13.9377; 17.9175; 22.0849 90; 92.306; 90 | 5510.8 | Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds. Chemical science, 2021, 12, 6153-6158 |
| 1561189 | CIF | C79 H172 K2 N2 O24 Si6 U2 | P 1 21/n 1 | 14.4207; 17.5321; 21.9098 90; 91.84; 90 | 5536.5 | Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds. Chemical science, 2021, 12, 6153-6158 |
| 1561190 | CIF | C72 H162 K2 N4 O24 Si6 U2 | P 1 21/n 1 | 14.382; 17.661; 21.819 90; 92.012; 90 | 5538.6 | Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds. Chemical science, 2021, 12, 6153-6158 |
| 1561191 | CIF | C81 H170 K2 N2 O26 Si6 U2 | P 1 21 1 | 13.9927; 18.2874; 22.208 90; 93.321; 90 | 5673.3 | Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds. Chemical science, 2021, 12, 6153-6158 |
| 1561223 | CIF | C52 H62 Ca O4 Sn2 | C 1 2/c 1 | 16.2273; 15.8447; 18.9351 90; 98.715; 90 | 4812.3 | Chapple, Peter M.; Cartron, Julien; Hamdoun, Ghanem; Kahlal, Samia; Cordier, Marie; Oulyadi, Hassan; Carpentier, Jean-François; Saillard, Jean-Yves; Sarazin, Yann Metal‒metal bonded alkaline-earth distannyls Chemical Science, 2021, 12, 7098-7114 |
| 1561224 | CIF | C34 H86 Ca O4 Si6 Sn2 | P 1 21/c 1 | 20.9784; 13.237; 20.0226 90; 105.698; 90 | 5352.7 | Chapple, Peter M.; Cartron, Julien; Hamdoun, Ghanem; Kahlal, Samia; Cordier, Marie; Oulyadi, Hassan; Carpentier, Jean-François; Saillard, Jean-Yves; Sarazin, Yann Metal‒metal bonded alkaline-earth distannyls Chemical Science, 2021, 12, 7098-7114 |
| 1561225 | CIF | C52 H62 O4 Sn2 Sr | C 1 2/c 1 | 16.3942; 15.957; 19.01 90; 99.049; 90 | 4911.2 | Chapple, Peter M.; Cartron, Julien; Hamdoun, Ghanem; Kahlal, Samia; Cordier, Marie; Oulyadi, Hassan; Carpentier, Jean-François; Saillard, Jean-Yves; Sarazin, Yann Metal‒metal bonded alkaline-earth distannyls Chemical Science, 2021, 12, 7098-7114 |
| 1561226 | CIF | C38 H94 Ba O5 Si6 Sn2 | C 1 2/c 1 | 19.499; 17.117; 34.898 90; 91.768; 90 | 11642 | Chapple, Peter M.; Cartron, Julien; Hamdoun, Ghanem; Kahlal, Samia; Cordier, Marie; Oulyadi, Hassan; Carpentier, Jean-François; Saillard, Jean-Yves; Sarazin, Yann Metal‒metal bonded alkaline-earth distannyls Chemical Science, 2021, 12, 7098-7114 |
| 1561227 | CIF | C34 H86 O4 Si6 Sn2 Sr | P 1 21/c 1 | 40.215; 13.1722; 20.52 90; 93.183; 90 | 10853 | Chapple, Peter M.; Cartron, Julien; Hamdoun, Ghanem; Kahlal, Samia; Cordier, Marie; Oulyadi, Hassan; Carpentier, Jean-François; Saillard, Jean-Yves; Sarazin, Yann Metal‒metal bonded alkaline-earth distannyls Chemical Science, 2021, 12, 7098-7114 |
| 1561228 | CIF | C116 H148 Ba2 O11 Sn4 | P c a 21 | 17.2099; 35.155; 18.6605 90; 90; 90 | 11289.9 | Chapple, Peter M.; Cartron, Julien; Hamdoun, Ghanem; Kahlal, Samia; Cordier, Marie; Oulyadi, Hassan; Carpentier, Jean-François; Saillard, Jean-Yves; Sarazin, Yann Metal‒metal bonded alkaline-earth distannyls Chemical Science, 2021, 12, 7098-7114 |
| 1561229 | CIF | C40 H34 Br2 N2 O2 S2 | P -1 | 7.845; 10.433; 15.69 73.92; 89.21; 70.37 | 1157.8 | Yang, Wei; Sun, Mingxiang; Wang, Yue; Yan, Hui; Zhang, Guobing; Zhang, Qing Bis-isatin based polymers with tunable energy levels for organic field-effect transistor applications Polymer Chemistry, 2021, 12, 2317-2324 |
| 1561232 | CIF | C25 H18 N2 O7 Zn | P 1 21/c 1 | 11.7505; 15.3185; 12.9694 90; 109.03; 90 | 2206.91 | Tian, Li; Xu, Xuebin; Liu, Meiying; Liu, Zixin; Liu, Zhiliang Significantly Enhancing the Lithium Ionic Conductivity of Metal‒Organic Frameworks via a Postsynthetic Modification Strategy Langmuir, 2021 |
| 1561233 | CIF | C36 H48 N2 O4 S4 | P -1 | 9.629; 14.535; 19.083 85.137; 89.812; 83.002 | 2641.3 | Teshima, Yoshikazu; Saito, Masahiko; Mikie, Tsubasa; Komeyama, Kimihiro; Osaka, Itaru Bithiazole Dicarboxylate Ester: An Easily Accessible Electron-Deficient Building Unit for π-Conjugated Polymers Enabling Electron Transport Macromolecules, 2021 |
| 1561273 | CIF | C16 H40 Cl7 In N4 O0 S4 | C 1 2/c 1 | 20.9774; 10.1284; 14.5479 90; 99.752; 90 | 3046.3 | Wu, Yue; Shi, Cui-Mi; Xu, Liang-Jin; Yang, Ming; Chen, Zhong-Ning Reversible Luminescent Vapochromism of a Zero-Dimensional Sb<sup>3+</sup>-Doped Organic-Inorganic Hybrid. The journal of physical chemistry letters, 2021, 3288-3294 |
| 1561274 | CIF | C12 H27 Cl5 In N2 O S2 | P 1 21/n 1 | 11.7611; 12.5257; 15.0163 90; 96.853; 90 | 2196.34 | Wu, Yue; Shi, Cui-Mi; Xu, Liang-Jin; Yang, Ming; Chen, Zhong-Ning Reversible Luminescent Vapochromism of a Zero-Dimensional Sb<sup>3+</sup>-Doped Organic-Inorganic Hybrid. The journal of physical chemistry letters, 2021, 3288-3294 |
| 1561275 | CIF | C14 H36 Cl6 In N3 O S3 | P -1 | 7.7233; 11.6526; 15.1865 82.98; 87.09; 88.651 | 1354.53 | Wu, Yue; Shi, Cui-Mi; Xu, Liang-Jin; Yang, Ming; Chen, Zhong-Ning Reversible Luminescent Vapochromism of a Zero-Dimensional Sb<sup>3+</sup>-Doped Organic-Inorganic Hybrid. The journal of physical chemistry letters, 2021, 3288-3294 |
| 1561276 | CIF | C16 H40 Cl7 In0.93 N4 S4 Sb0.07 | C 1 2/c 1 | 21.0254; 10.1582; 14.5931 90; 99.846; 90 | 3070.9 | Wu, Yue; Shi, Cui-Mi; Xu, Liang-Jin; Yang, Ming; Chen, Zhong-Ning Reversible Luminescent Vapochromism of a Zero-Dimensional Sb<sup>3+</sup>-Doped Organic-Inorganic Hybrid. The journal of physical chemistry letters, 2021, 3288-3294 |
| 1561277 | CIF | C15 H17 N O S | P 1 21/c 1 | 8.8398; 22.2474; 7.025 90; 105.163; 90 | 1333.46 | Heinz, Benjamin; Djukanovic, Dimitrije; Filipponi, Paolo; Martin, Benjamin; Karaghiosoff, Konstantin; Knochel, Paul Regioselective Difunctionalization of Pyridines via 3,4-Pyridynes Chemical Science, 2021 |
| 1561278 | CIF | C15 H16 I N O S | P 1 21 1 | 8.587; 6.1553; 14.6215 90; 99.114; 90 | 763.07 | Heinz, Benjamin; Djukanovic, Dimitrije; Filipponi, Paolo; Martin, Benjamin; Karaghiosoff, Konstantin; Knochel, Paul Regioselective Difunctionalization of Pyridines via 3,4-Pyridynes Chemical Science, 2021 |
| 1561279 | CIF | C17 H23 N O2 Si | P n a 21 | 30.9518; 6.9485; 15.9226 90; 90; 90 | 3424.45 | Heinz, Benjamin; Djukanovic, Dimitrije; Filipponi, Paolo; Martin, Benjamin; Karaghiosoff, Konstantin; Knochel, Paul Regioselective Difunctionalization of Pyridines via 3,4-Pyridynes Chemical Science, 2021 |
| 1561308 | CIF | C26 H36 O15 | P 1 21 1 | 10.648; 6.3182; 20.729 90; 95.88; 90 | 1387.2 | Sun, Meng; Guo, Brian; Xu, Mingming; Zhao, Ming; Onakpa, Monday M.; Wu, Zhenlong; Burdette, Joanna E.; Che, Chun-Tao (9βH)- and 17-Nor-Pimaranes from Icacina oliviformis Journal of Natural Products, 2021 |
| 1561309 | CIF | C18 H13 N3 O4 | C 1 2/c 1 | 24.705; 8.3362; 20.825 90; 131.76; 90 | 3199.2 | Xu, Wei-Feng; Chao, Rong; Hai, Yang; Guo, Yang-Yang; Wei, Mei-Yan; Wang, Chang-Yun; Shao, Chang-Lun 17-Hydroxybrevianamide N and Its N1-Methyl Derivative, Quinazolinones from a Soft-Coral-Derived <i>Aspergillus</i> sp. Fungus: 13<i>S</i> Enantiomers as the True Natural Products. Journal of natural products, 2021 |
| 1561310 | CIF | C19 H17 N3 O5 | P -1 | 8.3911; 8.8058; 13.4606 95.446; 105.411; 114.671 | 846.93 | Xu, Wei-Feng; Chao, Rong; Hai, Yang; Guo, Yang-Yang; Wei, Mei-Yan; Wang, Chang-Yun; Shao, Chang-Lun 17-Hydroxybrevianamide N and Its N1-Methyl Derivative, Quinazolinones from a Soft-Coral-Derived <i>Aspergillus</i> sp. Fungus: 13<i>S</i> Enantiomers as the True Natural Products. Journal of natural products, 2021 |
| 1561311 | CIF | C17 H12 Br F2 N O2 | P -1 | 4.7731; 11.3543; 14.65 67.712; 85.665; 88.114 | 732.53 | Häfliger, Joel; Livingstone, Keith; Daniliuc, Constantin; Gilmour, Ryan Difluorination of α-(Bromomethyl)styrenes via I(I)/I(III) Catalysis: Facile Access to Electrophilic Linchpins for Drug Discovery Chemical Science, 2021 |
| 1561312 | CIF | C21 H21 N O2 S | P 21 21 21 | 6.5212; 19.52; 27.5641 90; 90; 90 | 3508.7 | Duan, Shengzu; Deng, Guogang; Zi, Yujin; Wu, Xiaomei; Tian, Xun; Liu, Zhengfen; Li, Minyan; Zhang, Hongbin; Yang, Xiaodong; Walsh, Patrick Nickel-Catalyzed Enantioselective Vinylation of Aryl 2-Azaallyl Anions Chemical Science, 2021 |
| 1561313 | CIF HKL Paper | C19 H18 O3 | P 21 21 21 | 7.9229; 9.4474; 20.875 90; 90; 90 | 1562.5 | Shirmila, D. Angeline; Jonathan, D. Reuben; Priya, M. Krishna; Hemalatha, J.; Usha, G. (2<i>E</i>)-2-(3,4-Dimethoxybenzylidene)-3,4-dihydronaphthalen-1(2<i>H</i>)-one IUCrData, 2021, 6, x210309 |
| 1561346 | CIF | C29 H21 F3 N2 | P 1 21/n 1 | 9.4838; 10.8493; 22.4754 90; 94.262; 90 | 2306.16 | Hu, Weigao; Zhan, Qiangqiang; Zhou, Hongwei; Cao, Shanshan; Jiang, Zhiyong Radical-based functionalization-oriented construction: rapid assembly of azaarene-substituted highly functionalized pyrroles Chemical Science, 2021 |
| 1561376 | CIF | C23 H27 F2 N5 O2 | C 1 2 1 | 36.459; 8.6753; 13.8617 90; 98.333; 90 | 4338.1 | Huestis, Malcolm P.; Dela Cruz, Darlene; DiPasquale, Antonio G.; Durk, Matthew R.; Eigenbrot, Charles; Gibbons, Paul; Gobbi, Alberto; Hunsaker, Thomas L.; La, Hank; Leung, Dennis H.; Liu, Wendy; Malek, Shiva; Merchant, Mark; Moffat, John G.; Muli, Christine S.; Orr, Christine J.; Parr, Brendan T.; Shanahan, Frances; Sneeringer, Christopher J.; Wang, Weiru; Yen, Ivana; Yin, Jianping; Siu, Michael; Rudolph, Joachim Targeting KRAS Mutant Cancers via Combination Treatment: Discovery of a 5-Fluoro-4-(3<i>H</i>)-quinazolinone Aryl Urea pan-RAF Kinase Inhibitor. Journal of medicinal chemistry, 2021 |
| 1561377 | CIF | C23 H28 F N5 O2 | P -1 | 9.8391; 11.1859; 11.8823 72.632; 89.776; 64.843 | 1118.23 | Huestis, Malcolm P.; Dela Cruz, Darlene; DiPasquale, Antonio G.; Durk, Matthew R.; Eigenbrot, Charles; Gibbons, Paul; Gobbi, Alberto; Hunsaker, Thomas L.; La, Hank; Leung, Dennis H.; Liu, Wendy; Malek, Shiva; Merchant, Mark; Moffat, John G.; Muli, Christine S.; Orr, Christine J.; Parr, Brendan T.; Shanahan, Frances; Sneeringer, Christopher J.; Wang, Weiru; Yen, Ivana; Yin, Jianping; Siu, Michael; Rudolph, Joachim Targeting KRAS Mutant Cancers via Combination Treatment: Discovery of a 5-Fluoro-4-(3<i>H</i>)-quinazolinone Aryl Urea pan-RAF Kinase Inhibitor. Journal of medicinal chemistry, 2021 |
| 1561396 | CIF | C17 H20 Cl N O3 S | P 1 21/n 1 | 6.8411; 15.3599; 17.0637 90; 100.751; 90 | 1761.56 | Kim, Myojeong; You, Euna; Park, Seongjin; Hong, Sungwoo Divergent Reactivity of Sulfinates with Pyridinium Salts Based on One- versus Two-Electron Pathways Chemical Science, 2021 |
| 1561397 | CIF | C19 H14 F3 N O2 S | P 1 21/c 1 | 15.1971; 15.1809; 7.5348 90; 97.371; 90 | 1724 | Kim, Myojeong; You, Euna; Park, Seongjin; Hong, Sungwoo Divergent Reactivity of Sulfinates with Pyridinium Salts Based on One- versus Two-Electron Pathways Chemical Science, 2021 |
| 1561398 | CIF HKL Paper | C24 H22 N2 O5 | P 21 21 2 | 37.196; 4.8441; 5.584 90; 90; 90 | 1006.13 | El-Hiti, Gamal A; Abdel-Wahab, Bakr F.; Baashen, Mohammed A.; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 2-(Naphthalen-2-yloxy)-<i>N</i>'-[2-(naphthalen-2-yloxy)acetyl]acetohydrazide monohydrate IUCrData, 2021, 6, x210314 |
| 1561399 | CIF HKL Paper | H20 I14 O10 Ta6 | P -1 | 10.009; 10.118; 10.498 117.451; 97.465; 96.344 | 917.7 | Schröder, Florian; Köckerling, Martin Hexaaquadodeca-μ2-iodido-octahedro-hexatantalum diiodide tetrahydrate IUCrData, 2021, 6 |
| 1561440 | CIF | C38 H48 O4 | P 65 2 2 | 12.3525; 12.3525; 79.6448 90; 90; 120 | 10524.4 | Lu, Wei-Jia; Xu, Wen-Jun; Zhang, Mei-Hui; Zhang, Yan-Qiu; Li, Yi-Ran; Zhang, Hao; Luo, Jun; Kong, Ling-Yi Diverse Polycyclic Polyprenylated Acylphloroglucinol Congeners with Anti-Nonalcoholic Steatohepatitis Activity from <i>Hypericum forrestii</i>. Journal of natural products, 2021 |
| 1561441 | CIF | C60 H90 Al6 Cu8 | C 1 2/m 1 | 19.603; 17.296; 12.944 90; 123.107; 90 | 3676.2 | Schütz, Max; Gemel, Christian; Muhr, Maximilian; Jandl, Christian; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A. Exploring Cu/Al cluster growth and reactivity: from embryonic building blocks to intermetalloid, open-shell superatoms. Chemical science, 2021, 12, 6588-6599 |
| 1561442 | CIF | C30 H45 Al Cu2 | P -1 | 10.6817; 10.6837; 15.0961 75.703; 72.18; 60.202 | 1413.85 | Schütz, Max; Gemel, Christian; Muhr, Maximilian; Jandl, Christian; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A. Exploring Cu/Al cluster growth and reactivity: from embryonic building blocks to intermetalloid, open-shell superatoms. Chemical science, 2021, 12, 6588-6599 |
| 1561443 | CIF | C60 H90 Al6 Cu7.33 | I 1 2/m 1 | 12.9999; 17.2545; 16.5285 90; 97.741; 90 | 3673.7 | Schütz, Max; Gemel, Christian; Muhr, Maximilian; Jandl, Christian; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A. Exploring Cu/Al cluster growth and reactivity: from embryonic building blocks to intermetalloid, open-shell superatoms. Chemical science, 2021, 12, 6588-6599 |
| 1561444 | CIF | C59 H86 Al4 Cu4 | P 1 21/n 1 | 14.6563; 25.306; 19.6043 90; 92.589; 90 | 7263.7 | Schütz, Max; Gemel, Christian; Muhr, Maximilian; Jandl, Christian; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A. Exploring Cu/Al cluster growth and reactivity: from embryonic building blocks to intermetalloid, open-shell superatoms. Chemical science, 2021, 12, 6588-6599 |
| 1561445 | CIF | C48 H48 N6 | P 1 21/c 1 | 11.9199; 6.4841; 24.7395 90; 91.495; 90 | 1911.5 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561446 | CIF | C38 H24 N6 | P 1 21/n 1 | 6.429; 14.653; 15.517 90; 94.96; 90 | 1456.3 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561447 | CIF | C43 H36 N6 | P -1 | 6.326; 15.778; 16.684 81.36; 89.31; 88.89 | 1646 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561448 | CIF | C40 H26 Cl6 N6 | P -1 | 11.6072; 11.69065; 15.3099 100.114; 104.457; 112.643 | 1768.75 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561449 | CIF | C38 H24 N6 | P 1 21/n 1 | 9.244; 6.649; 24.353 90; 98.58; 90 | 1480.1 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561450 | CIF | C38 H24 N6 | P -1 | 6.326; 15.778; 16.684 81.36; 89.31; 88.89 | 1646 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561451 | CIF | C38 H24 N6 | P 1 21/c 1 | 11.9199; 6.4841; 24.7395 90; 91.495; 90 | 1911.5 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561452 | CIF | C55.6 H34.6 Cl4.8 N9 | P -1 | 11.7152; 12.5774; 17.5509 99.811; 93.572; 101.07 | 2488.73 | Kang, Taewon; Kim, Hongsik; Jeoung, Sungeun; Moon, Dohyun; Moon, Hoi Ri; Lee, Dongwhan Non-stackable molecules assemble into porous crystals displaying concerted cavity-changing motions Chemical Science, 2021 |
| 1561472 | CIF | C223 H104 Dy3 N20 | P 1 21/c 1 | 14.761; 32.102; 32.24 90; 101.88; 90 | 14949.9 | Yang, Shangfeng; Jin, Fei; Xin, Jinpeng; Guan, Runnan; Xie, Xiao-Ming; Chen, Muqing; Zhang, Qianyan; Popov, Alexey A.; Xie, Su-Yuan Stabilizing Three-Center Single-Electron Metal-Metal Bond in a Fullerene Cage Chemical Science, 2021 |
| 1561473 | CIF | C328 H616 N40 O216 P8 S0 V48 | P 1 21/n 1 | 24.986; 41.24; 25.1687 90; 108.986; 90 | 24524 | Guo, Ji; Chang, Qing; Liu, Zhiwei; Wang, Yangming; Liu, Chuanhong; Wang, Mou; Huang, Danmeng; Chen, Guanying; Zhao, Hongmei; Wang, Wei; Fang, Xikui How to not build a cage: endohedral functionalization of polyoxometalate-based metal-organic polyhedra. Chemical science, 2021, 12, 7361-7368 |
| 1561474 | CIF | C369 H665 N31 O227 P8 S0 V48 | P 1 21/n 1 | 24.986; 42.565; 25.2167 90; 109.572; 90 | 25269 | Guo, Ji; Chang, Qing; Liu, Zhiwei; Wang, Yangming; Liu, Chuanhong; Wang, Mou; Huang, Danmeng; Chen, Guanying; Zhao, Hongmei; Wang, Wei; Fang, Xikui How to not build a cage: endohedral functionalization of polyoxometalate-based metal-organic polyhedra. Chemical science, 2021, 12, 7361-7368 |
| 1561475 | CIF | C309 H610 Cl N23 O245 P8 V56 | C 1 2/m 1 | 39.096; 26.059; 29.242 90; 113.642; 90 | 27291 | Guo, Ji; Chang, Qing; Liu, Zhiwei; Wang, Yangming; Liu, Chuanhong; Wang, Mou; Huang, Danmeng; Chen, Guanying; Zhao, Hongmei; Wang, Wei; Fang, Xikui How to not build a cage: endohedral functionalization of polyoxometalate-based metal-organic polyhedra. Chemical science, 2021, 12, 7361-7368 |
| 1561476 | CIF | C156 H297 N11 O106 P4 S0 V24 | P 1 21/m 1 | 27.776; 32.56; 36.61 90; 105.89; 90 | 31844 | Guo, Ji; Chang, Qing; Liu, Zhiwei; Wang, Yangming; Liu, Chuanhong; Wang, Mou; Huang, Danmeng; Chen, Guanying; Zhao, Hongmei; Wang, Wei; Fang, Xikui How to not build a cage: endohedral functionalization of polyoxometalate-based metal-organic polyhedra. Chemical science, 2021, 12, 7361-7368 |
| 1561477 | CIF | C32 H60 N12 O16 Zn2 | P 31 2 1 | 8.9788; 8.9788; 44.4258 90; 90; 120 | 3101.72 | ICHIMARU, Yoshimi; JIN, Wanchun; YAMAGUCHI, Yoshihiro; SUGIURA, Kirara; IMAI, Masanori; KUROSAKI, Hiromasa; FUJIOKA, Haruto; KOIKE, Tohru; HIEDA, Yuhzo; KATO, Koichi Crystal Structure of [1<sup>1</sup>,1<sup>4</sup>,1<sup>7</sup>,1<sup>10</sup>,5<sup>1</sup>,5<sup>4</sup>,5<sup>7</sup>,5<sup>10</sup>-Octaaza-1,5(1,4)-dicyclododecana-3,7(1,3)-dibenzenacyclooctaphane]zinc(II) tetrakis(nitrate), [<i>m,m</i>-bis(Zn<sup>II</sup>-cyclen)](NO<sub>3</sub>)<sub>4</sub> X-ray Structure Analysis Online, 2021, 37, 15-16 |
| 1561478 | CIF | C32.25 H40.75 Cl2 Co2 N6.25 O12.75 | P 1 21/c 1 | 10.4372; 27.8578; 13.5496 90; 102.812; 90 | 3841.6 | SHINDE, Naho; HANDA, Ryunosuke; FURUTACHI, Hideki; SAKATA, Yoko; AKINE, Shigehisa; FUJINAMI, Shuhei; SUZUKI, Masatatsu Synthesis and Crystal Structure of (μ-Acetato)bis(μ-Alkoxo)dicobalt(II, III) Complex with an Unsymmetric Dinucleating Ligand X-ray Structure Analysis Online, 2021, 37, 13-14 |
| 1561479 | CIF | C30 H25 Cl O Si2 | P 1 21/n 1 | 10.6741; 14.2858; 17.5012 90; 99.597; 90 | 2631.37 | Bauer, Jonathan O.; Götz, Tobias Chloropentaphenyldisiloxane—Model Study on Intermolecular Interactions in the Crystal Structure of a Monofunctionalized Disiloxane Chemistry, 2021, 3, 444-453 |
| 1561513 | CIF | C23 H37 Cl N P2 Rh S2 | P 1 21/c 1 | 18.425; 8.8088; 17.927 90; 113.42; 90 | 2669.89 | Hasche, Patrick; Haak, Julia; Anke, Felix; Kubis, Christoph; Baumann, Wolfgang; Drexler, Hans-Joachim; Jiao, Haijun; Beweries, Torsten Dehydropolymerisation of methylamine borane using highly active rhodium(iii) bis(thiophosphinite) pincer complexes: catalytic and mechanistic insights Catalysis Science & Technology, 2021, 11, 3514-3526 |
| 1561514 | CIF | C18 H32 Cl P2 Rh S2 | P 1 21/c 1 | 11.1268; 11.9807; 17.1003 90; 92.141; 90 | 2278 | Hasche, Patrick; Haak, Julia; Anke, Felix; Kubis, Christoph; Baumann, Wolfgang; Drexler, Hans-Joachim; Jiao, Haijun; Beweries, Torsten Dehydropolymerisation of methylamine borane using highly active rhodium(iii) bis(thiophosphinite) pincer complexes: catalytic and mechanistic insights Catalysis Science & Technology, 2021, 11, 3514-3526 |
| 1561515 | CIF | C35 H29 Cl N P2 Rh S2 | P 1 21/n 1 | 9.2984; 15.248; 22.7278 90; 100.479; 90 | 3168.65 | Hasche, Patrick; Haak, Julia; Anke, Felix; Kubis, Christoph; Baumann, Wolfgang; Drexler, Hans-Joachim; Jiao, Haijun; Beweries, Torsten Dehydropolymerisation of methylamine borane using highly active rhodium(iii) bis(thiophosphinite) pincer complexes: catalytic and mechanistic insights Catalysis Science & Technology, 2021, 11, 3514-3526 |
| 1561516 | CIF | C66 H78 N4 O4 Pt2 | P 1 21/c 1 | 13.3643; 21.517; 20.834 90; 94.905; 90 | 5969.1 | Pander, Piotr; Daniels, Ruth; Zaytsev, Andrey V.; Horn, Ashleigh; Sil, Amit; Penfold, Thomas J.; Williams, J. A. Gareth; Kozhevnikov, Valery N.; Dias, Fernando B. Exceptionally fast radiative decay of a dinuclear platinum complex through thermally activated delayed fluorescence. Chemical science, 2021, 12, 6172-6180 |
| 1561547 | CIF | C52.5 H100 B Ge9 K N2 O Si8 | P -1 | 14.7094; 16.9327; 18.7377 65.966; 67.528; 88.951 | 3886.2 | Wallach, Chistoph; Geitner, Felix; Fässler, Thomas F FLP-type Nitrile Activation and Cyclic Ether Ring Opening by Halo-Borane Nonagermanide-Cluster Lewis Acid-Base-Pairs Chemical Science, 2021 |
| 1561548 | CIF | C47 H91 B Ge9 K N3 Si8 | P 1 21 1 | 13.7573; 9.2613; 28.4239 90; 94.438; 90 | 3610.6 | Wallach, Chistoph; Geitner, Felix; Fässler, Thomas F FLP-type Nitrile Activation and Cyclic Ether Ring Opening by Halo-Borane Nonagermanide-Cluster Lewis Acid-Base-Pairs Chemical Science, 2021 |
| 1561549 | CIF | C48 H94 B Ge9 K N2 O Si8 | P -1 | 14.6663; 15.46; 18.0618 65.417; 82.365; 88.648 | 3688.8 | Wallach, Chistoph; Geitner, Felix; Fässler, Thomas F FLP-type Nitrile Activation and Cyclic Ether Ring Opening by Halo-Borane Nonagermanide-Cluster Lewis Acid-Base-Pairs Chemical Science, 2021 |
| 1561550 | CIF | C62 H114 B Ge9 K N2 O Si8 | P -1 | 16.4024; 16.8409; 17.5417 92.419; 107.892; 102.92 | 4462.2 | Wallach, Chistoph; Geitner, Felix; Fässler, Thomas F FLP-type Nitrile Activation and Cyclic Ether Ring Opening by Halo-Borane Nonagermanide-Cluster Lewis Acid-Base-Pairs Chemical Science, 2021 |
| 1561583 | CIF | C52 H28 N4 | P -1 | 10.5126; 13.2993; 13.3298 88.442; 84.692; 69.641 | 1739.7 | Leith, Gabrielle A.; Rice, Allison M.; Yarbrough, Brandon J.; Kittikhunnatham, Preecha; Mathur, Abhijai; Morris, Nicholas A.; Francis, Megan J.; Berseneva, Anna A.; Dhull, Poonam; Adams, Richard D.; Bobo, M. Victoria; Vannucci, Aaron A.; Smith, Mark D.; Garashchuk, Sophya; Shustova, Natalia B. "Broken-hearted" carbon bowl <i>via</i> electron shuttle reaction: energetics and electron coupling. Chemical science, 2021, 12, 6600-6606 |
| 1561584 | CIF | C28 H14 N4 | P 1 21/n 1 | 6.9885; 10.0688; 14.6611 90; 103.589; 90 | 1002.76 | Leith, Gabrielle A.; Rice, Allison M.; Yarbrough, Brandon J.; Kittikhunnatham, Preecha; Mathur, Abhijai; Morris, Nicholas A.; Francis, Megan J.; Berseneva, Anna A.; Dhull, Poonam; Adams, Richard D.; Bobo, M. Victoria; Vannucci, Aaron A.; Smith, Mark D.; Garashchuk, Sophya; Shustova, Natalia B. "Broken-hearted" carbon bowl <i>via</i> electron shuttle reaction: energetics and electron coupling. Chemical science, 2021, 12, 6600-6606 |
| 1561585 | CIF | C19 H16 | P 21 21 21 | 5.0524; 15.7417; 15.791 90; 90; 90 | 1255.91 | Leith, Gabrielle A.; Rice, Allison M.; Yarbrough, Brandon J.; Kittikhunnatham, Preecha; Mathur, Abhijai; Morris, Nicholas A.; Francis, Megan J.; Berseneva, Anna A.; Dhull, Poonam; Adams, Richard D.; Bobo, M. Victoria; Vannucci, Aaron A.; Smith, Mark D.; Garashchuk, Sophya; Shustova, Natalia B. "Broken-hearted" carbon bowl <i>via</i> electron shuttle reaction: energetics and electron coupling. Chemical science, 2021, 12, 6600-6606 |
| 1561586 | CIF | C19 H12 | P 1 21/c 1 | 18.41; 11.5059; 12.1836 90; 109.148; 90 | 2438 | Leith, Gabrielle A.; Rice, Allison M.; Yarbrough, Brandon J.; Kittikhunnatham, Preecha; Mathur, Abhijai; Morris, Nicholas A.; Francis, Megan J.; Berseneva, Anna A.; Dhull, Poonam; Adams, Richard D.; Bobo, M. Victoria; Vannucci, Aaron A.; Smith, Mark D.; Garashchuk, Sophya; Shustova, Natalia B. "Broken-hearted" carbon bowl <i>via</i> electron shuttle reaction: energetics and electron coupling. Chemical science, 2021, 12, 6600-6606 |
| 1561587 | CIF | C21 H20 | P n a 21 | 9.8601; 9.0281; 16.8983 90; 90; 90 | 1504.25 | Leith, Gabrielle A.; Rice, Allison M.; Yarbrough, Brandon J.; Kittikhunnatham, Preecha; Mathur, Abhijai; Morris, Nicholas A.; Francis, Megan J.; Berseneva, Anna A.; Dhull, Poonam; Adams, Richard D.; Bobo, M. Victoria; Vannucci, Aaron A.; Smith, Mark D.; Garashchuk, Sophya; Shustova, Natalia B. "Broken-hearted" carbon bowl <i>via</i> electron shuttle reaction: energetics and electron coupling. Chemical science, 2021, 12, 6600-6606 |
| 1561588 | CIF | C3 Cs2 K0.5 O68 P2 W18 | P 63 2 2 | 17.209; 17.209; 28.557 90; 90; 120 | 7324.1 | Ogiwara, Naoki; Tomoda, Masahiro; Miyazaki, Shotaro; Weng, Zhewei; Takatsu, Hiroshi; Kageyama, Hiroshi; Misawa, Toshiyuki; Ito, Takeru; Uchida, Sayaka Integrating molecular design and crystal engineering approaches in non-humidified intermediate-temperature proton conductors based on a Dawson-type polyoxometalate and poly(ethylene glycol) derivatives. Nanoscale, 2021, 13, 8049-8057 |
| 1561589 | CIF | Cs5 O62 P2 W18 | P m m n :2 | 24.1713; 16.5887; 12.6541 90; 90; 90 | 5073.9 | Ogiwara, Naoki; Tomoda, Masahiro; Miyazaki, Shotaro; Weng, Zhewei; Takatsu, Hiroshi; Kageyama, Hiroshi; Misawa, Toshiyuki; Ito, Takeru; Uchida, Sayaka Integrating molecular design and crystal engineering approaches in non-humidified intermediate-temperature proton conductors based on a Dawson-type polyoxometalate and poly(ethylene glycol) derivatives. Nanoscale, 2021, 13, 8049-8057 |
| 1561590 | CIF | Cs5 O62 P2 W18 | P 1 21/c 1 | 17.261; 30.571; 28.331 90; 105.688; 90 | 14393 | Ogiwara, Naoki; Tomoda, Masahiro; Miyazaki, Shotaro; Weng, Zhewei; Takatsu, Hiroshi; Kageyama, Hiroshi; Misawa, Toshiyuki; Ito, Takeru; Uchida, Sayaka Integrating molecular design and crystal engineering approaches in non-humidified intermediate-temperature proton conductors based on a Dawson-type polyoxometalate and poly(ethylene glycol) derivatives. Nanoscale, 2021, 13, 8049-8057 |
| 1561633 | CIF HKL Paper | C14 H12 N4 O3 S | P 1 21/n 1 | 5.4887; 9.247; 27.457 90; 94.75; 90 | 1388.8 | Kotha, Sambasivarao; Gupta, Naveen Kumar; Ansari, Saima 5-[(1,3-Dimethyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)amino]-2-methylisoindoline-1,3-dione IUCrData, 2021, 6 |
| 1561634 | CIF HKL Paper | C16 H12 Cl4 N2 O4 | P 1 21/c 1 | 9.7398; 4.654; 20.1866 90; 100.842; 90 | 898.71 | El-Hiti, Gamal A; Abdel-Wahab, Bakr F.; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 2-(2,4-Dichlorophenoxy)-<i>N</i>'-[2-(2,4-dichlorophenoxy)acetyl]acetohydrazide IUCrData, 2021, 6, x210318 |
| 1561635 | CIF HKL Paper | C22 H20 O3 | P b c a | 8.1123; 15.8713; 27.6155 90; 90; 90 | 3555.6 | Samoľová, Erika; Dehno Khalaji, Aliakbar; Eigner, Václav 4-(Diphenylmethoxy)-3-ethoxybenzaldehyde IUCrData, 2021, 6, x210356 |
| 1561636 | CIF HKL Paper | C8 H11 N O2 S | P -1 | 7.664; 9.876; 13.018 91.602; 104.301; 101.729 | 931.7 | Khanum, Ghazala; Fatima, Aysha; Sharma, Pooja; Srivastava, S. K.; Butcher, Ray J. Ethyl 2-amino-4-methylthiophene-3-carboxylate IUCrData, 2021, 6, x210351 |
| 1561637 | CIF HKL Paper | C11 H15 Br N2 O2 | P 1 21 1 | 6.0518; 27.7837; 6.9028 90; 90.497; 90 | 1160.6 | Samoľová, Erika; Dehno Khalaji, Aliakbar; Eigner, Václav 4-Bromo-2-[({2-[(2-hydroxyethyl)amino]ethyl}imino)methyl]phenol IUCrData, 2021, 6, x210335 |
| 1561638 | CIF | C30 H42 O4 | P 1 21/c 1 | 12.4055; 22.5129; 9.4377 90; 91.882; 90 | 2634.37 | Wang, Ru-Bing; Ma, Shuanggang; Jamieson, Cooper S.; Gao, Rong-Mei; Liu, Yunbao; Li, Yong; Wang, Xiaojing; Li, Yuhuan; Houk, Kendall N.; Qu, Jing; Yu, Shi-shan Library construction of stereochemically diverse isomers of spirooliganin: their total synthesis and antiviral activity Chemical Science, 2021 |
| 1561639 | CIF | C21 H30 O3 | P b c a | 15.257; 9.9205; 23.3519 90; 90; 90 | 3534.5 | Wang, Ru-Bing; Ma, Shuanggang; Jamieson, Cooper S.; Gao, Rong-Mei; Liu, Yunbao; Li, Yong; Wang, Xiaojing; Li, Yuhuan; Houk, Kendall N.; Qu, Jing; Yu, Shi-shan Library construction of stereochemically diverse isomers of spirooliganin: their total synthesis and antiviral activity Chemical Science, 2021 |
| 1561640 | CIF | C21 H30 O3 | P b c a | 7.7751; 11.2883; 41.1933 90; 90; 90 | 3615.44 | Wang, Ru-Bing; Ma, Shuanggang; Jamieson, Cooper S.; Gao, Rong-Mei; Liu, Yunbao; Li, Yong; Wang, Xiaojing; Li, Yuhuan; Houk, Kendall N.; Qu, Jing; Yu, Shi-shan Library construction of stereochemically diverse isomers of spirooliganin: their total synthesis and antiviral activity Chemical Science, 2021 |
| 1561641 | CIF | C21 H30 O3 | P -1 | 6.0339; 11.8215; 13.8305 110.674; 101.373; 97.79 | 881.95 | Wang, Ru-Bing; Ma, Shuanggang; Jamieson, Cooper S.; Gao, Rong-Mei; Liu, Yunbao; Li, Yong; Wang, Xiaojing; Li, Yuhuan; Houk, Kendall N.; Qu, Jing; Yu, Shi-shan Library construction of stereochemically diverse isomers of spirooliganin: their total synthesis and antiviral activity Chemical Science, 2021 |
| 1561642 | CIF | C21 H30 O3 | P -1 | 14.5922; 15.5056; 17.9599 104.166; 110.403; 98.982 | 3560.15 | Wang, Ru-Bing; Ma, Shuanggang; Jamieson, Cooper S.; Gao, Rong-Mei; Liu, Yunbao; Li, Yong; Wang, Xiaojing; Li, Yuhuan; Houk, Kendall N.; Qu, Jing; Yu, Shi-shan Library construction of stereochemically diverse isomers of spirooliganin: their total synthesis and antiviral activity Chemical Science, 2021 |
| 1561668 | CIF | C80 H96 K4 O8 | C 1 2/c 1 | 22.33; 10.12; 31.991 90; 99.196; 90 | 7136 | Rogachev, Andrey Yu.; Zhou, Zheng; Liu, Shuyang; Wei, Zheng; Schaub, Tobias A.; Jasti, Ramesh; Petrukhina, Marina A. Stretching [8]cycloparaphenylene with encapsulated potassium cations: structural and theoretical insights into core perturbation upon four-fold reduction and complexation Chemical Science, 2021 |
| 1561669 | CIF | As4 K5 Na O170 Ru4 W40 | I -4 | 19.6886; 19.6886; 26.1118 90; 90; 90 | 10122 | Li, Huafeng; Chen, Wenjing; Zhao, Yujie; Zou, Yan; Zhao, Xue; Song, Junpeng; Ma, Pengtao; Niu, Jingyang; Wang, Jingping Regulating the catalytic activity of multi-Ru-bridged polyoxometalates based on differential active site environments with six-coordinate geometry and five-coordinate geometry transitions. Nanoscale, 2021, 13, 8077-8086 |
| 1561670 | CIF | As4 Cl2 K Na12 O179.5 W40 | P -1 | 19.178; 19.677; 30.803 94.414; 98.453; 116.279 | 10176 | Li, Huafeng; Chen, Wenjing; Zhao, Yujie; Zou, Yan; Zhao, Xue; Song, Junpeng; Ma, Pengtao; Niu, Jingyang; Wang, Jingping Regulating the catalytic activity of multi-Ru-bridged polyoxometalates based on differential active site environments with six-coordinate geometry and five-coordinate geometry transitions. Nanoscale, 2021, 13, 8077-8086 |
| 1561699 | CIF | C14 H21 N O5 S | P 1 21/c 1 | 26.9877; 5.7256; 9.8987 90; 90.078; 90 | 1529.55 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561700 | CIF | C13 H17 N O3 S | P 1 21/c 1 | 23.1972; 6.10055; 9.242 90; 90.2932; 90 | 1307.87 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561701 | CIF | C26 H33 N O9 S | C 1 2 1 | 22.5244; 10.26708; 12.02634 90; 96.6693; 90 | 2762.39 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561702 | CIF | C10 H17 F2 N O3 S | P 1 21/c 1 | 11.83783; 10.04452; 10.01996 90; 96.4304; 90 | 1183.93 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561703 | CIF | C9 H17 N O4 S | P 1 21/c 1 | 18.4344; 6.101; 9.7772 90; 91.605; 90 | 1099.19 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561704 | CIF | C14 H25 N O2 S | P 1 21/n 1 | 6.4731; 19.8101; 11.0428 90; 94.993; 90 | 1410.68 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561705 | CIF | C12 H17 N O3 S | P 1 21/n 1 | 5.4965; 24.4849; 9.7713 90; 105.544; 90 | 1266.94 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561706 | CIF | C9 H11 N3 O3 S2 | P -1 | 5.4957; 5.8614; 18.6487 83.542; 88.913; 82.753 | 592.13 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561707 | CIF | C17 H23 N O2 S | P 1 21/n 1 | 14.0325; 6.2686; 18.2532 90; 110.571; 90 | 1503.25 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Arman, Hadi D.; Larionov, Oleg V. Photocatalytic decarboxylative amidosulfonation enables direct transformation of carboxylic acids to sulfonamides Chemical Science, 2021 |
| 1561708 | CIF HKL Paper | C16 H15 Cl2 N5 O7 | P 1 21/n 1 | 7.9855; 13.5742; 17.6103 90; 91.463; 90 | 1908.3 | Sathya, Udhayasuriyan; Nirmal Ram, Jeyaraman Selvaraj; Gomathi, Sundaramoorthy; Ramu, Shyamaladevi; Jegan Jennifer, Samson; Ibrahim, Abdul Razak 4-(2,3-Dichlorophenyl)piperazin-1-ium picrate IUCrData, 2021, 6, x210379 |
| 1561776 | CIF | C35 H32 B Cl2 Cu N4 P2 S | P 1 21/c 1 | 9.4427; 38.5575; 9.5037 90; 94.951; 90 | 3447.26 | Yu, Xiao; Li, Xiaoyue; Cai, Zelun; Sun, Lingzhi; Wang, Chengbo; Rao, Haixia; Wei, Chen; Bian, Zuqiang; Jin, Qionghua; Liu, Zhiwei Mechanochromic properties in a mononuclear Cu(I) complex without cuprophilic interactions. Chemical communications (Cambridge, England), 2021, 57, 5082-5085 |
| 1561777 | CIF | C35 H32 B Cl2 Cu N4 P2 S | P 1 21 1 | 11.20173; 8.45092; 18.9038 90; 96.6573; 90 | 1777.46 | Yu, Xiao; Li, Xiaoyue; Cai, Zelun; Sun, Lingzhi; Wang, Chengbo; Rao, Haixia; Wei, Chen; Bian, Zuqiang; Jin, Qionghua; Liu, Zhiwei Mechanochromic properties in a mononuclear Cu(I) complex without cuprophilic interactions. Chemical communications (Cambridge, England), 2021, 57, 5082-5085 |
| 1561778 | CIF | C21 H28 F3 N3 O3 | C 1 2/c 1 | 52.9651; 8.6539; 19.4197 90; 91.443; 90 | 8898.3 | Jiang, Tuo; Bordi, Samuele; McMillan, Angus Erland; Chen, Kuang-Yen; Saito, Fumito; Nichols, Paula L.; Wanner, Benedikt M.; Bode, Jeffrey W. An Integrated Console for Capsule-Based, Automated Organic Synthesis Chemical Science, 2021 |
| 1561779 | CIF | C21 H28 F3 N3 O3 | P -1 | 8.725; 11.2299; 12.2001 79.147; 80.009; 73.949 | 1118.85 | Jiang, Tuo; Bordi, Samuele; McMillan, Angus Erland; Chen, Kuang-Yen; Saito, Fumito; Nichols, Paula L.; Wanner, Benedikt M.; Bode, Jeffrey W. An Integrated Console for Capsule-Based, Automated Organic Synthesis Chemical Science, 2021 |
| 1561780 | CIF | C17 H22 Cu N4 O6.5 | P 1 21 1 | 8.984; 17.472; 12.48 90; 99.44; 90 | 1932.4 | Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes New Journal of Chemistry, 2021, 45, 8118-8124 |
| 1561781 | CIF | C38 H32 O8 | P -1 | 9.1526; 13.794; 15.1145 107.493; 92.096; 102.376 | 1767.2 | Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes New Journal of Chemistry, 2021, 45, 8118-8124 |
| 1561782 | CIF | C41 H37 N O6 | P -1 | 9.4795; 13.3263; 26.101 94.943; 98.261; 98.981 | 3203.1 | Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes New Journal of Chemistry, 2021, 45, 8118-8124 |
| 1561783 | CIF | C38 H28 O8 | P -1 | 9.7076; 11.8242; 12.4785 87.701; 78.041; 89.185 | 1400.1 | Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes New Journal of Chemistry, 2021, 45, 8118-8124 |
| 1561784 | CIF | C38 H30 O8 | P 1 21/c 1 | 13.107; 13.566; 32.525 90; 90.549; 90 | 5783 | Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes New Journal of Chemistry, 2021, 45, 8118-8124 |
| 1561785 | CIF | C45 H37 Cl2 O6 P S | P -1 | 12.2704; 12.9162; 14.0637 105.461; 91.247; 115.181 | 1920.6 | Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes New Journal of Chemistry, 2021, 45, 8118-8124 |
| 1561832 | CIF | C39 H50 Gd2 N11 O14.5 | P 41 21 2 | 17.6388; 17.6388; 29.2421 90; 90; 90 | 9098 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561833 | CIF | C39 H53 N11 O16 Y2 | P 43 21 2 | 17.6029; 17.6029; 29.0488 90; 90; 90 | 9001.1 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561834 | CIF | C39 H50 Lu2 N11 O14.5 | P 43 21 2 | 17.5856; 17.5856; 28.9382 90; 90; 90 | 8949.2 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561835 | CIF | C39 H50 Lu N11 O14.5 Yb | P 43 21 2 | 17.5896; 17.5896; 28.9543 90; 90; 90 | 8958.3 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561836 | CIF | C39 H50 Gd N11 O14.5 Yb | P 41 21 2 | 17.6212; 17.6212; 29.1165 90; 90; 90 | 9040.9 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561837 | CIF | C39 H50 Lu N11 O14.5 Y | P 43 21 2 | 17.5884; 17.5884; 28.9743 90; 90; 90 | 8963.3 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561838 | CIF | C39 H50 Gd Lu N11 O14.5 | P 41 21 2 | 17.6236; 17.6236; 29.062 90; 90; 90 | 9026.4 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561839 | CIF | C39 H50 N11 O14.5 Y Yb | P 41 21 2 | 17.5997; 17.5997; 28.979 90; 90; 90 | 8976.2 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561840 | CIF | C39 H52 Gd N11 O15.5 Y | P 43 21 2 | 17.6312; 17.6312; 29.2044 90; 90; 90 | 9078.5 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561841 | CIF | C39 H50 N11 O14.5 Yb2 | P 41 21 2 | 17.5867; 17.5867; 28.966 90; 90; 90 | 8959 | Buch, Christian Dirk; Hansen, Steen H.; Mitcov, Dmitri; Tram, Camilla Mia; Nichol, Gary Stephen; Brechin, Euan K.; Piligkos, Stergios Design of Pure Heterodinuclear Lanthanoid Cryptate Complexes Chemical Science, 2021 |
| 1561842 | CIF | C36 H45 Cl12 I2 N7 | P b c m | 12.486; 27.199; 13.881 90; 90; 90 | 4714.1 | Pinter, Piermaria; Schuesslbauer, Christoph; Watt, Fabian A.; Dickmann, Nicole; Herbst-Irmer, Regine; Morgenstern, Bernd; Gruenwald, Annette; Ullrich, Tobias; Zimmer, Michael; Hohloch, Stephan; Guldi, Dirk M.; Munz, Dominik Bright Luminescent Lithium and Magnesium Carbene Complexes Chemical Science, 2021 |
| 1561843 | CIF | C80 H116 I4 Li6 N14 O4 | P 1 21/n 1 | 14.6296; 18.3265; 16.323 90; 93.471; 90 | 4368.32 | Pinter, Piermaria; Schuesslbauer, Christoph; Watt, Fabian A.; Dickmann, Nicole; Herbst-Irmer, Regine; Morgenstern, Bernd; Gruenwald, Annette; Ullrich, Tobias; Zimmer, Michael; Hohloch, Stephan; Guldi, Dirk M.; Munz, Dominik Bright Luminescent Lithium and Magnesium Carbene Complexes Chemical Science, 2021 |
| 1561844 | CIF | C50 H58 I N7 | P -1 | 10.5612; 15.8193; 15.8498 113.98; 96.942; 105.305 | 2254.1 | Pinter, Piermaria; Schuesslbauer, Christoph; Watt, Fabian A.; Dickmann, Nicole; Herbst-Irmer, Regine; Morgenstern, Bernd; Gruenwald, Annette; Ullrich, Tobias; Zimmer, Michael; Hohloch, Stephan; Guldi, Dirk M.; Munz, Dominik Bright Luminescent Lithium and Magnesium Carbene Complexes Chemical Science, 2021 |
| 1561874 | CIF | C13 H9 Br2 N O S | P -1 | 4.0327; 9.774; 16.841 104.639; 91.864; 95.118 | 638.6 | John, Athira T.; Narayanasamy, Akshaya; George, Deepu; Hariharan, Mahesh Atom-Efficient Halogen‒Halogen Interactions Assist One-, Two-, and Three-Dimensional Molecular Zippers The Journal of Physical Chemistry C, 2021 |
| 1561875 | CIF | C70 H73 Br3 F12 Fe N6 O10 P2 | R -3 :H | 13.982; 13.982; 67.108 90; 90; 120 | 11362 | Morozumi, Takuma; Matsuoka, Ryota; Nakamura, Takashi; Nabeshima, Tatsuya Solvent-dependent fac/mer-isomerization and self-assembly of triply helical complexes bearing a pivot part Chemical Science, 2021 |
| 1561876 | CIF | C13 H11 Cl Cu N4 S2 | P -1 | 8.6462; 9.7989; 10.1011 68.887; 71.065; 82.137 | 755 | Gou, Yi; Chen, MeiRong; Li, Shanhe; Deng, JunGang; Li, Jinlong; Fang, GuiHua; Yang, Feng; Huang, GuoJin Dithiocarbazate-Copper Complexes for Bioimaging and Treatment of Pancreatic Cancer. Journal of medicinal chemistry, 2021 |
| 1561877 | CIF | C26 H22 Cu2 N10 O6 S4 | P -1 | 7.9731; 9.8264; 10.9176 76.501; 85.908; 73.399 | 797.05 | Gou, Yi; Chen, MeiRong; Li, Shanhe; Deng, JunGang; Li, Jinlong; Fang, GuiHua; Yang, Feng; Huang, GuoJin Dithiocarbazate-Copper Complexes for Bioimaging and Treatment of Pancreatic Cancer. Journal of medicinal chemistry, 2021 |
| 1561878 | CIF | C26 H22 Br3 Cu3 N8 S4 | C 1 2/c 1 | 10.7395; 16.0006; 18.9882 90; 96.286; 90 | 3243.3 | Gou, Yi; Chen, MeiRong; Li, Shanhe; Deng, JunGang; Li, Jinlong; Fang, GuiHua; Yang, Feng; Huang, GuoJin Dithiocarbazate-Copper Complexes for Bioimaging and Treatment of Pancreatic Cancer. Journal of medicinal chemistry, 2021 |
| 1561941 | CIF | C54 H26 Cd3 N2 O16 | C 1 2/c 1 | 17.2764; 25.4667; 18.4671 90; 95.669; 90 | 8085.3 | Jiao, Zhuo-Hao; Hou, Sheng-Li; Kang, Xiao-Min; Yang, Xiu-Pei; Zhao, Bin Recyclable Luminescence Sensor for Dinotefuran in Water by Stable Cadmium‒Organic Framework Analytical Chemistry, 2021 |
| 1561942 | CIF | C20 H20 Br N5 O8 Ru S3 | P -1 | 8.4255; 12.3597; 13.7917 104.032; 98.783; 90.292 | 1375.7 | Cole, Jacqueline M.; Gosztola, David J.; Velazquez-Garcia, Jose de J. Nanooptomechanical Transduction in a Single Crystal with 100% Photoconversion The Journal of Physical Chemistry C, 2021, 125, 8907-8915 |
| 1561943 | CIF | C46 H52 N4 O6 | C 1 2/c 1 | 21.6002; 13.9128; 15.8199 90; 120.926; 90 | 4078.3 | Liu, Dongming; Song, Bo; Wang, Jia; Li, Baoxi; Wang, Bingnan; Li, Mingzhao; Qin, Anjun; Tang, Ben Zhong CO2-Involved and Isocyanide-Based Three-Component Polymerization toward Functional Heterocyclic Polymers with Self-Assembly and Sensing Properties Macromolecules, 2021 |
| 1561944 | CIF | C88 H96 N8 O11 | P 1 21/n 1 | 24.1177; 5.9556; 29.0641 90; 100.642; 90 | 4102.8 | Liu, Dongming; Song, Bo; Wang, Jia; Li, Baoxi; Wang, Bingnan; Li, Mingzhao; Qin, Anjun; Tang, Ben Zhong CO2-Involved and Isocyanide-Based Three-Component Polymerization toward Functional Heterocyclic Polymers with Self-Assembly and Sensing Properties Macromolecules, 2021 |
| 1561945 | CIF HKL Paper | C11 H13 Br2 N O4 | P -1 | 7.2866; 8.5212; 12.1832 71.376; 81.745; 83.682 | 707.76 | Noland, Wayland E.; Herzig, Ryan J.; Fox, Renee C.; Tritch, Kenneth J. 3,5-Dibromo-4-carbamoylbenzoic acid 2-propanol monosolvate IUCrData, 2021, 6, x210391 |
| 1561946 | CIF HKL Paper | C8 H22 Cl2 N4 O9 Zn | P 1 2/c 1 | 12.3428; 8.4603; 16.0543 90; 92.881; 90 | 1674.33 | Ichimaru, Yoshimi; Kato, Koichi; Kurosaki, Hiromasa; Fujioka, Haruto; Sakai, Misa; Yamaguchi, Yoshihiro; Wanchun, Jin; Sugiura, Kirara; Imai, Masanori; Koike, Tohru Aqua(1,4,7,10-tetraazacyclododecane)zinc(II) bis(perchlorate) IUCrData, 2021, 6 |
| 1561947 | CIF | Fe0.8 Mn3.2 Nd4 O11.6 | P n m a | 5.7753; 7.6025; 5.4222 90; 90; 90 | 238.07 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561948 | CIF | Fe0.8 Mn3.2 Nd4 O11.6 | P n m a | 5.621; 7.842; 5.519 90; 90; 90 | 243.28 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561949 | CIF | Fe0.8 Mn3.2 Nd4 O12 | P n m a | 5.6046; 7.8383; 5.5186 90; 90; 90 | 242.44 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561950 | CIF | Fe0.4 Mn3.6 Nd4 O11.6 | P n m a | 5.6346; 7.842; 5.5179 90; 90; 90 | 243.82 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561951 | CIF | Fe0.4 Mn3.6 Nd4 O11.6 | P n m a | 5.8096; 7.5778; 5.4196 90; 90; 90 | 238.59 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561952 | CIF | Fe0.4 Mn3.6 Nd4 O12 | P n m a | 5.5927; 7.8178; 5.5063 90; 90; 90 | 240.75 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561953 | CIF | Fe0.4 Mn3.6 Nd4 O12 | P n m a | 5.6657; 7.6228; 5.4186 90; 90; 90 | 234.02 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561954 | CIF | Mn4 Nd4 O11.6 | P n m a | 5.6392; 7.8384; 5.5155 90; 90; 90 | 243.8 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561955 | CIF | Mn4 Nd4 O11.6 | P n m a | 5.8463; 7.5498; 5.4169 90; 90; 90 | 239.09 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561956 | CIF | Mn Nd O3 | P n m a | 5.6021; 7.8322; 5.5149 90; 90; 90 | 241.98 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1561957 | CIF | Mn Nd O3 | P n m a | 5.6748; 7.602; 5.4108 90; 90; 90 | 233.42 | Matus Mihalik Cooperative Jahn-Teller effect in NdMn1-xFexO3 (0 <= x <= 0.2) Journal of Alloys and Compounds, 2021, 857, 157612 |
| 1562005 | CIF | C24 H30 N2 O | P 21 21 21 | 9.138; 13.8136; 15.8299 90; 90; 90 | 1998.2 | Panahi, Farhad; Khosravi, Hormoz; Bauer, Felix; Breit, Bernhard Asymmetric hydroalkylation of alkynes and allenes with imidazolidinone derivatives: α-alkenylation of α-amino acids Chemical Science, 2021, 12, 7388-7392 |
| 1562006 | CIF | C195.5 H248 N19 O67 Zr6 | C 2 2 21 | 25.1903; 29.0888; 64.585 90; 90; 90 | 47325 | Gong, Wei; Liu, Yan; Cui, Yong Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons. Faraday discussions, 2021, 231, 168-180 |
| 1562007 | CIF | C135 H78 O40 Zr6 | C 2 2 21 | 25.626; 30.235; 61.873 90; 90; 90 | 47939 | Gong, Wei; Liu, Yan; Cui, Yong Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons. Faraday discussions, 2021, 231, 168-180 |
| 1562008 | CIF | C61 H42 O17 Zr3 | I 41 2 2 | 42.697; 42.697; 37.907 90; 90; 90 | 69106 | Gong, Wei; Liu, Yan; Cui, Yong Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons. Faraday discussions, 2021, 231, 168-180 |
| 1562009 | CIF | C135 H78 O60 P3 Zr9 | P 62 2 2 | 38.1622; 38.1622; 45.5859 90; 90; 120 | 57495 | Gong, Wei; Liu, Yan; Cui, Yong Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons. Faraday discussions, 2021, 231, 168-180 |
| 1562010 | CIF | C182.67 H102 O60 P3 Zr9 | P 32 2 1 | 45.122; 45.122; 49.238 90; 90; 120 | 86818 | Gong, Wei; Liu, Yan; Cui, Yong Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons. Faraday discussions, 2021, 231, 168-180 |
| 1562050 | CIF | C86 H114 B4 Co2 F8 Fe2 N36 O6 | P -1 | 14.3083; 14.8135; 15.9556 62.691; 66.812; 63.731 | 2616.3 | Kamilya, Sujit; Ghosh, Subrata; Mehta, Sakshi; Mondal, Abhishake Effect of Ligand Modulation on Metal-to-Metal Electron Transfer in a Series of [Fe2Co2] Molecular Square Complexes The Journal of Physical Chemistry A, 2021 |
| 1562051 | CIF | C86 H98 B4 Co2 F8 Fe2 N36 O6 | P -1 | 13.2668; 13.3671; 16.934 75.022; 80.773; 84.036 | 2857.34 | Kamilya, Sujit; Ghosh, Subrata; Mehta, Sakshi; Mondal, Abhishake Effect of Ligand Modulation on Metal-to-Metal Electron Transfer in a Series of [Fe2Co2] Molecular Square Complexes The Journal of Physical Chemistry A, 2021 |
| 1562052 | CIF | C86 H98 B4 Co2 F8 Fe2 N36 O6 | P -1 | 13.476; 13.4982; 17.3464 75.871; 80.2; 84.287 | 3009.7 | Kamilya, Sujit; Ghosh, Subrata; Mehta, Sakshi; Mondal, Abhishake Effect of Ligand Modulation on Metal-to-Metal Electron Transfer in a Series of [Fe2Co2] Molecular Square Complexes The Journal of Physical Chemistry A, 2021 |
| 1562053 | CIF | C78 H98 B4 Co2 F8 Fe2 N36 O6 | P -1 | 13.2612; 13.2975; 15.778 88.404; 70.475; 82.323 | 2598.4 | Kamilya, Sujit; Ghosh, Subrata; Mehta, Sakshi; Mondal, Abhishake Effect of Ligand Modulation on Metal-to-Metal Electron Transfer in a Series of [Fe2Co2] Molecular Square Complexes The Journal of Physical Chemistry A, 2021 |
| 1562054 | CIF | C78 H98 B4 Co2 F8 Fe2 N36 O6 | P -1 | 13.1307; 13.1529; 15.5247 88.755; 70.514; 82.435 | 2504.9 | Kamilya, Sujit; Ghosh, Subrata; Mehta, Sakshi; Mondal, Abhishake Effect of Ligand Modulation on Metal-to-Metal Electron Transfer in a Series of [Fe2Co2] Molecular Square Complexes The Journal of Physical Chemistry A, 2021 |
| 1562055 | CIF | C86 H114 B4 Co2 F8 Fe2 N36 O6 | P -1 | 14.1373; 14.8381; 15.844 62.517; 88.485; 63.206 | 2561.82 | Kamilya, Sujit; Ghosh, Subrata; Mehta, Sakshi; Mondal, Abhishake Effect of Ligand Modulation on Metal-to-Metal Electron Transfer in a Series of [Fe2Co2] Molecular Square Complexes The Journal of Physical Chemistry A, 2021 |
| 1562056 | CIF HKL Paper | C40 H54 Cl4 N4 O5 | P 1 | 9.5944; 12.7606; 18.0312 73.9951; 79.1246; 75.2203 | 2035.09 | Anderson, Grace I.; Bellia, Sophia; Zeller, Matthias; Hillesheim, Patrick C.; Mirjafari, Arsalan Quinine dihydrochloride hemihydrate IUCrData, 2021, 6, x210406 |
| 1562057 | CIF | C23 H30 O5 S Si | P 1 21 1 | 9.2424; 8.7534; 15.2178 90; 96.784; 90 | 1222.54 | Guan, Mingming; Wang, Shiyu; Luo, Yao; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming Catalytic asymmetric addition of thiols to silyl glyoxylates for synthesis of multi-hetero-atom substituted carbon stereocenters. Chemical science, 2021, 12, 7498-7503 |
| 1562058 | CIF | C49 H78 F9 N4 O17 S3 Y | P 1 21 1 | 11.9751; 20.8149; 12.9319 90; 106.231; 90 | 3094.9 | Guan, Mingming; Wang, Shiyu; Luo, Yao; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming Catalytic asymmetric addition of thiols to silyl glyoxylates for synthesis of multi-hetero-atom substituted carbon stereocenters. Chemical science, 2021, 12, 7498-7503 |
| 1562114 | CIF | C14 H15 F N2 O7 | P 1 21/n 1 | 7.6479; 6.3464; 30.7977 90; 94.502; 90 | 1490.2 | Yu, Yue-Ming; Niu, Yuan-Yuan; Wang, Ling-Yang; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei Supramolecular self-assembly and perfected in vitro/vivo property of 5-fluorouracil and ferulic acid on the strength of double optimized strategy: the first 5-fluorouracial-phenolic acid nutraceutical cocrystal with synergistic antitumor efficacy The Analyst, 2021, 146, 2506-2519 |
| 1562115 | CIF | C18 H21.53 N3 O7 P | P 1 21 1 | 10.0914; 9.9851; 10.5204 90; 92.72; 90 | 1058.88 | Kaasik, Mikk; Martõnova, Jevgenija; Erkman, Kristin; Metsala, Andrus; Järving, Ivar; Kanger, Tõnis Enantioselective Michael addition to vinyl phosphonates <i>via</i> hydrogen bond-enhanced halogen bond catalysis. Chemical science, 2021, 12, 7561-7568 |
| 1562116 | CIF | C554 H856 B3 Cs3 F72 N109 O90.25 Si40 | P 1 21 1 | 26.3005; 46.071; 30.4842 90; 91.29; 90 | 36928 | Liu, Mengjia; He, Ying; Shan, Chuan; Wojtas, Lukasz; Ghiviriga, Ion; Fathalla, Omar; Yan, Yu; Li, Xiaopeng; Shi, Xiaodong Anion mediated, tunable isoguanosine self-assemblies: decoding the conformation influence and solvent effects. Chemical science, 2021, 12, 7569-7574 |
| 1562117 | CIF | C20 H24 Cl N5 O5.5 | P 21 21 21 | 9.0849; 21.33; 23.003 90; 90; 90 | 4457.5 | Liu, Mengjia; He, Ying; Shan, Chuan; Wojtas, Lukasz; Ghiviriga, Ion; Fathalla, Omar; Yan, Yu; Li, Xiaopeng; Shi, Xiaodong Anion mediated, tunable isoguanosine self-assemblies: decoding the conformation influence and solvent effects. Chemical science, 2021, 12, 7569-7574 |
| 1562118 | CIF | C28.69 H47.76 N5 O4.94 Si2 | C 1 2 1 | 64.413; 7.1861; 22.2867 90; 99.221; 90 | 10182.7 | Liu, Mengjia; He, Ying; Shan, Chuan; Wojtas, Lukasz; Ghiviriga, Ion; Fathalla, Omar; Yan, Yu; Li, Xiaopeng; Shi, Xiaodong Anion mediated, tunable isoguanosine self-assemblies: decoding the conformation influence and solvent effects. Chemical science, 2021, 12, 7569-7574 |
| 1562119 | CIF | C15 H16 B N3 O4 | P 1 21/c 1 | 11.1651; 10.4907; 12.5832 90; 94.045; 90 | 1470.2 | Lin, Shengjia; Wang, Lucia; Sharma, Abhishek Acrylic boronate: a multifunctional C3 building block for catalytic synthesis of rare organoborons and chemoselective heterobifunctional ligations. Chemical science, 2021, 12, 7924-7929 |
| 1562120 | CIF | C20 H18 B N3 O4 | P 1 21/c 1 | 17.1144; 9.3148; 12.0484 90; 94.91; 90 | 1913.7 | Lin, Shengjia; Wang, Lucia; Sharma, Abhishek Acrylic boronate: a multifunctional C3 building block for catalytic synthesis of rare organoborons and chemoselective heterobifunctional ligations. Chemical science, 2021, 12, 7924-7929 |
| 1562121 | CIF | C82 H102 Au2 Br N8 O4 | P -1 | 13.63; 15.952; 19.288 86.368; 88.416; 78.854 | 4105.8 | Sen, Sajal; Perrin, Mark W.; Sedgwick, Adam C.; Lynch, Vincent M.; Sessler, Jonathan L.; Arambula, Jonathan F. Covalent and non-covalent albumin binding of Au(i) bis-NHCs <i>via</i> post-synthetic amide modification. Chemical science, 2021, 12, 7547-7553 |
| 1562122 | CIF | C43 H57 Au F6 N5 O2 P | P -1 | 11.0894; 18.0488; 24.6597 101.631; 93.6495; 101.64 | 4706.8 | Sen, Sajal; Perrin, Mark W.; Sedgwick, Adam C.; Lynch, Vincent M.; Sessler, Jonathan L.; Arambula, Jonathan F. Covalent and non-covalent albumin binding of Au(i) bis-NHCs <i>via</i> post-synthetic amide modification. Chemical science, 2021, 12, 7547-7553 |
| 1562123 | CIF | C45 H59 Au F6 N5 O2 P | P 1 21 1 | 11.3001; 50.4909; 17.6766 90; 100.564; 90 | 9914.5 | Sen, Sajal; Perrin, Mark W.; Sedgwick, Adam C.; Lynch, Vincent M.; Sessler, Jonathan L.; Arambula, Jonathan F. Covalent and non-covalent albumin binding of Au(i) bis-NHCs <i>via</i> post-synthetic amide modification. Chemical science, 2021, 12, 7547-7553 |
| 1562124 | CIF | C95 H118 Au2 Cl2 F12 N12 O6 P2 | P -1 | 11.0621; 18.0164; 25.9531 102.579; 92.799; 98.359 | 4977.26 | Sen, Sajal; Perrin, Mark W.; Sedgwick, Adam C.; Lynch, Vincent M.; Sessler, Jonathan L.; Arambula, Jonathan F. Covalent and non-covalent albumin binding of Au(i) bis-NHCs <i>via</i> post-synthetic amide modification. Chemical science, 2021, 12, 7547-7553 |
| 1562125 | CIF | C12 H11 Cl O2 | P 1 21/n 1 | 5.7583; 9.7431; 18.3135 90; 94.058; 90 | 1024.88 | Van Lommel, Ruben; Bock, Jonathan; Daniliuc, Constantin; Hennecke, Ulrich; De Proft, Frank A Dynamic Picture of the Halolactonization Reaction through a Combination of ab-initio Metadynamics and Experimental Investigations . Chemical Science, 2021 |
| 1562126 | CIF | C12 H11 Cl O2 | P -1 | 8.1989; 8.4173; 8.8635 68.933; 76.834; 65.982 | 519 | Van Lommel, Ruben; Bock, Jonathan; Daniliuc, Constantin; Hennecke, Ulrich; De Proft, Frank A Dynamic Picture of the Halolactonization Reaction through a Combination of ab-initio Metadynamics and Experimental Investigations . Chemical Science, 2021 |
| 1562127 | CIF | C13 H13 Cl O2 | P -1 | 8.5302; 8.5648; 8.8272 76.753; 69.175; 65.803 | 547.18 | Van Lommel, Ruben; Bock, Jonathan; Daniliuc, Constantin; Hennecke, Ulrich; De Proft, Frank A Dynamic Picture of the Halolactonization Reaction through a Combination of ab-initio Metadynamics and Experimental Investigations . Chemical Science, 2021 |
| 1562128 | CIF | C12 H11 Br O2 | P -1 | 8.3537; 8.5198; 8.8355 69.125; 76.764; 65.212 | 531.08 | Van Lommel, Ruben; Bock, Jonathan; Daniliuc, Constantin; Hennecke, Ulrich; De Proft, Frank A Dynamic Picture of the Halolactonization Reaction through a Combination of ab-initio Metadynamics and Experimental Investigations . Chemical Science, 2021 |
| 1562129 | CIF | C12 H11 Br O2 | P 1 21/n 1 | 5.8376; 9.7639; 18.2223 90; 94.149; 90 | 1035.91 | Van Lommel, Ruben; Bock, Jonathan; Daniliuc, Constantin; Hennecke, Ulrich; De Proft, Frank A Dynamic Picture of the Halolactonization Reaction through a Combination of ab-initio Metadynamics and Experimental Investigations . Chemical Science, 2021 |
| 1562130 | CIF | C13 H13 Br O2 | P -1 | 8.5352; 8.6441; 8.8394 77.597; 69.818; 67.081 | 561.35 | Van Lommel, Ruben; Bock, Jonathan; Daniliuc, Constantin; Hennecke, Ulrich; De Proft, Frank A Dynamic Picture of the Halolactonization Reaction through a Combination of ab-initio Metadynamics and Experimental Investigations . Chemical Science, 2021 |
| 1562166 | CIF | C16 H14 O2 S | P 21 21 21 | 6.256; 7.6732; 28.1296 90; 90; 90 | 1350.32 | McNamee, Ryan E.; Haugland, Marius M.; Nugent, Jeremy; Chan, Rachel; Christensen, Kirsten E.; Anderson, Edward A. Synthesis of 1,3-disubstituted bicyclo[1.1.0]butanes <i>via</i> directed bridgehead functionalization. Chemical science, 2021, 12, 7480-7485 |
| 1562167 | CIF | C16 H13 F O2 S | P 1 c 1 | 7.5201; 6.1363; 29.1109 90; 93.778; 90 | 1340.42 | McNamee, Ryan E.; Haugland, Marius M.; Nugent, Jeremy; Chan, Rachel; Christensen, Kirsten E.; Anderson, Edward A. Synthesis of 1,3-disubstituted bicyclo[1.1.0]butanes <i>via</i> directed bridgehead functionalization. Chemical science, 2021, 12, 7480-7485 |
| 1562168 | CIF | C18 H16 O4 S | P 1 21/c 1 | 7.2283; 19.7499; 21.8837 90; 90.439; 90 | 3123.99 | McNamee, Ryan E.; Haugland, Marius M.; Nugent, Jeremy; Chan, Rachel; Christensen, Kirsten E.; Anderson, Edward A. Synthesis of 1,3-disubstituted bicyclo[1.1.0]butanes <i>via</i> directed bridgehead functionalization. Chemical science, 2021, 12, 7480-7485 |
| 1562169 | CIF | C16 H14 O2 S | P 21 21 21 | 6.1993; 22.8971; 27.5542 90; 90; 90 | 3911.21 | McNamee, Ryan E.; Haugland, Marius M.; Nugent, Jeremy; Chan, Rachel; Christensen, Kirsten E.; Anderson, Edward A. Synthesis of 1,3-disubstituted bicyclo[1.1.0]butanes <i>via</i> directed bridgehead functionalization. Chemical science, 2021, 12, 7480-7485 |
| 1562170 | CIF | C17 H16 O2 S | P 1 21/n 1 | 5.9144; 16.5154; 14.7712 90; 95.2702; 90 | 1436.73 | McNamee, Ryan E.; Haugland, Marius M.; Nugent, Jeremy; Chan, Rachel; Christensen, Kirsten E.; Anderson, Edward A. Synthesis of 1,3-disubstituted bicyclo[1.1.0]butanes <i>via</i> directed bridgehead functionalization. Chemical science, 2021, 12, 7480-7485 |
| 1562171 | CIF | C17 H22 O4 | P 1 21 1 | 10.6905; 12.9017; 11.275 90; 99.604; 90 | 1533.32 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562172 | CIF | C18 H24 O4 | P 1 | 10.0882; 11.6472; 14.4851 101.004; 106.6; 96.185 | 1577.07 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562173 | CIF | C20 H28 O4 | P 1 21 1 | 8.7363; 7.5297; 13.3695 90; 90.32; 90 | 879.45 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562174 | CIF | C19 H24 O4 | P 1 21 1 | 8.1066; 17.4846; 11.7095 90; 90.935; 90 | 1659.49 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562175 | CIF | C18 H24 O4 | P 1 21 1 | 6.8205; 17.9401; 6.9699 90; 116.508; 90 | 763.18 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562176 | CIF | C16 H22 O4 | P 1 21 1 | 8.0972; 7.0855; 13.1638 90; 107.604; 90 | 719.875 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562177 | CIF | C46 H52 O8 | P 1 21 1 | 11.3066; 8.3782; 20.2485 90; 96.507; 90 | 1905.76 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562178 | CIF | C19 H26 O4 | P 1 21 1 | 9.2554; 19.3711; 10.2742 90; 115.9; 90 | 1657.02 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562179 | CIF | C78 H43 F48 O8 | P 1 21 1 | 10.533; 32.5011; 12.4209 90; 111.317; 90 | 3961.18 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562180 | CIF | C67 H102 O4 | P 21 21 21 | 17.7407; 27.9256; 27.9774 90; 90; 90 | 13860.5 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
| 1562181 | CIF HKL Paper | C30 H19 I N2 | P 1 21/n 1 | 9.5057; 29.3757; 16.5679 90; 96.127; 90 | 4599.9 | Yan, Dan 9-[3-(9<i>H</i>-Carbazol-9-yl)-5-iodophenyl]-9<i>H</i>-carbazole IUCrData, 2021, 6, x210428 |
| 1562223 | CIF | C100 H46 Ag12 Au F36 N13 | P -1 | 15.4163; 15.5079; 15.5847 61.591; 67.904; 61.997 | 2837 | Zheng, Ji; Wang, Jia-Nan; Wang, Ting; Wu, Kun; Wei, Rong-Jia; Lu, Weigang; Li, Dan Phosphorescent Metal Rotaxane-like Bimetallic Ag/Au Clusters The Journal of Physical Chemistry C, 2021 |
| 1562224 | CIF | C94 H38 Ag12.4 Au0.6 F44 N13 | P -1 | 15.3601; 15.6093; 15.6475 62.885; 67.963; 61.886 | 2883.2 | Zheng, Ji; Wang, Jia-Nan; Wang, Ting; Wu, Kun; Wei, Rong-Jia; Lu, Weigang; Li, Dan Phosphorescent Metal Rotaxane-like Bimetallic Ag/Au Clusters The Journal of Physical Chemistry C, 2021 |
| 1562225 | CIF | C228 H170 Ag24.4 Au1.6 F72 N26 O17 | P -1 | 15.21283; 16.46205; 27.06694 86.2278; 87.0958; 64.9064 | 6123.47 | Zheng, Ji; Wang, Jia-Nan; Wang, Ting; Wu, Kun; Wei, Rong-Jia; Lu, Weigang; Li, Dan Phosphorescent Metal Rotaxane-like Bimetallic Ag/Au Clusters The Journal of Physical Chemistry C, 2021 |
| 1562226 | CIF | C37 H57 Au Cl3 F6 N P Sb | P -1 | 10.1636; 11.2723; 20.036 79.592; 86.479; 65.966 | 2061.8 | Rodriguez, Jessica; Tabey, Alexis; Ladeira, Sonia; Bourissou, Didier Oxidative additions of alkynyl/vinyl iodides to gold and gold-catalyzed vinylation reactions triggered by the MeDalphos Ligand Chemical Science, 2021 |
| 1562227 | CIF | C30.5 H44 Au Cl2 F6 N P Sb | P -1 | 10.3795; 11.7433; 16.0874 80.093; 77.477; 65.482 | 1734.2 | Rodriguez, Jessica; Tabey, Alexis; Ladeira, Sonia; Bourissou, Didier Oxidative additions of alkynyl/vinyl iodides to gold and gold-catalyzed vinylation reactions triggered by the MeDalphos Ligand Chemical Science, 2021 |
| 1562228 | CIF | C36 H45 Au Cl F6 N P Sb | C 1 2/c 1 | 29.91; 9.8604; 28.71 90; 119.225; 90 | 7389.5 | Rodriguez, Jessica; Tabey, Alexis; Ladeira, Sonia; Bourissou, Didier Oxidative additions of alkynyl/vinyl iodides to gold and gold-catalyzed vinylation reactions triggered by the MeDalphos Ligand Chemical Science, 2021 |
| 1562229 | CIF | C33 H47 Au Cl F6 N O2 P Sb | P -1 | 10.1052; 14.6709; 14.9416 109.75; 101.005; 104.616 | 1922.4 | Rodriguez, Jessica; Tabey, Alexis; Ladeira, Sonia; Bourissou, Didier Oxidative additions of alkynyl/vinyl iodides to gold and gold-catalyzed vinylation reactions triggered by the MeDalphos Ligand Chemical Science, 2021 |
| 1562230 | CIF | C33 H47 Au Cl F6 N O2 P Sb | P 1 21/n 1 | 9.7524; 25.856; 14.5514 90; 106.77; 90 | 3513.2 | Rodriguez, Jessica; Tabey, Alexis; Ladeira, Sonia; Bourissou, Didier Oxidative additions of alkynyl/vinyl iodides to gold and gold-catalyzed vinylation reactions triggered by the MeDalphos Ligand Chemical Science, 2021 |
| 1562231 | CIF | C35 H35 Cl2 F3 N8 O3 S Zn | P 1 21/n 1 | 13.2525; 18.3533; 15.0527 90; 96.635; 90 | 3636.7 | Lauenstein, Raphael; Mader, Sophie L.; Derondeau, Henrieta; Esezobor, Oaikhena Z.; Block, Matthias; Römer, Armin J; Jandl, Christian; Riedle, Eberhard; Kaila, Ville R. I.; Hauer, Jürgen; Thyrhaug, Erling; Hess, Corinna R. The central role of the metal ion for photoactivity: Zn- <i>vs.</i> Ni-Mabiq. Chemical science, 2021, 12, 7521-7532 |
| 1562232 | CIF | C25 H27 N O5 S | P 1 21 1 | 9.954; 14.826; 15.404 90; 94.53; 90 | 2266.2 | Bin, Huai-Yu; Cheng, Li; Wu, Xiong; Zhu, Chang-Liang; Yang, Xiao-Hui; Xie, Jian-Hua; Zhou, Qi-Lin Asymmetric Hydrogenation of Exocyclic γ,δ-Unsaturated β-Ketoesters to Functionalized Chiral Allylic Alcohols via Dynamic Kinetic Resolution Chemical Science, 2021 |
| 1562233 | CIF | C15 H17 F O3 | P 21 21 21 | 8.2258; 11.1904; 14.7228 90; 90; 90 | 1355.23 | Bin, Huai-Yu; Cheng, Li; Wu, Xiong; Zhu, Chang-Liang; Yang, Xiao-Hui; Xie, Jian-Hua; Zhou, Qi-Lin Asymmetric Hydrogenation of Exocyclic γ,δ-Unsaturated β-Ketoesters to Functionalized Chiral Allylic Alcohols via Dynamic Kinetic Resolution Chemical Science, 2021 |
| 1562234 | CIF | C18 H19 N O2 | P 1 21 1 | 10.4741; 10.4866; 13.7315 90; 99.081; 90 | 1489.33 | Tak, Raj K.; Amemiya, Fuyuki; Noda, Hidetoshi; Shibasaki, Masakatsu Generation and application of Cu-bound alkyl nitrene for the catalyst-controlled synthesis of cyclic β-amino acids Chemical Science, 2021 |
| 1562235 | CIF | C97 H80 Cl2 O8 | P -1 | 12.9562; 14.7057; 21.804 96.529; 97.374; 110.822 | 3793.6 | Nogami, Juntaro; Nagashima, Yuki; Miyamoto, Kazunori; Muranaka, Atsuya; Uchiyama, Masanobu; Tanaka, Ken Asymmetric Synthesis, Structures, and Chiroptical Properties of Helical Cycloparaphenylenes Chemical Science, 2021 |
| 1562236 | CIF | C44 H29 In2 N O12 | P -1 | 11.241; 13.279; 18.002 86.469; 75.801; 81.052 | 2572.6 | Jindal, Swati; Anjum, Gulshan; Maka, Vijay Kumar; Moorthy, Jarugu Narasimha Mechanoluminescence and aggregation-enhanced emission (AEE) of an In-MOF based on a 9,9'-diphenyl-9<i>H</i>-fluorene tetraacid linker. Nanoscale, 2021, 13, 9668-9677 |
| 1562291 | CIF | C H13 Mn N2 O6 P3 | P n m a | 9.3794; 13.2922; 8.5672 90; 90; 90 | 1068.1 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562292 | CIF | C H13 Mn N2 O6 P3 | P n m a | 9.1707; 13.1949; 8.3574 90; 90; 90 | 1011.3 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562293 | CIF | C H13 Mn N2 O6 P3 | P n m a | 7.4791; 12.9833; 10.0993 90; 90; 90 | 980.7 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562294 | CIF | C H13 Mn N2 O6 P3 | P 1 21/n 1 | 10.2348; 7.272; 12.6997 90; 92.533; 90 | 944.3 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562295 | CIF | C H13 Mn N2 O6 P3 | P 1 21/n 1 | 10.2099; 7.229; 12.6741 90; 92.643; 90 | 934.4 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562296 | CIF | C H13 Mn N2 O6 P3 | P 1 21/n 1 | 10.1672; 7.163; 12.6123 90; 92.749; 90 | 917.5 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562297 | CIF | C H13 Mn N2 O6 P3 | P 1 21/n 1 | 10.115; 7.088; 12.613 90; 93.298; 90 | 902.8 | Mączka, Mirosław; Sobczak, Szymon; Kryś, Mikołaj; Leite, Fabio Furtado; Paraguassu, Waldeci; Katrusiak, Andrzej Mechanism of Pressure-Induced Phase Transitions and Structure‒Property Relations in Methylhydrazinium Manganese Hypophosphite Perovskites The Journal of Physical Chemistry C, 2021 |
| 1562298 | CIF | C22 H23 N O3 | P b c a | 17.998; 9.6252; 20.8083 90; 90; 90 | 3604.71 | Pooler, Daisy Rose Sherwood; Pierron, Robin; Crespi, Stefano; Costil, Romain; Pfeifer, Lukas; Léonard, Jérémie; Olivucci, Massimo; Feringa, Ben L. Effect of charge-transfer enhancement on the efficiency and rotary mechanism of an oxindole-based molecular motor Chemical Science, 2021 |
| 1562299 | CIF | C44 H39 Au Cl2 N2 O2 P2 | P 1 21/n 1 | 10.4749; 16.5319; 23.0359 90; 93.007; 90 | 3983.63 | Kim, Jong Hyun; Ofori, Samuel; Parkin, Sean; Vekaria, Hemendra; Sullivan, Patrick G.; Awuah, Samuel G. Anticancer gold(iii)-bisphosphine complex alters the mitochondrial electron transport chain to induce <i>in vivo</i> tumor inhibition. Chemical science, 2021, 12, 7467-7479 |
| 1562300 | CIF | C42 H32 Au Cl2 N O P2 | P -1 | 12.0282; 16.7453; 20.3891 97.253; 95.135; 90.405 | 4056.8 | Kim, Jong Hyun; Ofori, Samuel; Parkin, Sean; Vekaria, Hemendra; Sullivan, Patrick G.; Awuah, Samuel G. Anticancer gold(iii)-bisphosphine complex alters the mitochondrial electron transport chain to induce <i>in vivo</i> tumor inhibition. Chemical science, 2021, 12, 7467-7479 |
| 1562301 | CIF | C41 H33 Au Cl2 N2 P2 | P 1 21/n 1 | 10.4667; 16.4519; 23.6049 90; 96.182; 90 | 4041.06 | Kim, Jong Hyun; Ofori, Samuel; Parkin, Sean; Vekaria, Hemendra; Sullivan, Patrick G.; Awuah, Samuel G. Anticancer gold(iii)-bisphosphine complex alters the mitochondrial electron transport chain to induce <i>in vivo</i> tumor inhibition. Chemical science, 2021, 12, 7467-7479 |
| 1562302 | CIF | C44 H42 Au Cl2 N O2 P2 | P 21 21 21 | 13.5131; 16.8347; 18.5104 90; 90; 90 | 4210.91 | Kim, Jong Hyun; Ofori, Samuel; Parkin, Sean; Vekaria, Hemendra; Sullivan, Patrick G.; Awuah, Samuel G. Anticancer gold(iii)-bisphosphine complex alters the mitochondrial electron transport chain to induce <i>in vivo</i> tumor inhibition. Chemical science, 2021, 12, 7467-7479 |
| 1562339 | CIF | C40 H52 O11 | P 61 | 10.56998; 10.56998; 56.6723 90; 90; 120 | 5483.4 | Zhang, Dong-Li; Li, Min; Han, Gui-Fang; Li, Shao-Yong; Jin, De-Jun; Tang, Sheng-An Longipetalol A: A Highly Modified Triterpenoid from <i>Dichapetalum longipetalum</i>. Journal of natural products, 2021 |
| 1562340 | CIF | C210 H177 Au23 F12 N12 Sb2 | P -1 | 20.1518; 24.0064; 25.2448 61.645; 89.9897; 82.7479 | 10636.5 | Hirano, Koto; Takano, Shinjiro; Tsukuda, Tatsuya Ligand Effects on the Structures of [Au23L6(C≡CPh)9]2+ (L = N-Heterocyclic Carbene vs Phosphine) with Au17 Superatomic Cores The Journal of Physical Chemistry C, 2021 |
| 1562341 | CIF | C72 H162 K N2 O24 Si6 U2 | P -1 | 13.4396; 17.7067; 25.0094 80.0596; 88.3887; 71.629 | 5561.2 | Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides Chemical Science, 2021 |
| 1562342 | CIF | C80 H184 N2 O26 Si6 U2 | P 1 21 1 | 14.34057; 17.69858; 22.05 90; 91.5214; 90 | 5594.49 | Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides Chemical Science, 2021 |
| 1562343 | CIF | C76 H170 N2 O25 Si6 U2 | P 1 21 1 | 14.1108; 17.5538; 22.2467 90; 91.4964; 90 | 5508.59 | Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides Chemical Science, 2021 |
| 1562344 | CIF | C72 H162 I K2 N2 O24 Si6 U2 | P 1 21 1 | 13.9014; 18.1586; 22.0984 90; 92.822; 90 | 5571.5 | Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides Chemical Science, 2021 |
| 1562345 | CIF | C44 H97 Cl O14 Si3 U | C 1 c 1 | 24.6881; 14.15493; 38.5283 90; 107.29; 90 | 12855.6 | Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides Chemical Science, 2021 |
| 1562346 | CIF HKL Paper | C20 H36 N2 O2 | P 1 21/n 1 | 8.2294; 8.4573; 14.0115 90; 93.974; 90 | 972.83 | Schmitt, Volker; Holzmann, Gideon; Schollmeyer, Dieter; Detert, Heiner [2,5-Bis(dipropylamino)-4-(hydroxymethyl)phenyl]methanol IUCrData, 2021, 6, x210443 |
| 1562347 | CIF | C34 H42 O12 | C 1 2 1 | 24.152; 9.2708; 6.9096 90; 94.898; 90 | 1541.5 | Sadorn, Karoon; Saepua, Siriporn; Boonyuen, Nattawut; Choowong, Wilunda; Rachtawee, Pranee; Pittayakhajonwut, Pattama Bioactive Dimeric Tetrahydroxanthones with 2,2'- and 4,4'-Axial Linkages from the Entomopathogenic Fungus <i>Aschersonia confluens</i>. Journal of natural products, 2021, 84, 1149-1162 |
| 1562348 | CIF | C33.5 H40 O11.5 | P 1 | 11.938; 12.782; 12.925 118.386; 92.327; 114.237 | 1512.3 | Sadorn, Karoon; Saepua, Siriporn; Boonyuen, Nattawut; Choowong, Wilunda; Rachtawee, Pranee; Pittayakhajonwut, Pattama Bioactive Dimeric Tetrahydroxanthones with 2,2'- and 4,4'-Axial Linkages from the Entomopathogenic Fungus <i>Aschersonia confluens</i>. Journal of natural products, 2021, 84, 1149-1162 |
| 1562349 | CIF | C17 H16 N2 | P 1 21/c 1 | 15.9907; 11.3667; 15.9469 90; 114.149; 90 | 2644.87 | Jin, Pengfei; Zhan, Guanqun; Zheng, Guijuan; Liu, Junjun; Peng, Xiang; Huang, Lang; Gao, Biao; Yuan, Xinghua; Yao, Guangmin Gelstriamine A, a Triamino Monoterpene Indole Alkaloid with a Caged 6/5/7/6/6/5 Scaffold and Analgesic Alkaloids from <i>Gelsemium elegans</i> Stems. Journal of natural products, 2021, 84, 1326-1334 |
| 1562350 | CIF | C19 H28 O5 | P 21 21 21 | 8.7654; 12.6378; 15.3841 90; 90; 90 | 1704.18 | Cheng, Meimei; Li, Pinglin; Jiang, Yun; Tang, Xuli; Zhang, Wenjie; Wang, Qi; Li, Guoqiang Penitol A and Penicitols E-I: Citrinin Derivatives from <i>Penicillium citrinum</i> and the Structure Revision of Previously Proposed Analogues. Journal of natural products, 2021, 84, 1345-1352 |
| 1562351 | CIF | C38 H56 O10 | P 1 21 1 | 10.3283; 9.4323; 17.9581 90; 90.172; 90 | 1749.46 | Cheng, Meimei; Li, Pinglin; Jiang, Yun; Tang, Xuli; Zhang, Wenjie; Wang, Qi; Li, Guoqiang Penitol A and Penicitols E-I: Citrinin Derivatives from <i>Penicillium citrinum</i> and the Structure Revision of Previously Proposed Analogues. Journal of natural products, 2021, 84, 1345-1352 |
| 1562352 | CIF | C18 H16 F6 O2 | P b c a | 12.736; 5.824; 22.5026 90; 90; 90 | 1669.12 | Lv, Jinghuang; Chen, Si; Xu, Zhenchuang; Zhang, Siquan; Li, Ya; Zhao, Yanchuan Synthesis and Characterization of Diastereoisomeric Polyesters Derived from Bisphenols Bearing Vicinal Trifluoromethyl Groups Macromolecules, 2021, 54, 3716-3724 |
| 1562353 | CIF | C62.5 H75 Cl N4 | P 1 21/n 1 | 14.5082; 20.329; 37.5089 90; 97.29; 90 | 10973.3 | Man, Zhongwei; Cui, Hongtu; Lv, Zheng; Xu, Zhenzhen; Wu, Zhaoyang; Wu, Yishi; Liao, Qing; Liu, Meihui; Xi, Peng; Zheng, Lemin; Fu, Hongbing Organic Nanoparticles-Assisted Low-Power STED Nanoscopy. Nano letters, 2021, 21, 3487-3494 |
| 1562354 | CIF | C56 H62 N2 O14 Si10 | P 21 21 21 | 10.0808; 24.277; 25.8121 90; 90; 90 | 6317 | Ishida, Ayano; Fujii, Shunichi; Sumida, Akifumi; Kamitani, Tasuku; Minami, Saori; Urayama, Kenji; Imoto, Hiroaki; Naka, Kensuke Supramolecular organogel formation behaviors of beads-on-string shaped poly(azomethine)s dependent on POSS structures in the main chains Polymer Chemistry, 2021, 12, 3169-3176 |
| 1562355 | CIF | C59.25 H54.5 Br2 Cl2.5 N2 Ni | P 1 21/n 1 | 15.1086; 19.8115; 19.2127 90; 93.602; 90 | 5739.5 | Dai, Shengyu; Li, Gen; Lu, Weiqing; Liao, Yudan; Fan, Weigang Suppression of chain transfer via a restricted rotation effect of dibenzosuberyl substituents in polymerization catalysis Polymer Chemistry, 2021, 12, 3240-3249 |
| 1562356 | CIF | C71 H53 Cl N2 Pd | C 1 2/c 1 | 12.976; 19.5971; 23.93 90; 96.867; 90 | 6041.6 | Dai, Shengyu; Li, Gen; Lu, Weiqing; Liao, Yudan; Fan, Weigang Suppression of chain transfer via a restricted rotation effect of dibenzosuberyl substituents in polymerization catalysis Polymer Chemistry, 2021, 12, 3240-3249 |
| 1562357 | CIF | C59 H51 Cl N2 Pd | P 1 21/c 1 | 15.86; 16.3701; 18.8102 90; 106.03; 90 | 4693.8 | Dai, Shengyu; Li, Gen; Lu, Weiqing; Liao, Yudan; Fan, Weigang Suppression of chain transfer via a restricted rotation effect of dibenzosuberyl substituents in polymerization catalysis Polymer Chemistry, 2021, 12, 3240-3249 |
| 1562358 | CIF | C70 H52 Br2 N2 Ni | P -1 | 17.6855; 19.5147; 21.7741 66.138; 87.031; 70.111 | 6430.3 | Dai, Shengyu; Li, Gen; Lu, Weiqing; Liao, Yudan; Fan, Weigang Suppression of chain transfer via a restricted rotation effect of dibenzosuberyl substituents in polymerization catalysis Polymer Chemistry, 2021, 12, 3240-3249 |
| 1562359 | CIF | C32 H28 Cl6 N2 O2 Sb | P -1 | 7.9631; 10.0144; 11.2341 100.421; 95.385; 106.067 | 836.8 | Corbin, Daniel A.; McCarthy, Blaine G.; van de Lindt, Zach; Miyake, Garret M. Radical Cations of Phenoxazine and Dihydrophenazine Photoredox Catalysts and Their Role as Deactivators in Organocatalyzed Atom Transfer Radical Polymerization Macromolecules, 2021, 54, 4726-4738 |
| 1562360 | CIF | C46.5 H32 Cl7 N O Sb | P 1 21/n 1 | 11.6418; 18.8802; 18.9143 90; 91.686; 90 | 4155.6 | Corbin, Daniel A.; McCarthy, Blaine G.; van de Lindt, Zach; Miyake, Garret M. Radical Cations of Phenoxazine and Dihydrophenazine Photoredox Catalysts and Their Role as Deactivators in Organocatalyzed Atom Transfer Radical Polymerization Macromolecules, 2021, 54, 4726-4738 |
| 1562361 | CIF | C26 H16 Br3 F6 N2 | P -1 | 7.73; 10.3469; 16.7221 78.825; 77.881; 83.304 | 1278.83 | Corbin, Daniel A.; Puffer, Katherine O.; Chism, Katherine A.; Cole, Justin P.; Theriot, Jordan C.; McCarthy, Blaine G.; Buss, Bonnie L.; Lim, Chern-Hooi; Lincoln, Sarah R.; Newell, Brian S.; Miyake, Garret M. Radical Addition to N,N-Diaryl Dihydrophenazine Photoredox Catalysts and Implications in Photoinduced Organocatalyzed Atom Transfer Radical Polymerization Macromolecules, 2021, 54, 4507-4516 |
| 1562362 | CIF | C66 H56 F6 N2 O8 | P -1 | 6.5181; 14.7409; 16.2314 114.08; 93.91; 102.462 | 1368.8 | Corbin, Daniel A.; Puffer, Katherine O.; Chism, Katherine A.; Cole, Justin P.; Theriot, Jordan C.; McCarthy, Blaine G.; Buss, Bonnie L.; Lim, Chern-Hooi; Lincoln, Sarah R.; Newell, Brian S.; Miyake, Garret M. Radical Addition to N,N-Diaryl Dihydrophenazine Photoredox Catalysts and Implications in Photoinduced Organocatalyzed Atom Transfer Radical Polymerization Macromolecules, 2021, 54, 4507-4516 |
| 1562363 | CIF | C30 H30 Br N O2 | P 1 21 1 | 10.5345; 9.9038; 12.7437 90; 104.117; 90 | 1289.42 | Marfo-OWUSU, Emmanuel; THOMPSON, Amber L. The Crystal Structure of an Inclusion Complex of Benzyltrimethylammonium Bromide with (<i>R</i>)-(+)-1,1′-binaphthalene-2,2′-diol X-ray Structure Analysis Online, 2021, 37, 19-20 |
| 1562364 | CIF | C19 H15 N3 O | P n a 21 | 18.351; 17.574; 4.5721 90; 90; 90 | 1474.5 | SUDA, Shintaro; ONAMI, Yuika; HARAGUCHI, Tomoyuki; AKITSU, Takashiro Orthorhombic Polymorphism of 4-(2-Phenyldiazenyl)-2-[(phenylimino)methyl]phenol X-ray Structure Analysis Online, 2021, 37, 17-18 |
| 1562365 | CIF | B K1.78 Na1.22 O14 Si4 U | C m c e | 15.5471; 14.3403; 11.7315 90; 90; 90 | 2615.5 | Pace, Kristen A.; Klepov, Vladislav V.; Smith, Mark D.; Williams, Travis; Morrison, Gregory; Lauterbach, Jochen A.; Misture, Scott T.; zur Loye, Hans-Conrad Hydrothermal Synthesis and Structural Investigation of a Crystalline Uranyl Borosilicate Inorganics, 2021, 9, 25 |
| 1562366 | CIF | C40.5 H34 F6 N7 O4.5 P Ru | P 1 21/c 1 | 8.431; 35.524; 13.404 90; 99.315; 90 | 3962 | Shiga, Takuya; Tachibana, Minami; Oshio, Hiroki; Nihei, Masayuki Synthesis of a Ru(II) Complex with a Naphthoquinone-Annelated Imidazole Ligand Exhibiting Proton-Responsive Redox and Luminescent Behavior Inorganics, 2021, 9, 24 |
| 1562367 | CIF | C5 H12 N2 | I -4 2 d | 7.208; 7.208; 23.094 90; 90; 90 | 1199.9 | Aitken, R. Alan; Sonecha, Dheirya K.; Slawin, Alexandra M. Z. Homopiperazine (Hexahydro-1,4-diazepine) Molbank, 2021, 2021, M1200 |
| 1562368 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.878; 3.9147; 15.6886 90; 102.569; 90 | 472.24 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562369 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8846; 3.9372; 15.754 90; 102.594; 90 | 477.29 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562370 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8868; 3.9718; 15.822 90; 102.719; 90 | 483.46 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562371 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8876; 3.9434; 15.7578 90; 102.624; 90 | 478.28 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562372 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8728; 3.9608; 15.7845 90; 102.664; 90 | 480.23 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562373 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8758; 3.9534; 15.7573 90; 102.653; 90 | 478.71 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562374 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8702; 3.9302; 15.732 90; 102.573; 90 | 474.94 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562375 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8662; 3.966; 15.7823 90; 102.696; 90 | 480.33 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562376 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8729; 3.9195; 15.7126 90; 102.604; 90 | 473.17 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562377 | CIF | C14 H8 O2 | P 1 21/c 1 | 7.8864; 3.9488; 15.774 90; 102.624; 90 | 479.36 | Hu, Yajing; Yao, Yang-Rong; Liu, Xuechen; Yu, Ao; Xie, Xiao-Ming; Abella, Laura; Rodriguez-Fortea, Antonio; Poblet, Josep M.; Akasaka, Takeshi; Peng, Ping; Zhang, Qianyan; Xie, Su-Yuan; Li, Fang-Fang; Lu, Xing Unexpected Formation of 1,2- and 1,4-Bismethoxyl Sc3N@Ih-C80 Derivatives via Regioselective Anion Addition: Unambiguous Structural Identification and Mechanism Study Chemical Science, 2021 |
| 1562378 | CIF | C37 H47 N O4 S Si | P 1 21/n 1 | 16.6691; 10.8205; 20.3333 90; 112.297; 90 | 3393.3 | Feng, Qiang; Wu, An; Zhang, Xinhao; Song, Lijuan; Sun, Jianwei An Unusual Formal Migrative Cycloaddition of Aurone-derived Azadienes: Synthesis of Benzofuran-fused Nitrogen Heterocycles Chemical Science, 2021 |
| 1562379 | CIF | C28 H25 Cl2 N O4 S | P -1 | 10.7086; 10.8936; 11.8325 78.43; 66.115; 79.274 | 1227.96 | Feng, Qiang; Wu, An; Zhang, Xinhao; Song, Lijuan; Sun, Jianwei An Unusual Formal Migrative Cycloaddition of Aurone-derived Azadienes: Synthesis of Benzofuran-fused Nitrogen Heterocycles Chemical Science, 2021 |
| 1562380 | CIF | C28 H25 Br Cl N O4 S | P -1 | 10.7962; 10.9702; 11.8384 78.442; 65.815; 79.502 | 1245.21 | Feng, Qiang; Wu, An; Zhang, Xinhao; Song, Lijuan; Sun, Jianwei An Unusual Formal Migrative Cycloaddition of Aurone-derived Azadienes: Synthesis of Benzofuran-fused Nitrogen Heterocycles Chemical Science, 2021 |
| 1562381 | CIF | Lu Mn Na O6 W | P 1 21 1 | 5.34558; 5.55762; 7.87444 90; 90.2851; 90 | 233.936 | P N, Ravi Shankar; Panda, Debendra Prasad; Sundaresan, Athinarayanan Switchable and Nonswitchable Polarization in Doubly Ordered Perovskites NaLnCoWO6 (Ln = Er, Tm, Yb, and Lu) The Journal of Physical Chemistry C, 2021, 125, 10803-10809 |
| 1562382 | CIF | Co Lu Na O6 W | P 1 21 1 | 5.30219; 5.50632; 7.76771 90; 90.2633; 90 | 226.78 | P N, Ravi Shankar; Panda, Debendra Prasad; Sundaresan, Athinarayanan Switchable and Nonswitchable Polarization in Doubly Ordered Perovskites NaLnCoWO6 (Ln = Er, Tm, Yb, and Lu) The Journal of Physical Chemistry C, 2021, 125, 10803-10809 |
| 1562383 | CIF | Co Na O6 Tm W | P 1 21 1 | 5.32174; 5.51366; 7.77534 90; 90.2722; 90 | 228.144 | P N, Ravi Shankar; Panda, Debendra Prasad; Sundaresan, Athinarayanan Switchable and Nonswitchable Polarization in Doubly Ordered Perovskites NaLnCoWO6 (Ln = Er, Tm, Yb, and Lu) The Journal of Physical Chemistry C, 2021, 125, 10803-10809 |
| 1562384 | CIF | Co Na O6 W Yb | P 1 21 1 | 5.31027; 5.51156; 7.7711 90; 90.2794; 90 | 227.441 | P N, Ravi Shankar; Panda, Debendra Prasad; Sundaresan, Athinarayanan Switchable and Nonswitchable Polarization in Doubly Ordered Perovskites NaLnCoWO6 (Ln = Er, Tm, Yb, and Lu) The Journal of Physical Chemistry C, 2021, 125, 10803-10809 |
| 1562385 | CIF | Co Er Na O6 W | P 1 21 1 | 5.33407; 5.51959; 7.78263 90; 90.2676; 90 | 229.133 | P N, Ravi Shankar; Panda, Debendra Prasad; Sundaresan, Athinarayanan Switchable and Nonswitchable Polarization in Doubly Ordered Perovskites NaLnCoWO6 (Ln = Er, Tm, Yb, and Lu) The Journal of Physical Chemistry C, 2021, 125, 10803-10809 |
| 1562386 | CIF | C15 H20 Cl N O3 | P 21 21 21 | 9.5536; 10.5647; 15.067 90; 90; 90 | 1520.73 | Wang, Yuzhuo; Wang, Lei; Chen, Mingjie; Tu, Youshao; Liu, Yu; Zhang, Junliang Palladium/Xu-Phos-Catalyzed Asymmetric Carboamination towards Isoxazolidines and Pyrrolidines Chemical Science, 2021 |
| 1562387 | CIF | C42 H68 N O3 P S | P 21 21 21 | 13.7139; 14.6929; 20.8028 90; 90; 90 | 4191.7 | Wang, Yuzhuo; Wang, Lei; Chen, Mingjie; Tu, Youshao; Liu, Yu; Zhang, Junliang Palladium/Xu-Phos-Catalyzed Asymmetric Carboamination towards Isoxazolidines and Pyrrolidines Chemical Science, 2021 |
| 1562388 | CIF | C31 H31 N3 O6 S | P 1 21/n 1 | 20.0965; 5.88104; 26.5867 90; 98.87; 90 | 3104.7 | Pirenne, Vincent; Robert, Emma G. L.; Waser, Jerome Catalytic (3+2) Annulation of Donor-Acceptor Aminocyclopropane Monoesters and Indoles Chemical Science, 2021 |
| 1562389 | CIF | C26 H32 N2 O4 S | P 1 21/c 1 | 6.3612; 23.6708; 15.8181 90; 91.6343; 90 | 2380.84 | Pirenne, Vincent; Robert, Emma G. L.; Waser, Jerome Catalytic (3+2) Annulation of Donor-Acceptor Aminocyclopropane Monoesters and Indoles Chemical Science, 2021 |
| 1562390 | CIF | C16 H10 F6 O6 S2 | P -1 | 9.5762; 10.0978; 10.1439 87.983; 78.962; 69.485 | 901.15 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562391 | CIF | C16 H8 F6 O6 S2 | P -1 | 5.4457; 9.7022; 17.3622 84.758; 87.356; 74.878 | 881.63 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562392 | CIF | C39.5 H24 | P -1 | 10.1399; 11.8036; 12.2024 104.246; 90.62; 111.016 | 1313.5 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562393 | CIF | C36 H20 | P 1 21/n 1 | 10.03642; 20.42255; 12.53918 90; 111.752; 90 | 2387.14 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562394 | CIF | C105 H89 B4 N4 | P -1 | 14.4537; 14.7536; 20.5177 100.327; 98.165; 99.886 | 4172.5 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562395 | CIF | C54 H50 O4 | P 1 2/n 1 | 11.1578; 11.0555; 17.2821 90; 98.594; 90 | 2107.9 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562396 | CIF | C24 H22 O2 | P n a 21 | 11.74087; 32.1637; 9.77293 90; 90; 90 | 3690.55 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562397 | CIF | C104 H76 B4 N4 | P 1 21/c 1 | 14.0002; 40.895; 17.3331 90; 91.677; 90 | 9919.6 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562398 | CIF | C95.25 H84.87 B4 N9.62 | P b c a | 19.2454; 28.1544; 29.7705 90; 90; 90 | 16130.9 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562399 | CIF | C87.33 H78.66 B4 Cl6.66 N8 | P n a 21 | 23.0669; 22.8536; 15.375 90; 90; 90 | 8105.1 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562400 | CIF | C84 H76 B4 N10 | I 41/a :2 | 26.4901; 26.4901; 44.94 90; 90; 90 | 31535.5 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562401 | CIF | C52 H52 O5 | P -1 | 9.8376; 11.0362; 11.1225 89.252; 66.881; 74.852 | 1066.53 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene ‒ Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562402 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562403 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562404 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562405 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562406 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562407 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562408 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562409 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562410 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562411 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562412 | CIF | C10 N5 O0.5 Zn1.5 | P 1 21/c 1 | 13.654; 14.936; 14.311 90; 118.162; 90 | 2573 | Ge, Meng; Yang, Taimin; Wang, Yanzhi; Carraro, Francesco; Liang, Weibin; Doonan, Christian; Falcaro, Paolo; Zheng, Haoquan; Zou, Xiaodong; Huang, Zhehao On the completeness of three-dimensional electron diffraction data for structural analysis of metal-organic frameworks. Faraday discussions, 2021, 231, 66-80 |
| 1562413 | CIF | C13 H13 N O4 S2 | P 1 21/c 1 | 12.5382; 7.5215; 15.2868 90; 94.455; 90 | 1437.3 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
| 1562414 | CIF | C17 H15 N O4 S3 | I 1 2/c 1 | 19.992; 12.091; 30.161 90; 96.166; 90 | 7248 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
| 1562415 | CIF | C12 H10 O2 S | I 1 a 1 | 5.968; 7.371; 24.21 90; 94.51; 90 | 1061.7 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
| 1562416 | CIF | C10 H8 O2 S2 | P b c a | 14.212; 6.005; 23.945 90; 90; 90 | 2043.5 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
| 1562417 | CIF | C9 H6 O2 S2 | C 1 2/c 1 | 20.4772; 12.4117; 7.2775 90; 96.438; 90 | 1838 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
| 1562418 | CIF | C7 H4 Cl N S | P 21 21 21 | 5.802; 8.7244; 15.004 90; 90; 90 | 759.49 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
| 1562419 | CIF | C36 H29 N O2 | P -1 | 9.6146; 16.2601; 18.3252 110.783; 90.71; 101.904 | 2609.4 | Ran, You; Yang, Ge; Liu, Yang; Han, Weiguo; Gao, Ge; Su, Rongchuan; Bin, Zhengyang; You, Jingsong A methyl-shield strategy enables efficient blue thermally activated delayed fluorescence hosts for high-performance fluorescent OLEDs Materials Horizons, 2021, 8, 2025-2031 |
| 1562420 | CIF | C35 H27 N O2 | P 1 21/c 1 | 9.25345; 34.5061; 8.13039 90; 106.251; 90 | 2492.31 | Ran, You; Yang, Ge; Liu, Yang; Han, Weiguo; Gao, Ge; Su, Rongchuan; Bin, Zhengyang; You, Jingsong A methyl-shield strategy enables efficient blue thermally activated delayed fluorescence hosts for high-performance fluorescent OLEDs Materials Horizons, 2021, 8, 2025-2031 |
| 1562421 | CIF | C34 H25 N O2 | P 1 21/c 1 | 9.7712; 15.2854; 16.9918 90; 100.166; 90 | 2498 | Ran, You; Yang, Ge; Liu, Yang; Han, Weiguo; Gao, Ge; Su, Rongchuan; Bin, Zhengyang; You, Jingsong A methyl-shield strategy enables efficient blue thermally activated delayed fluorescence hosts for high-performance fluorescent OLEDs Materials Horizons, 2021, 8, 2025-2031 |
| 1562422 | CIF | C35 H27 N O2 | P -1 | 9.2312; 10.2169; 14.6844 76.439; 87.971; 67.26 | 1239.33 | Ran, You; Yang, Ge; Liu, Yang; Han, Weiguo; Gao, Ge; Su, Rongchuan; Bin, Zhengyang; You, Jingsong A methyl-shield strategy enables efficient blue thermally activated delayed fluorescence hosts for high-performance fluorescent OLEDs Materials Horizons, 2021, 8, 2025-2031 |
| 1562423 | CIF | C29 H42 O10 | P 1 21 1 | 18.8533; 7.0067; 21.3135 90; 98.186; 90 | 2786.81 | Stierle, Andrea A.; Stierle, Donald B.; Decato, Daniel; Alverson, Jeremy; Apedaile, Lily Cryptic Biosynthesis of the Berkeleypenostatins from Coculture of Extremophilic <i>Penicillium</i> sp. Journal of natural products, 2021, 84, 1656-1665 |
| 1562424 | CIF | C37 H27 Cr N O4 P2 | P 1 21/c 1 | 10.2734; 14.333; 21.7148 90; 99.339; 90 | 3155.09 | Wang, Zhichao; Liu, Lin; Ma, Xufeng; Liu, Yao; Mi, Puke; Liu, Zhen; Zhang, Jun Effect of an additional donor on decene formation in ethylene oligomerization catalyzed by a Cr/PCCP system: a combined experimental and DFT study Catalysis Science & Technology, 2021, 11, 4596-4604 |
| 1562425 | CIF | C57 H111 Na O12 Si6 Th | P -1 | 13.8938; 14.4588; 18.342 74.4602; 84.135; 83.5214 | 3517.3 | Wedal, Justin C.; Barlow, Jeffrey M.; Ziller, Joseph W.; Yang, Jenny Y.; Evans, William J. Electrochemical Studies of Tris(cyclopentadienyl) Thorium and Uranium Complexes in the +2, +3, and +4 Oxidation States Chemical Science, 2021 |
| 1562426 | CIF | C23 H45 K O6 Si2 | P 1 21/c 1 | 18.737; 18.571; 16.803 90; 90.149; 90 | 5847 | Wedal, Justin C.; Barlow, Jeffrey M.; Ziller, Joseph W.; Yang, Jenny Y.; Evans, William J. Electrochemical Studies of Tris(cyclopentadienyl) Thorium and Uranium Complexes in the +2, +3, and +4 Oxidation States Chemical Science, 2021 |
| 1562427 | CIF | C51 H99 Cs N2 O6 Si6 Th | P -1 | 12.1953; 12.7501; 22.2212 100.671; 104.376; 95.7421 | 3250.2 | Wedal, Justin C.; Barlow, Jeffrey M.; Ziller, Joseph W.; Yang, Jenny Y.; Evans, William J. Electrochemical Studies of Tris(cyclopentadienyl) Thorium and Uranium Complexes in the +2, +3, and +4 Oxidation States Chemical Science, 2021 |
| 1562428 | CIF | C51 H99 N2 O6 Rb Si6 Th | P -1 | 12.1971; 12.7473; 22.242 100.665; 104.473; 95.734 | 3251.6 | Wedal, Justin C.; Barlow, Jeffrey M.; Ziller, Joseph W.; Yang, Jenny Y.; Evans, William J. Electrochemical Studies of Tris(cyclopentadienyl) Thorium and Uranium Complexes in the +2, +3, and +4 Oxidation States Chemical Science, 2021 |
| 1562429 | CIF HKL Paper | C15 H14 Co F6 N2 P | P 1 c 1 | 9.961; 8.9243; 9.7204 90; 106.943; 90 | 826.59 | Menia, Daniel; Höfer, Thomas; Wurst, Klaus; Bildstein, Benno (Cobaltoceniumylamido)pyridinium hexafluoridophosphate IUCrData, 2021, 6 |
| 1562460 | CIF | C36 H48 B4 N16 Th | P 1 21/c 1 | 18.388; 11.1669; 22.459 90; 94.007; 90 | 4600.4 | DeJesus, Joseph F.; Kerr, Ryan W. F.; Penchoff, Deborah A.; Carroll, Xian B.; Peterson, Charles C.; Arnold, Polly L.; Jenkins, David M. Actinide tetra-N-heterocyclic carbene ‘sandwiches’ Chemical Science, 2021 |
| 1562461 | CIF | C40 H56 B4 N16 U | F d d d :2 | 14.118; 20.636; 37.423 90; 90; 90 | 10903 | DeJesus, Joseph F.; Kerr, Ryan W. F.; Penchoff, Deborah A.; Carroll, Xian B.; Peterson, Charles C.; Arnold, Polly L.; Jenkins, David M. Actinide tetra-N-heterocyclic carbene ‘sandwiches’ Chemical Science, 2021 |
| 1562462 | CIF | C36 H48 B4 N16 U | P 1 21/c 1 | 18.5705; 11.3097; 21.6322 90; 94.305; 90 | 4530.52 | DeJesus, Joseph F.; Kerr, Ryan W. F.; Penchoff, Deborah A.; Carroll, Xian B.; Peterson, Charles C.; Arnold, Polly L.; Jenkins, David M. Actinide tetra-N-heterocyclic carbene ‘sandwiches’ Chemical Science, 2021 |
| 1562463 | CIF | C17 H25 N3 O3 | P -1 | 8.9857; 10.0171; 11.6679 66.192; 82.839; 66.429 | 879.85 | Davern, Carolynn M.; Lowe, Brandon D.; Rosfi, Adam; Ison, Elon A.; Proulx, Caroline Submonomer Synthesis of Peptoids Containing trans-inducing N-imino- and N-alkylamino-glycines Chemical Science, 2021 |
| 1562464 | CIF | C16 H23 N3 O2 | P 1 21 1 | 6.0726; 9.9182; 26.154 90; 93.362; 90 | 1572.53 | Davern, Carolynn M.; Lowe, Brandon D.; Rosfi, Adam; Ison, Elon A.; Proulx, Caroline Submonomer Synthesis of Peptoids Containing trans-inducing N-imino- and N-alkylamino-glycines Chemical Science, 2021 |
| 1562465 | CIF | C16 H21 N3 O2 | P 1 21/c 1 | 5.0586; 27.489; 10.9711 90; 90.664; 90 | 1525.5 | Davern, Carolynn M.; Lowe, Brandon D.; Rosfi, Adam; Ison, Elon A.; Proulx, Caroline Submonomer Synthesis of Peptoids Containing trans-inducing N-imino- and N-alkylamino-glycines Chemical Science, 2021 |
| 1562466 | CIF | C17 H23 N3 O3 | P -1 | 5.0802; 11.6666; 14.355 101.704; 95.1179; 98.2498 | 818.32 | Davern, Carolynn M.; Lowe, Brandon D.; Rosfi, Adam; Ison, Elon A.; Proulx, Caroline Submonomer Synthesis of Peptoids Containing trans-inducing N-imino- and N-alkylamino-glycines Chemical Science, 2021 |
| 1562467 | CIF | C17 H22 F3 N3 O2 | P 1 21/c 1 | 6.1398; 9.9741; 28.544 90; 95.15; 90 | 1740.95 | Davern, Carolynn M.; Lowe, Brandon D.; Rosfi, Adam; Ison, Elon A.; Proulx, Caroline Submonomer Synthesis of Peptoids Containing trans-inducing N-imino- and N-alkylamino-glycines Chemical Science, 2021 |
| 1562468 | CIF | C17 H20 F3 N3 O2 | P -1 | 5.1066; 10.9857; 15.6081 105.298; 96.929; 91.011 | 837.29 | Davern, Carolynn M.; Lowe, Brandon D.; Rosfi, Adam; Ison, Elon A.; Proulx, Caroline Submonomer Synthesis of Peptoids Containing trans-inducing N-imino- and N-alkylamino-glycines Chemical Science, 2021 |
| 1562505 | CIF HKL Paper | C15 H16 O5 | P 1 21/n 1 | 11.4373; 9.2045; 13.9862 90; 112.03; 90 | 1364.89 | Mamadrakhimov, Azimjon; Mutalliyev, Luqmonjon; Abdullaev, Sirojiddin; Khodjaniyazov, Khamid; Izotova, Lidiya; Aisa, Haji Akber 8-Hydroxy-6-methoxy-7-(3-methylbut-2-enyloxy)coumarin (capensine) IUCrData, 2021, 6, x210451 |
| 1562538 | CIF | C20 H28 O4 | P 21 21 21 | 8.0711; 9.6743; 22.7439 90; 90; 90 | 1775.89 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
| 1562539 | CIF | C20 H26 O4 | P 21 21 21 | 9.622; 13.246; 13.922 90; 90; 90 | 1774.4 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
| 1562540 | CIF | C20 H28 O2 | P 1 21 1 | 14.195; 8.5829; 15.3489 90; 108.801; 90 | 1770.2 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
| 1562541 | CIF | C20 H28 O4 | P 21 21 21 | 10.1197; 13.3423; 14.0083 90; 90; 90 | 1891.4 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
| 1562542 | CIF | C21 H32 O6 | P 1 | 9.8531; 10.0264; 11.2177 96.693; 102.932; 106.655 | 1015.23 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
| 1562543 | CIF | C19 H26 O4 | P 21 21 21 | 7.447; 9.642; 23.098 90; 90; 90 | 1658.5 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
| 1562544 | CIF | C26 H34 O7 | P 21 21 21 | 10.3562; 10.6612; 19.9903 90; 90; 90 | 2207.1 | Nyamboki, Divinah K.; Bedane, Kibrom G.; Hassan, Khadija; Brieger, Lukas; Strohmann, Carsten; Spiteller, Michael; Matasyoh, Josphat C. Cytotoxic Compounds from the Stem Bark of Two subsp. of <i>Bersama abyssinica</i>. Journal of natural products, 2021, 84, 1453-1458 |
| 1562545 | CIF | C27 H38 O10 | P 1 21 1 | 7.1585; 16.5713; 10.8248 90; 102.657; 90 | 1252.89 | Nyamboki, Divinah K.; Bedane, Kibrom G.; Hassan, Khadija; Brieger, Lukas; Strohmann, Carsten; Spiteller, Michael; Matasyoh, Josphat C. Cytotoxic Compounds from the Stem Bark of Two subsp. of <i>Bersama abyssinica</i>. Journal of natural products, 2021, 84, 1453-1458 |
| 1562546 | CIF | C26 H32 O7 | P 1 21 1 | 12.1262; 14.4026; 13.3342 90; 105.607; 90 | 2242.9 | Nyamboki, Divinah K.; Bedane, Kibrom G.; Hassan, Khadija; Brieger, Lukas; Strohmann, Carsten; Spiteller, Michael; Matasyoh, Josphat C. Cytotoxic Compounds from the Stem Bark of Two subsp. of <i>Bersama abyssinica</i>. Journal of natural products, 2021, 84, 1453-1458 |
| 1562547 | CIF | C16 H13 N S2 | P n m a | 14.1113; 14.1996; 6.88839 90; 90; 90 | 1380.26 | Förtsch, Sebastian; Mena-Osteritz, Elena; Bäuerle, Peter Synthesis and characterization of β,β′-dimethylated dithieno[3,2-b:2′,3′-d]pyrroles and their corresponding regioregular conducting electropolymers Polymer Chemistry, 2021, 12, 3332-3345 |
| 1562548 | CIF | C33 H50 N2 Si2 Zr2 | P 1 21/c 1 | 16.1662; 12.7556; 16.3557 90; 96.7815; 90 | 3349.1 | Lindenau, Kevin; Jannsen, Nora; Rippke, Mirko; Al Hamwi, Hanan; Selle, Carmen; Drexler, Hans-Joachim; Spannenberg, Anke; Sawall, Mathias; Neymeyr, Klaus; Heller, Detlef; Reiß, Fabian; Beweries, Torsten Mechanistic insights into dehydrocoupling of amine boranes using dinuclear zirconocene complexes Catalysis Science & Technology, 2021, 11, 4034-4050 |
| 1562549 | CIF | C29 H40 Si2 Zr2 | P -1 | 8.4309; 8.6096; 10.3197 89.1575; 78.2307; 74.7766 | 706.99 | Lindenau, Kevin; Jannsen, Nora; Rippke, Mirko; Al Hamwi, Hanan; Selle, Carmen; Drexler, Hans-Joachim; Spannenberg, Anke; Sawall, Mathias; Neymeyr, Klaus; Heller, Detlef; Reiß, Fabian; Beweries, Torsten Mechanistic insights into dehydrocoupling of amine boranes using dinuclear zirconocene complexes Catalysis Science & Technology, 2021, 11, 4034-4050 |
| 1562550 | CIF | C33 H40 Si Zr2 | P 1 21/n 1 | 8.3405; 25.5764; 14.2103 90; 100.188; 90 | 2983.54 | Lindenau, Kevin; Jannsen, Nora; Rippke, Mirko; Al Hamwi, Hanan; Selle, Carmen; Drexler, Hans-Joachim; Spannenberg, Anke; Sawall, Mathias; Neymeyr, Klaus; Heller, Detlef; Reiß, Fabian; Beweries, Torsten Mechanistic insights into dehydrocoupling of amine boranes using dinuclear zirconocene complexes Catalysis Science & Technology, 2021, 11, 4034-4050 |
| 1562551 | CIF | C30.11 H41.33 Cl0.89 Si2 Zr2 | P -1 | 12.9147; 16.0454; 16.0971 73.455; 74.142; 82.668 | 3071.4 | Lindenau, Kevin; Jannsen, Nora; Rippke, Mirko; Al Hamwi, Hanan; Selle, Carmen; Drexler, Hans-Joachim; Spannenberg, Anke; Sawall, Mathias; Neymeyr, Klaus; Heller, Detlef; Reiß, Fabian; Beweries, Torsten Mechanistic insights into dehydrocoupling of amine boranes using dinuclear zirconocene complexes Catalysis Science & Technology, 2021, 11, 4034-4050 |
| 1562552 | CIF | C33 H52 N2 Zn | P 1 21 1 | 15.9444; 19.642; 19.6889 90; 90.009; 90 | 6166.17 | Grundy, Matthew; Yuan, Kang; Nichol, Gary Stephen; Ingleson, Michael James Zinc catalysed electrophilic C-H borylation of heteroarenes Chemical Science, 2021 |
| 1562553 | CIF | C15 H11 B Br N O2 | P 1 c 1 | 11.8776; 4.6452; 12.931 90; 113.246; 90 | 655.53 | Grundy, Matthew; Yuan, Kang; Nichol, Gary Stephen; Ingleson, Michael James Zinc catalysed electrophilic C-H borylation of heteroarenes Chemical Science, 2021 |
| 1562554 | CIF | C35 H48 B F6 N3 O6 S2 | P 1 21/c 1 | 19.26; 12.118; 19.857 90; 118.607; 90 | 4069 | Grundy, Matthew; Yuan, Kang; Nichol, Gary Stephen; Ingleson, Michael James Zinc catalysed electrophilic C-H borylation of heteroarenes Chemical Science, 2021 |
| 1562555 | CIF | Al24 K6.35 O96 P16.36 Si7.64 | I 2 3 | 14.4656; 14.4656; 14.4656 90; 90; 90 | 3026.98 | Wang, Xiaohe; Yan, Nana; Xie, Miao; Liu, Puxu; Bai, Pu; Su, Haopeng; Wang, Binyu; Wang, Yunzheng; Li, Libo; Cheng, Tao; Guo, Peng; Yan, Wenfu; Yu, Jihong The inorganic cation-tailored “trapdoor” effect of silicoaluminophosphate zeolite for highly selective CO2 separation Chemical Science, 2021, 12, 8803-8810 |
| 1562556 | CIF | Al24 Na7.9 O96 P16.36 Si7.64 | I 2 3 | 14.472; 14.472; 14.472 90; 90; 90 | 3031 | Wang, Xiaohe; Yan, Nana; Xie, Miao; Liu, Puxu; Bai, Pu; Su, Haopeng; Wang, Binyu; Wang, Yunzheng; Li, Libo; Cheng, Tao; Guo, Peng; Yan, Wenfu; Yu, Jihong The inorganic cation-tailored “trapdoor” effect of silicoaluminophosphate zeolite for highly selective CO2 separation Chemical Science, 2021, 12, 8803-8810 |
| 1562557 | CIF | Al24 Cs6.6 O96 P16.26 Si7.74 | I 2 3 | 14.6832; 14.6832; 14.6832 90; 90; 90 | 3165.64 | Wang, Xiaohe; Yan, Nana; Xie, Miao; Liu, Puxu; Bai, Pu; Su, Haopeng; Wang, Binyu; Wang, Yunzheng; Li, Libo; Cheng, Tao; Guo, Peng; Yan, Wenfu; Yu, Jihong The inorganic cation-tailored “trapdoor” effect of silicoaluminophosphate zeolite for highly selective CO2 separation Chemical Science, 2021, 12, 8803-8810 |
| 1562558 | CIF | Al24 Cs6.6 O157.98 P16.26 Si7.74 | I 2 3 | 14.6833; 14.6833; 14.6833 90; 90; 90 | 3165.71 | Wang, Xiaohe; Yan, Nana; Xie, Miao; Liu, Puxu; Bai, Pu; Su, Haopeng; Wang, Binyu; Wang, Yunzheng; Li, Libo; Cheng, Tao; Guo, Peng; Yan, Wenfu; Yu, Jihong The inorganic cation-tailored “trapdoor” effect of silicoaluminophosphate zeolite for highly selective CO2 separation Chemical Science, 2021, 12, 8803-8810 |
| 1562560 | CIF | C20 Cl9 Cu In N5 | C 1 2/c 1 | 32.2043; 7.6774; 34.1813 90; 107.203; 90 | 8073.1 | Connor, Bridget; Smaha, Rebecca; Li, Jiayi; Gold-Parker, Aryeh; Heyer, Alexander; Toney, Michael F.; Lee, Young; Karunadasa, Hemamala I. Alloying a Single and a Double Perovskite: A Cu+/2+ Mixed-Valence Layered Halide Perovskite with Strong Optical Absorption Chemical Science, 2021 |
| 1562561 | CIF | C16 Cl8 Cu1.55 In0.45 N4 | P -1 | 7.4458; 7.6348; 15.5065 89.97; 76.106; 89.921 | 855.71 | Connor, Bridget; Smaha, Rebecca; Li, Jiayi; Gold-Parker, Aryeh; Heyer, Alexander; Toney, Michael F.; Lee, Young; Karunadasa, Hemamala I. Alloying a Single and a Double Perovskite: A Cu+/2+ Mixed-Valence Layered Halide Perovskite with Strong Optical Absorption Chemical Science, 2021 |
| 1562562 | CIF | C12 H14 Cl6 Cu0.78 In0.22 N2 | P c c n | 7.4183; 32.1336; 7.259 90; 90; 90 | 1730.38 | Connor, Bridget; Smaha, Rebecca; Li, Jiayi; Gold-Parker, Aryeh; Heyer, Alexander; Toney, Michael F.; Lee, Young; Karunadasa, Hemamala I. Alloying a Single and a Double Perovskite: A Cu+/2+ Mixed-Valence Layered Halide Perovskite with Strong Optical Absorption Chemical Science, 2021 |
| 1562563 | CIF | C12 H14 Cl6 Cu0.83 In0.17 N2 | P 1 21/c 1 | 16.441; 7.5928; 7.313 90; 102.684; 90 | 890.63 | Connor, Bridget; Smaha, Rebecca; Li, Jiayi; Gold-Parker, Aryeh; Heyer, Alexander; Toney, Michael F.; Lee, Young; Karunadasa, Hemamala I. Alloying a Single and a Double Perovskite: A Cu+/2+ Mixed-Valence Layered Halide Perovskite with Strong Optical Absorption Chemical Science, 2021 |
| 1562564 | CIF HKL | C22 H23 N3 O2 | P -1 | 8.4465; 10.296; 12.1699 91.24; 95.072; 92.102 | 1053.17 | Sivapriya, S.; Priyanka, S.; Gopalakrishnan, M.; Manikandan, H.; Selvanayagam, S. Ethyl 2-cyano-2-{(<i>Z</i>)-2-[2,2-dicyano-1-(4-methylphenyl)ethyl]cyclohexylidene}acetate IUCrData, 2021, 6, x210500 |
| 1562619 | CIF | C21 H16 N4 O5 S | P 21 21 21 | 7.345; 11.5313; 23.7692 90; 90; 90 | 2013.2 | Mondal, Bivas; Maiti, Rakesh; Yang, Xing; Xu, Jun; Tian, Weiyi; Yan, Jialei; Li, Xiangyang; Chi, Yonggui Robin Carbene-Catalyzed Enantioselective Annulation of Dinucleophilic Hydrazones and Bromoenals for Access to Aryl-Dihydropyridazinones and Related Drugs Chemical Science, 2021 |
| 1562620 | CIF | C5 H14 B3 F12 K N2 | P b c 21 | 10.2792; 9.3759; 14.5388 90; 90; 90 | 1401.2 | Chen, Xiao-Xian; Zhang, X. Y.; Liu, De-Xuan; Huang, Rui-Kang; Wang, Sha-Sha; Xiong, Li-Qun; Zhang, Wei-Xiong; Chen, Xiao-Ming Room-temperature ferroelectric and ferroelastic orders coexisting in a new tetrafluoroborate-based perovskite Chemical Science, 2021 |
| 1562621 | CIF | C5 H14 B3 F12 K N2 | C m c m | 10.568; 9.929; 14.249 90; 90; 90 | 1495.1 | Chen, Xiao-Xian; Zhang, X. Y.; Liu, De-Xuan; Huang, Rui-Kang; Wang, Sha-Sha; Xiong, Li-Qun; Zhang, Wei-Xiong; Chen, Xiao-Ming Room-temperature ferroelectric and ferroelastic orders coexisting in a new tetrafluoroborate-based perovskite Chemical Science, 2021 |
| 1562622 | CIF | C5 H14 B3 F12 K N2 | P b c m | 10.5005; 9.7685; 14.0216 90; 90; 90 | 1438.25 | Chen, Xiao-Xian; Zhang, X. Y.; Liu, De-Xuan; Huang, Rui-Kang; Wang, Sha-Sha; Xiong, Li-Qun; Zhang, Wei-Xiong; Chen, Xiao-Ming Room-temperature ferroelectric and ferroelastic orders coexisting in a new tetrafluoroborate-based perovskite Chemical Science, 2021 |
| 1562623 | CIF | C5 H14 B3 F12 K N2 | P m -3 m | 7.2964; 7.2964; 7.2964 90; 90; 90 | 388.44 | Chen, Xiao-Xian; Zhang, X. Y.; Liu, De-Xuan; Huang, Rui-Kang; Wang, Sha-Sha; Xiong, Li-Qun; Zhang, Wei-Xiong; Chen, Xiao-Ming Room-temperature ferroelectric and ferroelastic orders coexisting in a new tetrafluoroborate-based perovskite Chemical Science, 2021 |
| 1562624 | CIF | C79 H62 B Cl2 F4 N2 O4 Os P3 | P -1 | 13.0037; 13.1533; 22.7428 99.03; 103.602; 101.623 | 3617.03 | Lin, Xusheng; Xie, Weiwei; Lin, Qin; Cai, Yuanting; Hua, Yuhui; Lin, Jianfeng; He, Guomei; Chen, Jiangxi NIR-responsive metal-containing polymer hydrogel for light-controlled microvalve Polymer Chemistry, 2021, 12, 3375-3382 |
| 1562675 | CIF | C9 H17 Br3 N2 Pb | P 1 21/c 1 | 11.434; 16.592; 7.918 90; 101.679; 90 | 1471 | Zhao, Jian-Qiang; Jing, Chang-Qing; Wu, Jia-Hang; Zhang, Wei-Feng; Feng, Li-Juan; Yue, Cheng-Yang; Lei, Xiao-Wu Systematic Approach of One-Dimensional Lead Perovskites with Face-Sharing Connectivity to Realize Efficient and Tunable Broadband Light Emission The Journal of Physical Chemistry C, 2021, 125, 10850-10859 |
| 1562676 | CIF | C6 H12 Br3 N2 Pb | P n m a | 7.941; 9.783; 16.168 90; 90; 90 | 1256 | Zhao, Jian-Qiang; Jing, Chang-Qing; Wu, Jia-Hang; Zhang, Wei-Feng; Feng, Li-Juan; Yue, Cheng-Yang; Lei, Xiao-Wu Systematic Approach of One-Dimensional Lead Perovskites with Face-Sharing Connectivity to Realize Efficient and Tunable Broadband Light Emission The Journal of Physical Chemistry C, 2021, 125, 10850-10859 |
| 1562677 | CIF | C7 H12 Br3 N2 Pb | P b c a | 17.6424; 7.7315; 19.1592 90; 90; 90 | 2613.36 | Zhao, Jian-Qiang; Jing, Chang-Qing; Wu, Jia-Hang; Zhang, Wei-Feng; Feng, Li-Juan; Yue, Cheng-Yang; Lei, Xiao-Wu Systematic Approach of One-Dimensional Lead Perovskites with Face-Sharing Connectivity to Realize Efficient and Tunable Broadband Light Emission The Journal of Physical Chemistry C, 2021, 125, 10850-10859 |
| 1562678 | CIF | C10 H23 Br3 N2 O Pb | P 1 21/c 1 | 10.2578; 23.1688; 7.7621 90; 101.481; 90 | 1807.8 | Zhao, Jian-Qiang; Jing, Chang-Qing; Wu, Jia-Hang; Zhang, Wei-Feng; Feng, Li-Juan; Yue, Cheng-Yang; Lei, Xiao-Wu Systematic Approach of One-Dimensional Lead Perovskites with Face-Sharing Connectivity to Realize Efficient and Tunable Broadband Light Emission The Journal of Physical Chemistry C, 2021, 125, 10850-10859 |
| 1562679 | CIF | C9 H6 Cl2 I N3 S | I b a 2 | 29.5021; 9.0794; 9.482 90; 90; 90 | 2539.86 | Hess, Andreas; Prohaska, Jan Philip; Doerrich, Sabrina Bettina; Trauner, Florian; Lutter, Ferdinand Hermann; Lemaire, Sébastien; Wagschal, Simon; Karaghiosoff, Konstantin; Knochel, Paul Directed Regioselective ortho,ortho’-Magnesiations of Aromatics and Heterocycles using sBu2Mg in Toluene Chemical Science, 2021 |
| 1562680 | CIF | C21 H24 Br N3 O5 Si | P -1 | 8.0355; 11.4221; 13.059 105.984; 104.098; 96.492 | 1096.49 | Hess, Andreas; Prohaska, Jan Philip; Doerrich, Sabrina Bettina; Trauner, Florian; Lutter, Ferdinand Hermann; Lemaire, Sébastien; Wagschal, Simon; Karaghiosoff, Konstantin; Knochel, Paul Directed Regioselective ortho,ortho’-Magnesiations of Aromatics and Heterocycles using sBu2Mg in Toluene Chemical Science, 2021 |
| 1562681 | CIF | C222 H202 N9 O28 Pt2 | P -1 | 18.7348; 21.8196; 27.4073 93.167; 101.052; 107.422 | 10415.3 | Sumida, Ryuki; Tanaka, Yuya; Niki, Keita; Sei, Yoshihisa; Toyota, Shinji; Yoshizawa, Michito Cyclic Monoterpenes Trapped in a Polyaromatic Capsule: Unusual Selectivity, Isomerization, and Volatility Suppression Chemical Science, 2021 |
| 1562682 | CIF | C215.33 H189.33 N10 O30.5 Pt2 | P -1 | 18.6373; 22.054; 27.1149 93.016; 101.669; 106.888 | 10369.9 | Sumida, Ryuki; Tanaka, Yuya; Niki, Keita; Sei, Yoshihisa; Toyota, Shinji; Yoshizawa, Michito Cyclic Monoterpenes Trapped in a Polyaromatic Capsule: Unusual Selectivity, Isomerization, and Volatility Suppression Chemical Science, 2021 |
| 1562683 | CIF HKL | C30 H38 Cu2 N4 O19 | I 1 2/m 1 | 8.8717; 18.8801; 9.9362 90; 100.916; 90 | 1634.19 | Nour Dissem; Prabhjyot Kaur; Love Karan Rana; Thierry Maris; Adam Duong Synthesis, characterization and Hirshfeld surface analysis of a mixed-ligand copper (II) coordination polymer from 1,4,8,11-tetraazacyclotetradecane and pyromellitic dianhydride Transition Metal Chemistry, 2021, 46, 283-290 |
| 1562684 | CIF | C24 H20 Cl3 N4 O0.6 | P -1 | 7.047; 8.9611; 9.4376 76.52; 71.24; 86.47 | 548.7 | Koo, Jin Young; Kwon, Taeyeon; Ahn, Yoolim; Choi, Hee Cheul Phase Change-Driven Radical Population and Electrical Conductivity Increases of Organic Radical Crystals by Mild Heating The Journal of Physical Chemistry C, 2021, 125, 10991-10997 |
| 1562685 | CIF | C12 H10 Cl1.19 N2 O0.4 | C 1 2/m 1 | 7.0475; 27.97; 11.386 90; 102.511; 90 | 2191.1 | Koo, Jin Young; Kwon, Taeyeon; Ahn, Yoolim; Choi, Hee Cheul Phase Change-Driven Radical Population and Electrical Conductivity Increases of Organic Radical Crystals by Mild Heating The Journal of Physical Chemistry C, 2021, 125, 10991-10997 |
| 1562686 | CIF | C90 H54 Br6 I2 N12 O12 | P 1 21/n 1 | 12.102; 23.347; 31.702 90; 99.798; 90 | 8827 | Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao A water-soluble naphthalenediimide-containing hexacationic cage. Chemical communications (Cambridge, England), 2021, 57, 6074-6077 |
| 1562687 | CIF | C90 H60 Br6 N12 O15 | P 1 21 1 | 14.159; 23.995; 14.229 90; 104.068; 90 | 4689 | Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao A water-soluble naphthalenediimide-containing hexacationic cage. Chemical communications (Cambridge, England), 2021, 57, 6074-6077 |
| 1562688 | CIF | C90 H54 Br2 I6 N12 O12 | P 1 21/n 1 | 12.1313; 23.4871; 31.769 90; 99.44; 90 | 8929.3 | Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao A water-soluble naphthalenediimide-containing hexacationic cage. Chemical communications (Cambridge, England), 2021, 57, 6074-6077 |
| 1562689 | CIF | C150 H108 Br6 N12 O27 | P -1 | 14.4602; 21.9065; 25.836 106.98; 100.14; 109.181 | 7049.7 | Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao A water-soluble naphthalenediimide-containing hexacationic cage. Chemical communications (Cambridge, England), 2021, 57, 6074-6077 |
| 1562690 | CIF | C233 H147 Br12 N24 O49 | P -1 | 21.62; 25.189; 26.682 99.495; 108.239; 105.86 | 12767 | Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao A water-soluble naphthalenediimide-containing hexacationic cage. Chemical communications (Cambridge, England), 2021, 57, 6074-6077 |
| 1562691 | CIF | C100 H65 Br6 N12 O15 | C 1 2 1 | 18.8016; 21.9859; 28.453 90; 108.666; 90 | 11143 | Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao A water-soluble naphthalenediimide-containing hexacationic cage. Chemical communications (Cambridge, England), 2021, 57, 6074-6077 |
| 1562692 | CIF | C126 H108 O24 | P -1 | 15.46; 17.12; 20.31 76.74; 69.11; 72.2 | 4737.81 | Fernandez-Bartolomé, Estefania; Gamonal, Arturo; Santos, Jose; Khodabakhshi, Saeed; Rodriguez, Eider; Sañudo, E. Carolina; Martín, Nazario; Sanchez Costa, Jose Playing with the Weakest Supramolecular Interactions in a 3D Crystalline Hexakis[60]Fullerene Induces Control over Hydrogenation Selectivity Chemical Science, 2021 |
| 1562693 | CIF | C126 H108 O24 | P -1 | 15.48; 17.08; 20.49 77.04; 69.9; 71.44 | 4782.64 | Fernandez-Bartolomé, Estefania; Gamonal, Arturo; Santos, Jose; Khodabakhshi, Saeed; Rodriguez, Eider; Sañudo, E. Carolina; Martín, Nazario; Sanchez Costa, Jose Playing with the Weakest Supramolecular Interactions in a 3D Crystalline Hexakis[60]Fullerene Induces Control over Hydrogenation Selectivity Chemical Science, 2021 |
| 1562694 | CIF | C94 H56 Eu2 F18 N6 O16 S6 | C 1 2/c 1 | 36.038; 19.4536; 14.1461 90; 109.424; 90 | 9352.9 | Suko, Natsumi; Itamoto, Hideki; Okayasu, Yoshinori; Okura, Naoya; Yuasa, Junpei Helix-mediated over 1 nm-range chirality recognition by ligand-to-ligand interactions of dinuclear helicates Chemical Science, 2021 |
| 1562695 | CIF | C52 H32 Fe2 | P 1 21/c 1 | 10.6986; 10.1128; 15.0273 90; 94.84; 90 | 1620.05 | Metzelaars, Marvin; Schneider, Claus M.; Rawson, Jeff; Bürgler, Daniel E.; Sanz, Sergio; Matthes, Frank; Kögerler, Paul; Hattori, Takuma; Schleicher, Sebastian; Borca, Bogdana Cyclophane with Eclipsed Pyrene Units Enables Construction of Spin Interfaces with Chemical Accuracy Chemical Science, 2021 |
| 1562696 | CIF | C36 H26 Fe2 | P 1 21/c 1 | 11.1819; 7.9345; 14.519 90; 100.936; 90 | 1264.77 | Metzelaars, Marvin; Schneider, Claus M.; Rawson, Jeff; Bürgler, Daniel E.; Sanz, Sergio; Matthes, Frank; Kögerler, Paul; Hattori, Takuma; Schleicher, Sebastian; Borca, Bogdana Cyclophane with Eclipsed Pyrene Units Enables Construction of Spin Interfaces with Chemical Accuracy Chemical Science, 2021 |
| 1562742 | CIF | C68 H100 F4 N6 O21 S4 | C 1 2 1 | 32.412; 6.476; 23.549 90; 132.313; 90 | 3655 | Zhang, Dongfeng; Li, Peng; Gao, Yongxin; Song, Yaoyao; Zhu, Yaqin; Su, Hong; Yang, Beibei; Li, Li; Li, Gang; Gong, Ningbo; Lu, Yang; Shao, Huanjie; Yu, Chunrong; Huang, Haihong Discovery of a Candidate Containing an (S)-3,3-Difluoro-1-(4-methylpiperazin-1-yl)-2,3-dihydro-1H-inden Scaffold as a Highly Potent Pan-Inhibitor of the BCR-ABL Kinase Including the T315I-Resistant Mutant for the Treatment of Chronic Myeloid Leukemia Journal of Medicinal Chemistry, 2021 |
| 1562743 | CIF | C17 H24 O5 | P 1 21 1 | 5.9932; 14.6831; 19.3382 90; 94.406; 90 | 1696.71 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
| 1562744 | CIF | C34 H54 O13 | C 2 2 21 | 7.7064; 37.225; 12.4547 90; 90; 90 | 3572.9 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
| 1562745 | CIF | C18 H26 O5 | P 21 21 21 | 8.7335; 12.167; 16.1121 90; 90; 90 | 1712.08 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
| 1562746 | CIF | C17 H26 O6 | P 21 21 21 | 6.0582; 12.5066; 22.5946 90; 90; 90 | 1711.94 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
| 1562747 | CIF | C17 H22 O6 | P 21 21 21 | 6.1916; 13.7904; 18.8869 90; 90; 90 | 1612.65 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
| 1562748 | CIF | C15 H22 O4 | P 1 21 1 | 6.3429; 12.3949; 8.7256 90; 99.915; 90 | 675.76 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
| 1562749 | CIF | C15 H24 O3 | P 21 21 2 | 12.1025; 16.7657; 7.1219 90; 90; 90 | 1445.08 | Wang, Xing; Peng, Xia; Tang, Chunping; Zhou, Shuaizhen; Ke, Chang-Qiang; Liu, Yueling; Yao, Sheng; Ai, Jing; Ye, Yang Anti-inflammatory Eudesmane Sesquiterpenoids from <i>Artemisia hedinii</i>. Journal of natural products, 2021, 84, 1626-1637 |
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