Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1566280 | CIF | C20 H14 N2 O S | P 1 21/c 1 | 15.662; 10.0274; 10.2923 90; 104.545; 90 | 1564.59 | Gao, Yang; Yang, Simin; She, Minwei; Nie, Jianhong; Huo, Yanping; Chen, Qian; Li, Xianwei; Hu, Xiao-Qiang Practical synthesis of 3-aryl anthranils via an electrophilic aromatic substitution strategy Chemical Science, 2022 |
| 1566281 | CIF | C43 H62 F6 N4 O5.5 P | P -1 | 13.1015; 13.9905; 14.3129 103.697; 99.4485; 117.548 | 2142.83 | Guillou, Amaury; Nisli, Eda; Klingler, Simon; Linden, Anthony; Holland, Jason P. Photoactivatable Fluorescent Tags for Dual-Modality Positron Emission Tomography Optical Imaging. Journal of medicinal chemistry, 2022, 65, 811-823 |
| 1566282 | CIF | C32 H34 O11 | P 1 | 7.3468; 9.587; 10.3986 71.686; 80.813; 86.65 | 686.37 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566283 | CIF | C33 H40 O14 | P 1 | 7.2806; 9.8268; 11.0309 85.062; 88.911; 86.614 | 784.83 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566284 | CIF | C32 H34 O12 | P 1 21 1 | 14.3066; 7.5865; 14.8171 90; 113.339; 90 | 1476.62 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566285 | CIF | C36 H42 O14 | P 21 21 21 | 7.4273; 17.5037; 25.5651 90; 90; 90 | 3323.6 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566286 | CIF | C36 H42 O14 | P 1 21 1 | 10.0366; 10.7583; 15.9163 90; 95.435; 90 | 1710.86 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566287 | CIF | C32 H34 O12 | P 21 21 21 | 7.8346; 15.3938; 24.8916 90; 90; 90 | 3002.03 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566288 | CIF | C32 H34 O11 | P 21 21 21 | 7.03918; 16.93129; 24.57803 90; 90; 90 | 2929.27 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566289 | CIF | C34 H40 O12 S | P 1 21 1 | 12.3621; 11.0513; 13.3183 90; 110.977; 90 | 1698.92 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566290 | CIF | C32 H34 O12 | P 1 21 1 | 7.9321; 10.0348; 18.6923 90; 91.815; 90 | 1487.11 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566291 | CIF | C32 H34 O12 | P 1 21 1 | 8.0867; 10.26; 17.8397 90; 100.578; 90 | 1455 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566292 | CIF | C32 H34 O12 | P 21 21 21 | 6.7227; 17.5115; 24.9638 90; 90; 90 | 2938.85 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
| 1566293 | CIF | C26 H30 O9 | P 21 21 21 | 8.20954; 13.0261; 22.2179 90; 90; 90 | 2375.94 | Wu, Yu-Zhuo; Xia, Gui-Yang; Xia, Huan; Wang, Ling-Yan; Wang, Ya-Nan; Li, Li; Shang, Hong-Cai; Lin, Sheng <i>Seco</i> and Nor-<i>seco</i> Isodhilarane-Type Meroterpenoids from <i>Penicillium purpurogenum</i> and the Configuration Revisions of Related Compounds. Journal of natural products, 2022, 85, 248-255 |
| 1566294 | CIF | C26 H30 O8 | P 21 21 21 | 9.14014; 13.23545; 19.4513 90; 90; 90 | 2353.1 | Wu, Yu-Zhuo; Xia, Gui-Yang; Xia, Huan; Wang, Ling-Yan; Wang, Ya-Nan; Li, Li; Shang, Hong-Cai; Lin, Sheng <i>Seco</i> and Nor-<i>seco</i> Isodhilarane-Type Meroterpenoids from <i>Penicillium purpurogenum</i> and the Configuration Revisions of Related Compounds. Journal of natural products, 2022, 85, 248-255 |
| 1566295 | CIF | C24 H26 O9 | P 21 21 21 | 11.2389; 12.4074; 15.325 90; 90; 90 | 2137 | Wu, Yu-Zhuo; Xia, Gui-Yang; Xia, Huan; Wang, Ling-Yan; Wang, Ya-Nan; Li, Li; Shang, Hong-Cai; Lin, Sheng <i>Seco</i> and Nor-<i>seco</i> Isodhilarane-Type Meroterpenoids from <i>Penicillium purpurogenum</i> and the Configuration Revisions of Related Compounds. Journal of natural products, 2022, 85, 248-255 |
| 1566296 | CIF | C28 H44 O7 | P 1 21 1 | 11.6684; 8.063; 29.5996 90; 98.518; 90 | 2754.08 | Zhang, Xiuyun; Liu, Yao; Deng, Jili; Xia, Jiankai; Zhang, Qiang; Chen, Xin; Liu, Runze; Gao, Yuqi; Gao, Jin-Ming Structurally Diverse Sesquiterpenoid Glycoside Esters from <i>Pittosporum qinlingense</i> with Anti-neuroinflammatory Activity. Journal of natural products, 2022, 85, 115-126 |
| 1566297 | CIF | C16 H18 O4 | P 1 21 1 | 4.705; 12.2221; 12.1951 90; 99.486; 90 | 691.69 | Chen, De-Li; Chen, Mei-Ying; Hou, Yong; Wang, Can-Hong; Sun, Zhao-Cui; Yang, Yun; Liang, Han-Qiao; Ma, Guo-Xu; Xu, Xu-Dong; Wei, Jian-He Cadinane-Type Sesquiterpenoids with Cytotoxic Activity from the Infected Stems of the Semi-mangrove <i>Hibiscus tiliaceus</i>. Journal of natural products, 2022, 85, 127-135 |
| 1566298 | CIF | C18 H24 O3 | P 1 21 1 | 5.832; 11.0477; 24.6078 90; 93.38; 90 | 1582.73 | Chen, De-Li; Chen, Mei-Ying; Hou, Yong; Wang, Can-Hong; Sun, Zhao-Cui; Yang, Yun; Liang, Han-Qiao; Ma, Guo-Xu; Xu, Xu-Dong; Wei, Jian-He Cadinane-Type Sesquiterpenoids with Cytotoxic Activity from the Infected Stems of the Semi-mangrove <i>Hibiscus tiliaceus</i>. Journal of natural products, 2022, 85, 127-135 |
| 1566299 | CIF | C16 H18 O4 | I 1 2/a 1 | 15.851; 9.869; 17.994 90; 92.952; 90 | 2811.1 | Chen, De-Li; Chen, Mei-Ying; Hou, Yong; Wang, Can-Hong; Sun, Zhao-Cui; Yang, Yun; Liang, Han-Qiao; Ma, Guo-Xu; Xu, Xu-Dong; Wei, Jian-He Cadinane-Type Sesquiterpenoids with Cytotoxic Activity from the Infected Stems of the Semi-mangrove <i>Hibiscus tiliaceus</i>. Journal of natural products, 2022, 85, 127-135 |
| 1566300 | CIF | C14 H14 O4 | P 1 21/c 1 | 14.0059; 12.3372; 7.0592 90; 100.903; 90 | 1197.77 | Chen, De-Li; Chen, Mei-Ying; Hou, Yong; Wang, Can-Hong; Sun, Zhao-Cui; Yang, Yun; Liang, Han-Qiao; Ma, Guo-Xu; Xu, Xu-Dong; Wei, Jian-He Cadinane-Type Sesquiterpenoids with Cytotoxic Activity from the Infected Stems of the Semi-mangrove <i>Hibiscus tiliaceus</i>. Journal of natural products, 2022, 85, 127-135 |
| 1566301 | CIF | C14 H16 O3 | P 1 21/c 1 | 14.155; 9.2926; 18.6842 90; 106.042; 90 | 2361.96 | Chen, De-Li; Chen, Mei-Ying; Hou, Yong; Wang, Can-Hong; Sun, Zhao-Cui; Yang, Yun; Liang, Han-Qiao; Ma, Guo-Xu; Xu, Xu-Dong; Wei, Jian-He Cadinane-Type Sesquiterpenoids with Cytotoxic Activity from the Infected Stems of the Semi-mangrove <i>Hibiscus tiliaceus</i>. Journal of natural products, 2022, 85, 127-135 |
| 1566302 | CIF | C44 H48 | P 1 21/n 1 | 15.9081; 10.1431; 23.4731 90; 98.646; 90 | 3744.5 | Hirao, Yasukazu; Ihara, Keiji; Ishibashi, Yukihide; Tiu, Elisha Gabrielle; Asahi, Tsuyoshi; Kubo, Takashi Mechanism and Kinetics of Fluorescence Quenching of Fluorene-Endcapped Butatriene: A Microspectroscopic Study of the Discrete State Constructed in Microcrystals The Journal of Physical Chemistry C, 2022, 126, 1196-1203 |
| 1566303 | CIF | C28 H16 | P 1 21/n 1 | 11.658; 5.99; 13.4368 90; 100.125; 90 | 923.7 | Hirao, Yasukazu; Ihara, Keiji; Ishibashi, Yukihide; Tiu, Elisha Gabrielle; Asahi, Tsuyoshi; Kubo, Takashi Mechanism and Kinetics of Fluorescence Quenching of Fluorene-Endcapped Butatriene: A Microspectroscopic Study of the Discrete State Constructed in Microcrystals The Journal of Physical Chemistry C, 2022, 126, 1196-1203 |
| 1566304 | CIF | C28 H20 | P -1 | 9.993; 10.043; 10.481 92.172; 104.863; 105.068 | 975.5 | Hirao, Yasukazu; Ihara, Keiji; Ishibashi, Yukihide; Tiu, Elisha Gabrielle; Asahi, Tsuyoshi; Kubo, Takashi Mechanism and Kinetics of Fluorescence Quenching of Fluorene-Endcapped Butatriene: A Microspectroscopic Study of the Discrete State Constructed in Microcrystals The Journal of Physical Chemistry C, 2022, 126, 1196-1203 |
| 1566305 | CIF | C7 H4 Br N3 O7 | P 1 21/c 1 | 10.5476; 9.05; 11.9209 90; 115.048; 90 | 1030.9 | Childs, Christian M.; Steele, Brad A.; Grivickas, Paulius; Zhang, Dongzhou; Crowhurst, Jonathan; Kuo, I-Feng W.; Bastea, Sorin; Clarke, Samantha M. High-Pressure Investigation of 2,4,6-Trinitro-3-bromoanisole (TNBA): Structural Determination and Piezochromism The Journal of Physical Chemistry C, 2022, 126, 1176-1187 |
| 1566306 | CIF | C6 H10 I4 N2 Pb | P 1 21/c 1 | 12.9783; 14.4105; 8.381 90; 105.605; 90 | 1509.67 | Jia, Qiang-Qiang; Luo, Qing-Feng; Ni, Hao-Fei; Su, Chang-Yuan; Fu, Da-Wei; Xie, Li-Yan; Lu, Hai-Feng High-Sensitivity Organic–Inorganic Hybrid Materials with Reversible Thermochromic Property and Dielectric Switching The Journal of Physical Chemistry C, 2022, 126, 1552-1557 |
| 1566307 | CIF HKL Paper | C8 H11 N O3 | P 1 21/c 1 | 9.915; 7.2523; 11.9573 90; 98.558; 90 | 850.23 | Moussa Slimane, Nabila; Benarous, Nesrine; Bougueria, Hassiba; Cherouana, Aouatef 2-Hydroxybenzenaminium acetate IUCrData, 2022, 7, x220112 |
| 1566308 | CIF | C37 H32 B P S | C 1 c 1 | 20.883; 8.704; 19.093 90; 123.59; 90 | 2891 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566309 | CIF | C21 H16 B N S | P 1 21/c 1 | 8.8; 10.843; 17.829 90; 99.74; 90 | 1676.7 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566310 | CIF | C44.25 H33.51 B2 N3 S2 | P -1 | 10.278; 12.065; 16.702 92.946; 107.906; 114.158 | 1760.3 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566311 | CIF | C41 H37 B2 N3 S2 Si | P -1 | 9.9577; 12.2845; 16.579 100.823; 90.407; 112.635 | 1831.5 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566312 | CIF | C36 H30 B2 S2 | C 1 2/c 1 | 14.644; 11.056; 17.829 90; 94.9; 90 | 2876 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566313 | CIF | C32 H22 B2 S2 | P 1 21 1 | 11.4201; 17.9796; 12.1277 90; 90.12; 90 | 2490.16 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566314 | CIF | C19 H17 B S | P 1 21/c 1 | 13.289; 30.28; 7.763 90; 93.3; 90 | 3119 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566315 | CIF | C38 H26 B2 N4 O2 S2 | P 1 21/n 1 | 13.299; 18.859; 13.574 90; 112.808; 90 | 3138.2 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566316 | CIF | C13 H7 F5 O2 | P 1 21/n 1 | 6.327; 26.441; 7.0232 90; 95.01; 90 | 1170.4 | Gerthoffer, Margaret C.; Xu, Bohan; Wu, Sikai; Cox, Jordan; Huss, Steven; Oburn, Shalisa M.; Lopez, Steven A.; Crespi, Vincent H.; Badding, John V.; Elacqua, Elizabeth Mechanistic insights into the pressure-induced polymerization of aryl/perfluoroaryl co-crystals Polymer Chemistry, 2022, 13, 1359-1368 |
| 1566317 | CIF | C13 H7 F5 O2 | P -1 | 5.9872; 7.934; 13.242 105.378; 99.982; 94.446 | 592.3 | Gerthoffer, Margaret C.; Xu, Bohan; Wu, Sikai; Cox, Jordan; Huss, Steven; Oburn, Shalisa M.; Lopez, Steven A.; Crespi, Vincent H.; Badding, John V.; Elacqua, Elizabeth Mechanistic insights into the pressure-induced polymerization of aryl/perfluoroaryl co-crystals Polymer Chemistry, 2022, 13, 1359-1368 |
| 1566318 | CIF | C40 H46 Ag2 N4 S4 | P -1 | 8.165; 15.5778; 16.2365 77.7; 87.359; 83.158 | 2002.9 | Oladipo, Segun D.; Omondi, Bernard N,N′-Diarylformamidine Dithiocarbamate Ag(I) Cluster and Coordination Polymer Molbank, 2022, 2022, M1327 |
| 1566319 | CIF | C156 H210 Ag6 N12 S12 | R -3 :H | 30.0941; 30.0941; 50.6555 90; 90; 120 | 39730.1 | Oladipo, Segun D.; Omondi, Bernard N,N′-Diarylformamidine Dithiocarbamate Ag(I) Cluster and Coordination Polymer Molbank, 2022, 2022, M1327 |
| 1566320 | CIF | C10 H5 Cl N2 O2 S3 | P n a 21 | 14.6146; 15.4871; 5.3576 90; 90; 90 | 1212.63 | Plakas, Konstantinos; Kalogirou, Andreas S.; Kourtellaris, Andreas; Koutentis, Panayiotis A. Reaction of 4,5-Dichloro-1,2,3-dithiazolium Chloride with 2-(Phenylsulfonyl)acetonitrile Molbank, 2022, 2022, M1322 |
| 1566321 | CIF | C14 H12 Cl2 O2 | P 1 21/c 1 | 8.058; 9.064; 34.864 90; 92.718; 90 | 2543.5 | Aitken, R. Alan; Gidlow, Anna L. G.; Ramsewak, Russel S.; Slawin, Alexandra M. Z. 2,2′-(Ethane-1,2-diyl)bis(4-chlorophenol) Molbank, 2022, 2022, M1318 |
| 1566322 | CIF | C8 H12 Br3 N Pb | P 21 21 21 | 7.9178; 8.1363; 20.5574 90; 90; 90 | 1324.34 | Feng, Rui; Fan, Jia-Hui; Li, Kai; Li, Zhi-Gang; Qin, Yan; Li, Zi-Ying; Li, Wei; Bu, Xian-He Temperature-Responsive Photoluminescence and Elastic Properties of 1D Lead Halide Perovskites R- and S-(Methylbenzylamine)PbBr3 Molecules, 2022, 27, 728 |
| 1566323 | CIF | C8 H12 Br3 N Pb | P 21 21 21 | 7.8835; 8.068; 20.1237 90; 90; 90 | 1279.95 | Feng, Rui; Fan, Jia-Hui; Li, Kai; Li, Zhi-Gang; Qin, Yan; Li, Zi-Ying; Li, Wei; Bu, Xian-He Temperature-Responsive Photoluminescence and Elastic Properties of 1D Lead Halide Perovskites R- and S-(Methylbenzylamine)PbBr3 Molecules, 2022, 27, 728 |
| 1566324 | CIF | O37.895 S U6 | P -1 | 8.8556; 13.9819; 14.307 96.749; 98.754; 99.726 | 1706.9 | Jakub Plasil; Jiri Sejkora; Radek Skoda; Pavel Skacha The recent weathering of uraninite from the Cervena vein, Jachymov (Czech Republic): a fingerprint of the primary mineralization geochemistry onto the alteration association Journal of GeoSciences, 2014, 59, 223-253 |
| 1566325 | CIF | K0.68 Mo2.08 Na4.32 O22 S0.42 U4 | C 1 2/c 1 | 24.282; 12.117; 13.6174 90; 106.33; 90 | 3844.9 | Sergey V. Krivovichev K2Na8(UO2)8Mo4O24[(S,Mo)O4], the first uranium molybdosulfate: synthesis, crystal structure, and comparison to related compounds Journal of GeoSciences, 2014, 59, 115-121 |
| 1566326 | CIF | K1.5 O21 Se3 U2 | P 1 21/m 1 | 12.001; 13.613; 13.753 90; 109.187; 90 | 2122 | Vladislav V. Gurzhiy; Olga V. Tyumentseva; Ilya V. Kornyakov; Sergey V. Krivovichev; Ivan G. Tananaev The role of potassium atoms in the formation of uranyl selenates: the crystal structure and synthesis of two novel compounds Journal of GeoSciences, 2014, 59, 123-133 |
| 1566327 | CIF | H20 K5 N O45 Se6 U4 | C 1 2/c 1 | 20.29; 10.38; 21.436 90; 103.446; 90 | 4390.9 | Vladislav V. Gurzhiy; Olga V. Tyumentseva; Ilya V. Kornyakov; Sergey V. Krivovichev; Ivan G. Tananaev The role of potassium atoms in the formation of uranyl selenates: the crystal structure and synthesis of two novel compounds Journal of GeoSciences, 2014, 59, 123-133 |
| 1566328 | CIF | Cl H4 Na7 O20 S4 U | C 1 2/c 1 | 21.1507; 5.3469; 34.6711 90; 104.913; 90 | 3788.9 | Jakub Plasil; Anthony R. Kampf; Anatoly V. Kasatkin; Joe Marty Bluelizardite, Na7(UO2)(SO4)4Cl(H2O)2, a new uranyl sulfate mineral from the Blue Lizard mine, San Juan County, Utah, USA Journal of GeoSciences, 2014, 59, 145-158 |
| 1566329 | CIF | Ca H6 O19 V6 | A 1 2/m 1 | 12.208; 3.6011; 18.358 90; 118.538; 90 | 709 | Mark A. Cooper; Frank C. Hawthorne; Vladimir Y. Karpenko; Leonid A. Pautov; Atali A. Agakhanov Metahewettite, Ca(V5+6O16)(H2O)3, from Hodzha-Rushnai-Mazar, southern Kirgizia: occurrence and crystal structure Journal of GeoSciences, 2014, 59, 159-168 |
| 1566330 | CIF | As3 Cl O12 Pb5 Si0 | P 63/m | 10.237; 10.237; 7.426 90; 90; 120 | 673.955 | Jiri Sejkora; Jakub Plasil; Ivana Cisarova; Radek Skoda; Jan Hlousek; Frantisek Veselovsky; Ivana Jebava Interesting supergene Pb-rich mineral association from the Rovnost mining field, Jachymov (St. Joachimsthal), Czech Republic Journal of GeoSciences, 2011, 56, 257-271 |
| 1566331 | CIF | C24 H29 N O6 | P 1 21 1 | 8.4222; 8.6086; 15.573 90; 93.674; 90 | 1126.77 | You, Shiqi; Ruan, Mengyao; Lu, Cuifen; Liu, Li; Weng, Yue; Yang, Guichun; Wang, Shengchun; Alhumade, Hesham; Lei, Aiwen; Gao, Meng Paired electrolysis enabled annulation for the quinolyl-modification of bioactive molecules Chemical Science, 2022, 13, 2310-2316 |
| 1566332 | CIF | C68 H146 Cr Mo6 N3 O32 | P 1 21/c 1 | 27.8416; 13.6571; 25.0139 90; 92.128; 90 | 9504.6 | Salazar Marcano, David E.; Moussawi, Mhamad Aly; Anyushin, Alexander V.; Lentink, Sarah; Van Meervelt, Luc; Ivanović-Burmazović, Ivana; Parac-Vogt, Tatjana N Versatile post-functionalisation strategy for the formation of modular organic-inorganic polyoxometalate hybrids. Chemical science, 2022, 13, 2891-2899 |
| 1566333 | CIF | C26 H55 N O13.5 V3 | P 1 21/c 1 | 13.052; 13.4949; 20.5929 90; 104.803; 90 | 3506.8 | Salazar Marcano, David E.; Moussawi, Mhamad Aly; Anyushin, Alexander V.; Lentink, Sarah; Van Meervelt, Luc; Ivanović-Burmazović, Ivana; Parac-Vogt, Tatjana N Versatile post-functionalisation strategy for the formation of modular organic-inorganic polyoxometalate hybrids. Chemical science, 2022, 13, 2891-2899 |
| 1566334 | CIF | C34.67 H59 B N2 Ni P2 | P 1 21/c 1 | 23.1838; 26.0619; 17.536 90; 101.639; 90 | 10377.6 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566335 | CIF | C30 H50 P2 Pd Si | P -1 | 9.5911; 9.8051; 19.1276 90.444; 94.813; 117.164 | 1592.59 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566336 | CIF | C50 H94 B2 N6 Ni2 P4 | P -1 | 10.5516; 11.9228; 13.7755 103.985; 111.062; 90.654 | 1560 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566337 | CIF | C26 H47 B N2 O2 P2 Pd | P 1 21/c 1 | 12.5308; 15.0351; 15.989 90; 103.614; 90 | 2927.72 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566338 | CIF | C32 H52 B Cl N2 Ni P2 | R -3 c :H | 26.0265; 26.0265; 26.0801 90; 90; 120 | 15299.3 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566339 | CIF | C25 H47 B N2 P2 Pd | P b c a | 11.9139; 14.4308; 32.1655 90; 90; 90 | 5530.12 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566340 | CIF | C28 H28 O3 S | P 1 21/c 1 | 14.1193; 10.6583; 16.1923 90; 95.636; 90 | 2425 | Wang, Lihong; Ma, Ruiyang; Sun, Jiaqiong; Zheng, GuangFan; Zhang, Qian NHCs and Visible Light-mediated Photoredox Co-catalyzed 1,4-Sulfonylacylation of 1,3-Enynes for Tetrasubstituted Allenyl Ketones Chemical Science, 2022 |
| 1566341 | CIF | C22 H23 Cl2 F6 N3 P Rh | P 1 21/c 1 | 12.804; 13.813; 13.807 90; 95.465; 90 | 2431 | Angoy, Marta; Jiménez, M. Victoria; Lahoz, Fernando J.; Vispe, Eugenio; Pérez-Torrente, Jesús J. Polymerization of phenylacetylene catalyzed by rhodium(i) complexes with N-functionalized N-heterocyclic carbene ligands Polymer Chemistry, 2022, 13, 1411-1421 |
| 1566342 | CIF | Al1.88 Ca2 Fe0.12 H2 O12 Si3 | P 2 c m | 4.63309; 5.4839; 18.51 90; 90; 90 | 470.291 | Sugiyama, K.; Kawamata, T.; Kuribayashi, T. Structure refinement of prehnite from Passaic County, New Jersey, USA Journal of Mineralogical and Petrological Sciences, 2021, 116, 272-276 |
| 1566343 | CIF | H4 O10 Si2 Zn4 | I m m 2 | 8.368; 10.724; 5.1121 90; 90; 90 | 458.8 | Okamoto, K.; Kuribayashi, T.; Nagase, T. Modulated structure of hemimorphite associated with pressure-induced phase transition Journal of Mineralogical and Petrological Sciences, 2021, 116, 251-262 |
| 1566344 | CIF | H4 O10 Si2 Zn4 | P n n 2 | 8.1577; 10.642; 5.0473 90; 90; 90 | 438.2 | Okamoto, K.; Kuribayashi, T.; Nagase, T. Modulated structure of hemimorphite associated with pressure-induced phase transition : at 3.01 GPa Journal of Mineralogical and Petrological Sciences, 2021, 116, 251-262 |
| 1566345 | CIF | H4 O10 Si2 Zn4 | P n n 2 | 8.0987; 10.549; 5.0288 90; 90; 90 | 429.63 | Okamoto, K.; Kuribayashi, T.; Nagase, T. Modulated structure of hemimorphite associated with pressure-induced phase transition : at 3.72 GPa Journal of Mineralogical and Petrological Sciences, 2021, 116, 251-262 |
| 1566346 | CIF | C52 H77 B2 Na O6 | P 1 21/c 1 | 12.5628; 13.3264; 15.5838 90; 106.231; 90 | 2505 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566347 | CIF | C55 H65 B2 Cu N2 | C 1 2/c 1 | 13.312; 19.989; 17.2387 90; 96.574; 90 | 4556.9 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566348 | CIF | C55 H65 Ag B2 N2 | C 1 2/c 1 | 13.3073; 20.5224; 17.1012 90; 96.418; 90 | 4641 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566349 | CIF | C55 H65 Au B2 N2 | P b c a | 21.161; 17.679; 25.912 90; 90; 90 | 9694 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566350 | CIF | C36 H33 B N4 | P 1 21/n 1 | 14.348; 9.7155; 20.1083 90; 95.494; 90 | 2790.2 | Huang, Huanan; Liu, Lingxiu; Wang, Jianguo; Zhou, Ying; Hu, Huanan; Ye, Xinglin; Liu, Guochang; Xu, Zhixiong; Xu, Han; Yang, Wen; Wang, Yawei; Peng, You; Yang, Pinghua; Sun, Jianqi; Yan, Ping; Cao, Xiaohua; Tang, Ben Zhong Aggregation caused quenching to aggregation induced emission transformation: a precise tuning based on BN-doped polycyclic aromatic hydrocarbons toward subcellular organelle specific imaging Chemical Science, 2022 |
| 1566351 | CIF | C32 H23 B N2 | P 1 21/c 1 | 8.1281; 14.6359; 22.9977 90; 93.688; 90 | 2730.2 | Huang, Huanan; Liu, Lingxiu; Wang, Jianguo; Zhou, Ying; Hu, Huanan; Ye, Xinglin; Liu, Guochang; Xu, Zhixiong; Xu, Han; Yang, Wen; Wang, Yawei; Peng, You; Yang, Pinghua; Sun, Jianqi; Yan, Ping; Cao, Xiaohua; Tang, Ben Zhong Aggregation caused quenching to aggregation induced emission transformation: a precise tuning based on BN-doped polycyclic aromatic hydrocarbons toward subcellular organelle specific imaging Chemical Science, 2022 |
| 1566352 | CIF | C17 H23 F N2 O4 | P 1 21 1 | 10.32624; 15.5828; 11.74267 90; 106.113; 90 | 1815.31 | Bing, Jade A.; Schley, Nathan D.; Johnston, Jeffrey N. Fluorine-induced diastereodivergence discovered in an equally rare enantioselective syn-aza-Henry reaction Chemical Science, 2022 |
| 1566353 | CIF | C20 H31 F N2 O4 | P 61 | 11.8419; 11.8419; 27.2204 90; 90; 120 | 3305.73 | Bing, Jade A.; Schley, Nathan D.; Johnston, Jeffrey N. Fluorine-induced diastereodivergence discovered in an equally rare enantioselective syn-aza-Henry reaction Chemical Science, 2022 |
| 1566354 | CIF | C20 H31 F N2 O4 | P 21 21 21 | 11.50004; 18.45454; 30.36728 90; 90; 90 | 6444.79 | Bing, Jade A.; Schley, Nathan D.; Johnston, Jeffrey N. Fluorine-induced diastereodivergence discovered in an equally rare enantioselective syn-aza-Henry reaction Chemical Science, 2022 |
| 1566355 | CIF | C21 H24 Cl F N2 O4 | P 1 21 1 | 12.8885; 5.3127; 15.1705 90; 95.058; 90 | 1034.72 | Bing, Jade A.; Schley, Nathan D.; Johnston, Jeffrey N. Fluorine-induced diastereodivergence discovered in an equally rare enantioselective syn-aza-Henry reaction Chemical Science, 2022 |
| 1566356 | CIF | C20 H32 N2 O4 | P 61 | 11.84105; 11.84105; 27.02804 90; 90; 120 | 3281.9 | Bing, Jade A.; Schley, Nathan D.; Johnston, Jeffrey N. Fluorine-induced diastereodivergence discovered in an equally rare enantioselective syn-aza-Henry reaction Chemical Science, 2022 |
| 1566357 | CIF | Al2 H4 O9 Si2 | P 1 | 5.185369; 8.997871; 7.347378 91.7552; 105.095; 89.8358 | 330.82 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
| 1566358 | CIF | Al2 H4 O9 Si2 | P 1 | 5.210756; 5.189703; 7.581904 89.3723; 72.4369; 119.963 | 166.073 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
| 1566359 | CIF | Al2 H4 O9 Si2 | P 1 | 5.162169; 5.176777; 7.781752 104.444; 98.2915; 119.884 | 165.438 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
| 1566360 | CIF | Al2 H4 O9 Si2 | P 1 | 5.159081; 8.934001; 14.410312 90; 96.3063; 90 | 660.17 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
| 1566361 | CIF | Al2 H4 O9 Si2 | P 1 | 5.185121; 8.939635; 14.188437 90.001; 89.08; 89.9997 | 657.593 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
| 1566362 | CIF | Al2 H4 O9 Si2 | P 1 | 8.902908; 5.163177; 14.518933 90.0004; 99.3478; 90 | 658.533 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
| 1566363 | CIF | C18 H21 F4 N3 | P 1 21/n 1 | 9.21581; 14.44752; 13.23644 90; 91.4811; 90 | 1761.78 | Tan, Jin-Fay; Bormann, Carl Thomas; Severin, Kay; Cramer, Nicolai Chemo- and regio-divergent access to fluorinated 1-alkyl and 1-acyl triazenes from alkynyl triazenes Chemical Science, 2022 |
| 1566364 | CIF | C15 H21 F2 N3 O | P -1 | 9.5957; 9.9111; 10.2433 104.216; 114.117; 101.164 | 812.95 | Tan, Jin-Fay; Bormann, Carl Thomas; Severin, Kay; Cramer, Nicolai Chemo- and regio-divergent access to fluorinated 1-alkyl and 1-acyl triazenes from alkynyl triazenes Chemical Science, 2022 |
| 1566365 | CIF | C42 H71 B2 Cs2 F2 N3 | P 21 21 21 | 10.5055; 17.6861; 24.528 90; 90; 90 | 4557.3 | Kirschner, Sven; Peters, Matthew; Yuan, Kang; Uzelac, Marina; Ingleson, Michael J. Developing organoboranes as phase transfer catalysts for nucleophilic fluorination using CsF Chemical Science, 2022 |
| 1566366 | CIF | C62 H87.79 Cl4 Fe2 N12 O24.9 | P -1 | 11.684; 13.345; 25.013 75.152; 84.913; 87.753 | 3754.5 | Rohde, Gregory T.; Xue, Genqiang; Que, Jr, Lawrence Explorations of the nonheme high-valent iron-oxo landscape: crystal structure of a synthetic complex with an [FeIV2(μ-O)<sub>2</sub>] diamond core relevant to the chemistry of sMMOH. Faraday discussions, 2022, 234, 109-128 |
| 1566367 | CIF | C152 H197 Cl8 D24 Fe4 N27 O48 | P -1 | 14.2183; 15.72; 21.5627 86.579; 71.452; 72.753 | 4360.5 | Rohde, Gregory T.; Xue, Genqiang; Que, Jr, Lawrence Explorations of the nonheme high-valent iron-oxo landscape: crystal structure of a synthetic complex with an [FeIV2(μ-O)<sub>2</sub>] diamond core relevant to the chemistry of sMMOH. Faraday discussions, 2022, 234, 109-128 |
| 1566368 | CIF | C62 H90 Cl3 Fe2 N10 O22 | C 1 2/c 1 | 27.9262; 11.108; 22.8446 90; 105.11; 90 | 6841.5 | Rohde, Gregory T.; Xue, Genqiang; Que, Jr, Lawrence Explorations of the nonheme high-valent iron-oxo landscape: crystal structure of a synthetic complex with an [FeIV2(μ-O)<sub>2</sub>] diamond core relevant to the chemistry of sMMOH. Faraday discussions, 2022, 234, 109-128 |
| 1566369 | CIF | C19 H24 O3 | P 21 21 21 | 9.16551; 10.4822; 17.5734 90; 90; 90 | 1688.36 | Wang, Jianhua; Li, Xiaoxun Asymmetric β-arylation of cyclopropanols enabled by photoredox and nickel dual catalysis. Chemical science, 2022, 13, 3020-3026 |
| 1566370 | CIF | C432 H471 Ag38 Au43 Cl12 | R -3 :H | 26.1589; 26.1589; 148.875 90; 90; 120 | 88225 | Xu, Jiayu; Xiong, Lin; Cai, Xiao; Tang, Shisi; Tang, Ancheng; Liu, Xu; Pei, Yong; Zhu, Yan Evolution from superatomic Au24Ag20 monomers into molecular-like Au43Ag38 dimeric nanoclusters Chemical Science, 2022 |
| 1566371 | CIF | C324 H251 Ag38 Au43 Cl9 | P -1 | 25.413; 25.542; 28.705 77.099; 83.178; 73.626 | 17394 | Xu, Jiayu; Xiong, Lin; Cai, Xiao; Tang, Shisi; Tang, Ancheng; Liu, Xu; Pei, Yong; Zhu, Yan Evolution from superatomic Au24Ag20 monomers into molecular-like Au43Ag38 dimeric nanoclusters Chemical Science, 2022 |
| 1566372 | CIF | C216 H168 Ag20 Au24 Cl4 | P -1 | 18.9562; 19.6527; 33.671 78.295; 79.704; 63.881 | 10971.5 | Xu, Jiayu; Xiong, Lin; Cai, Xiao; Tang, Shisi; Tang, Ancheng; Liu, Xu; Pei, Yong; Zhu, Yan Evolution from superatomic Au24Ag20 monomers into molecular-like Au43Ag38 dimeric nanoclusters Chemical Science, 2022 |
| 1566373 | CIF | C288 H312 Ag20 Au24 Cl2 | P -1 | 19.2914; 24.9197; 34.987 97.077; 105.131; 100.118 | 15729 | Xu, Jiayu; Xiong, Lin; Cai, Xiao; Tang, Shisi; Tang, Ancheng; Liu, Xu; Pei, Yong; Zhu, Yan Evolution from superatomic Au24Ag20 monomers into molecular-like Au43Ag38 dimeric nanoclusters Chemical Science, 2022 |
| 1566374 | CIF HKL Paper | C28 H16 Cl4 Ni S4 | P -1 | 9.5487; 11.4141; 15.0254 107.486; 94.791; 111.423 | 1419.16 | Koehne, Sydney; Mirmelli, Bailey; Mague, Joel T.; Donahue, James P. Bis[1,2-bis(4-chlorophenyl)ethylene-1,2-dithiolato(1–)]nickel(II) IUCrData, 2022, 7, x220148 |
| 1566375 | CIF HKL Paper | C42 H24 | C 1 2/c 1 | 36.615; 8.0709; 36.282 90; 90.863; 90 | 10720.7 | Schollmeyer, Dieter; Detert, Heiner 13,13'-Bi(dibenzo[<i>a</i>,<i>i</i>]fluorenylidene) IUCrData, 2022, 7, x220169 |
| 1566376 | CIF | C15 H19 Cl2 Co N3 O | P -1 | 7.3409; 8.2378; 14.1911 77.242; 85.133; 77.261 | 815.8 | Sharma, Dipesh M.; Gouda, Chandrakant; Gonnade, Rajesh G.; Punji, Benudhar Room temperature Z-selective hydrogenation of alkynes by hemilabile and non-innocent (NNN)Co(ii) catalysts Catalysis Science & Technology, 2022, 12, 1843-1849 |
| 1566377 | CIF | C15 H21 Cl2 Co N3 | P 1 21/c 1 | 16.65; 24.8705; 7.9667 90; 90.49; 90 | 3298.8 | Sharma, Dipesh M.; Gouda, Chandrakant; Gonnade, Rajesh G.; Punji, Benudhar Room temperature Z-selective hydrogenation of alkynes by hemilabile and non-innocent (NNN)Co(ii) catalysts Catalysis Science & Technology, 2022, 12, 1843-1849 |
| 1566378 | CIF | C33 H28 F6 S2 | P 21 21 21 | 10.4026; 21.482; 25.657 90; 90; 90 | 5733.5 | Kim, Alexia; Ngamnithiporn, Aurapat; Bartberger, Michael D.; Stoltz, Brian M. Iridium-Catalyzed Asymmetric trans-Selective Hydrogenation of 1,3-Disubstituted Isoquinolines Chemical Science, 2022 |
| 1566379 | CIF | C42 H34 B2 F8 Fe N18 | P -1 | 10.209; 10.4618; 21.8559 82.284; 82.051; 87.374 | 2290.06 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566380 | CIF | C42 H34 F12 Fe N18 P2 | P -1 | 9.8259; 10.8645; 22.6056 101.98; 91.87; 91.858 | 2357.51 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566381 | CIF | C42 H34 B2 F8 Fe N18 | P 1 21/c 1 | 10.1555; 18.7976; 24.3818 90; 99.376; 90 | 4592.3 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566382 | CIF | C42 H34 F12 Fe N18 P2 | P -1 | 9.9994; 11.0389; 22.5035 102.939; 90.267; 90.662 | 2420.69 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566383 | CIF | C46 H42 B2 F8 Fe N14 | I 1 2/a 1 | 22.0537; 9.5781; 22.3969 90; 98.891; 90 | 4674.11 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566384 | CIF | C42 H34 B2 F8 Fe N14 | P 1 21/n 1 | 10.2889; 18.9461; 22.8834 90; 95.792; 90 | 4438 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566385 | CIF | C42 H34 B2 F8 Fe N18 | P -1 | 9.82; 10.0724; 22.5535 92.684; 100.135; 94.567 | 2184.8 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566386 | CIF | C46 H38 B2 F8 Fe N14 | P 1 21/c 1 | 10.4294; 18.5284; 24.7378 90; 99.669; 90 | 4712.4 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566387 | CIF | C42 H34 B2 F8 Fe N14 | P -1 | 10.2254; 10.1492; 21.6116 96.133; 94.628; 93.979 | 2215.84 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566388 | CIF | C42 H34 F12 Fe N18 P2 | P -1 | 10.1721; 11.3235; 22.3862 104.374; 88.492; 88.975 | 2496.15 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566389 | CIF | C42 H34 B2 F8 Fe N18 | P -1 | 9.9373; 10.241; 22.3677 81.92; 80.061; 85.898 | 2217.3 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566390 | CIF | C24 H24 B2 F8 Fe N10 O | C 1 2/c 1 | 20.4712; 17.3086; 18.6657 90; 113.286; 90 | 6075.04 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566391 | CIF | C42 H34 F12 Fe N18 P2 | P 1 21/n 1 | 12.4569; 16.5431; 23.9335 90; 98.279; 90 | 4880.71 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566392 | CIF | C42 H34 F12 Fe N14 P2 | C 1 2/m 1 | 14.9529; 14.8247; 21.0093 90; 95.4899; 90 | 4635.82 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566393 | CIF | C46 H38 F12 Fe N14 P2 | P -1 | 9.8578; 10.9457; 22.5606 100.301; 91.468; 93.516 | 2388.9 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566394 | CIF | C42 H34 B2 F8 Fe N18 | P 1 21/c 1 | 9.9764; 18.0458; 24.6253 90; 97.592; 90 | 4394.48 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566395 | CIF | C46 H42 F12 Fe N14 P2 | P 1 21 1 | 9.0523; 30.808; 18.3037 90; 102.668; 90 | 4980.3 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566396 | CIF | C46 H42 F12 Fe N14 P2 | P 1 21 1 | 9.55236; 18.1504; 15.00388 90; 102.111; 90 | 2543.46 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566397 | CIF | C42 H34 F12 Fe N14 P2 S4 | P 32 2 1 | 14.8052; 14.8052; 19.695 90; 90; 120 | 3738.7 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566398 | CIF | C46 H38 F12 Fe N14 P2 | P -1 | 10.2078; 11.4083; 21.4035 97.221; 96.811; 93.568 | 2447.76 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566399 | CIF | C42 H34 B2 F8 Fe N14 | P 1 21/n 1 | 10.2076; 18.9941; 22.8634 90; 96.403; 90 | 4405.2 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566400 | CIF | C46 H42 F12 Fe N14 P2 | P 1 21 1 | 9.45496; 17.9858; 14.95322 90; 101.545; 90 | 2491.42 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566401 | CIF | C42 H34 B2 F8 Fe N14 | P -1 | 10.0861; 10.1542; 21.849 96.262; 96.2; 93.852 | 2204.26 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566402 | CIF | C46 H38 F12 Fe N14 P2 | P -1 | 9.8294; 22.3967; 22.3209 79.439; 89.335; 89.19 | 4829.9 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566403 | CIF HKL Paper | C14 H18 N6 O5 S | P 1 21/c 1 | 12.1115; 10.6282; 17.4772 90; 127.723; 90 | 1779.48 | Peña Hueso, Adrian; Esparza Ruiz, Adriana; Flores Parra, Angelina Bis(2-aminobenzimidazolium) sulfate monohydrate IUCrData, 2022, 7, x220172 |
| 1566404 | CIF | C37 H31 F O5 | P 1 21 1 | 10.9625; 9.5991; 14.075 90; 97.804; 90 | 1467.4 | Wu, Mingyue; Han, Zhaobin; Ni, Huanzhen; Wang, Nengzhong; Ding, Kuiling; Lu, Yixin Phosphine-catalyzed divergent domino processes between γ-substituted allenoates and carbonyl-activated alkenes Chemical Science, 2022 |
| 1566405 | CIF | C38 H34 O8 | P 21 21 2 | 15.0488; 25.2228; 8.6864 90; 90; 90 | 3297.1 | Wu, Mingyue; Han, Zhaobin; Ni, Huanzhen; Wang, Nengzhong; Ding, Kuiling; Lu, Yixin Phosphine-catalyzed divergent domino processes between γ-substituted allenoates and carbonyl-activated alkenes Chemical Science, 2022 |
| 1566406 | CIF | C10 H11 Cl F N O2 | P 21 21 21 | 5.1224; 8.268; 24.1637 90; 90; 90 | 1023.38 | Yamane, Daiki; Onitsuka, Satsuki; Re, Suyong; Isogai, Hikaru; Hamada, Rui; Hiramoto, Tadanari; Kawanishi, Eiji; Mizuguchi, Kenji; Shindo, Naoya; Ojida, Akio Selective covalent targeting of SARS-CoV-2 main protease by enantiopure chlorofluoroacetamide. Chemical science, 2022, 13, 3027-3034 |
| 1566407 | CIF | C22 H18 Cl F7 N4 O2 S | P 1 21/n 1 | 9.4276; 19.5575; 50.822 90; 93.634; 90 | 9351.7 | Yamane, Daiki; Onitsuka, Satsuki; Re, Suyong; Isogai, Hikaru; Hamada, Rui; Hiramoto, Tadanari; Kawanishi, Eiji; Mizuguchi, Kenji; Shindo, Naoya; Ojida, Akio Selective covalent targeting of SARS-CoV-2 main protease by enantiopure chlorofluoroacetamide. Chemical science, 2022, 13, 3027-3034 |
| 1566408 | CIF | C15 H16 O2 | C 1 c 1 | 8.7883; 12.6773; 10.4803 90; 99.097; 90 | 1152.94 | Wu, Wen-Biao; Mu, Bo-Shuai; Yu, Jin-Sheng; Zhou, Jian Me2(CH2=CH)SiCN: a bifunctional ethylene equivalent for Diels-Alder reaction based controllable tandem synthesis Chemical Science, 2022 |
| 1566409 | CIF | C17 H18 Br N O | P 1 21/c 1 | 19.7377; 9.5738; 7.613 90; 99.09; 90 | 1420.52 | Wu, Wen-Biao; Mu, Bo-Shuai; Yu, Jin-Sheng; Zhou, Jian Me2(CH2=CH)SiCN: a bifunctional ethylene equivalent for Diels-Alder reaction based controllable tandem synthesis Chemical Science, 2022 |
| 1566410 | CIF | C16 H18 O | P 1 21/n 1 | 7.2763; 13.1879; 12.6095 90; 94.179; 90 | 1206.78 | Wu, Wen-Biao; Mu, Bo-Shuai; Yu, Jin-Sheng; Zhou, Jian Me2(CH2=CH)SiCN: a bifunctional ethylene equivalent for Diels-Alder reaction based controllable tandem synthesis Chemical Science, 2022 |
| 1566411 | CIF | C18 H21 N O2 | P -1 | 7.2466; 8.3731; 12.6472 95.047; 96.626; 94.254 | 756.54 | Wu, Wen-Biao; Mu, Bo-Shuai; Yu, Jin-Sheng; Zhou, Jian Me2(CH2=CH)SiCN: a bifunctional ethylene equivalent for Diels-Alder reaction based controllable tandem synthesis Chemical Science, 2022 |
| 1566412 | CIF | C25 H32 O2 | P 1 21 1 | 12.196; 6.2725; 13.2067 90; 97.53; 90 | 1001.59 | Wu, Wen-Biao; Mu, Bo-Shuai; Yu, Jin-Sheng; Zhou, Jian Me2(CH2=CH)SiCN: a bifunctional ethylene equivalent for Diels-Alder reaction based controllable tandem synthesis Chemical Science, 2022 |
| 1566413 | CIF | C20 H17 N O | P 21 21 21 | 6.55952; 7.19955; 33.374 90; 90; 90 | 1576.11 | Wu, Wen-Biao; Mu, Bo-Shuai; Yu, Jin-Sheng; Zhou, Jian Me2(CH2=CH)SiCN: a bifunctional ethylene equivalent for Diels-Alder reaction based controllable tandem synthesis Chemical Science, 2022 |
| 1566414 | CIF | C20 H22 N4 S2 Zn | C 1 2 1 | 38.805; 6.6795; 16.442 90; 91.833; 90 | 4259.6 | Koskela, Kristopher M.; Quiton, Stephen J.; Sharada, Shaama Mallikarjun; Williams, Travis J.; Brutchey, Richard L. Kinetics and mechanistic details of bulk ZnO dissolution using a thiol–imidazole system Chemical Science, 2022 |
| 1566415 | CIF | C92 H120 B20 Co2 Cs2 O4 P4 | P 1 21/n 1 | 12.1327; 17.926; 22.865 90; 103.927; 90 | 4826.7 | Keener, Megan; Mattejat, Maxwell; Zheng, Shao-Liang; Wu, Guang; Hayton, Trevor W.; Ménard, Gabriel Selective electrochemical capture and release of uranyl from aqueous alkali, lanthanide, and actinide mixtures using redox-switchable carboranes Chemical Science, 2022 |
| 1566416 | CIF | C254 H332 B60 Co4 N7 O14 P12 Th2 | C 1 2/c 1 | 70.509; 17.5517; 23.4008 90; 108.146; 90 | 27519 | Keener, Megan; Mattejat, Maxwell; Zheng, Shao-Liang; Wu, Guang; Hayton, Trevor W.; Ménard, Gabriel Selective electrochemical capture and release of uranyl from aqueous alkali, lanthanide, and actinide mixtures using redox-switchable carboranes Chemical Science, 2022 |
| 1566417 | CIF | C154 H129 B30 Co3 N8 Nd O6 P6 | P c c n | 19.004; 23.285; 36.829 90; 90; 90 | 16297 | Keener, Megan; Mattejat, Maxwell; Zheng, Shao-Liang; Wu, Guang; Hayton, Trevor W.; Ménard, Gabriel Selective electrochemical capture and release of uranyl from aqueous alkali, lanthanide, and actinide mixtures using redox-switchable carboranes Chemical Science, 2022 |
| 1566418 | CIF | C42 H67 B10 N O2 P2 | P -1 | 11.082; 11.112; 37.623 93.075; 96.139; 101.822 | 4495 | Keener, Megan; Mattejat, Maxwell; Zheng, Shao-Liang; Wu, Guang; Hayton, Trevor W.; Ménard, Gabriel Selective electrochemical capture and release of uranyl from aqueous alkali, lanthanide, and actinide mixtures using redox-switchable carboranes Chemical Science, 2022 |
| 1566419 | CIF | C154 H204 B30 Co3 N8 O6 P6 Sm | P 1 21/c 1 | 19.0168; 23.3163; 36.48 90; 90.563; 90 | 16174.5 | Keener, Megan; Mattejat, Maxwell; Zheng, Shao-Liang; Wu, Guang; Hayton, Trevor W.; Ménard, Gabriel Selective electrochemical capture and release of uranyl from aqueous alkali, lanthanide, and actinide mixtures using redox-switchable carboranes Chemical Science, 2022 |
| 1566420 | CIF | C25 H33 N O6 S Si | P -1 | 9.1233; 11.1747; 13.3729 92.8956; 109.796; 90.2891 | 1280.81 | Bunyamin, Amanda; Hua, Carol; Polyzos, Anastasios; Priebbenow, Daniel Intramolecular Photochemical [2+1]-Cycloadditions of Nucleophilic Siloxy Carbenes Chemical Science, 2022 |
| 1566421 | CIF | C16 H22 O4 Si | P 1 21/c 1 | 8.6905; 16.3296; 11.4842 90; 98.168; 90 | 1613.22 | Bunyamin, Amanda; Hua, Carol; Polyzos, Anastasios; Priebbenow, Daniel Intramolecular Photochemical [2+1]-Cycloadditions of Nucleophilic Siloxy Carbenes Chemical Science, 2022 |
| 1566422 | CIF | C23 H29 N O6 S Si | C 1 2/c 1 | 45.775; 5.703; 18.31 90; 99.58; 90 | 4713.3 | Bunyamin, Amanda; Hua, Carol; Polyzos, Anastasios; Priebbenow, Daniel Intramolecular Photochemical [2+1]-Cycloadditions of Nucleophilic Siloxy Carbenes Chemical Science, 2022 |
| 1566423 | CIF | C23 H29 N O5 S Si | P 1 21 1 | 8.92; 18.338; 14.723 90; 99.61; 90 | 2374.5 | Bunyamin, Amanda; Hua, Carol; Polyzos, Anastasios; Priebbenow, Daniel Intramolecular Photochemical [2+1]-Cycloadditions of Nucleophilic Siloxy Carbenes Chemical Science, 2022 |
| 1566424 | CIF HKL Paper | C23 H19 N O5 | P 1 21/n 1 | 9.7089; 14.351; 14.2749 90; 106.946; 90 | 1902.6 | Surya Prakash Rao, H.; M, Prabakaran; Muthukumaran, Jayaraman Ethyl 10-cyano-7-hydroxy-6-oxo-3-phenyl-8,9,10,10a-tetrahydro-6<i>H</i>-benzo[<i>c</i>]chromene-10-carboxylate IUCrData, 2022, 7, x220199 |
| 1566425 | CIF HKL Paper | C10 H13 Cl N3 O3 P | P 1 21/c 1 | 11.5857; 7.0616; 16.6118 90; 108.222; 90 | 1290.92 | Chachlaki, Elpiniki; Choquesillo-Lazarte, Duane; Demadis, Konstantinos D. 5-Phenyl-3-(2-phosphonoethyl)-1,2,3-triazol-1-ium chloride IUCrData, 2022, 7, x220189 |
| 1566426 | CIF | C21 H17 F3 O3 S2 | P 1 21/n 1 | 8.8793; 13.4651; 16.2393 90; 94.659; 90 | 1935.17 | Zhang, Qiu-Chi; Xue, Xiaoping; Hong, Biqiong; Gu, Zhenhua Torsional Strain Inversed Chemoselectivity in Pd-Catalyzed Atroposelective Carboxylation Reaction of Dibenzothiophenium Chemical Science, 2022 |
| 1566427 | CIF | C30 H29 N O S | P 31 2 1 | 10.0094; 10.0094; 42.946 90; 90; 120 | 3726.2 | Zhang, Qiu-Chi; Xue, Xiaoping; Hong, Biqiong; Gu, Zhenhua Torsional Strain Inversed Chemoselectivity in Pd-Catalyzed Atroposelective Carboxylation Reaction of Dibenzothiophenium Chemical Science, 2022 |
| 1566428 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566429 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566430 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566431 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566432 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566433 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566434 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566435 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566436 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566437 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566438 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566439 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566440 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566441 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566442 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566443 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566444 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566445 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566446 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566447 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566448 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566449 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566450 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566451 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566452 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566453 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566454 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566456 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566457 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566458 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566459 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566460 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566461 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566462 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566463 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566464 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566465 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566466 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566467 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566468 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566469 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566470 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566471 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566472 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566473 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566474 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566475 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566476 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566477 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566478 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566479 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566480 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566481 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566482 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566483 | CIF | C8 H18 Mg O14 | P 1 21/c 1 | 10.195; 11.759; 6.6206 90; 103.67; 90 | 771.2 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566484 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566485 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566486 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566487 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566488 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566489 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566490 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566491 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566492 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566493 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566494 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566495 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566496 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566497 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566498 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566499 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566500 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566501 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566502 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566503 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566504 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566505 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566506 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566507 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566508 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566509 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566510 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566511 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566512 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566513 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566514 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566515 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566516 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566517 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566518 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566519 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566520 | CIF | C H4 N2 O | P -4 21 m | 5.578; 5.578; 4.686 90; 90; 90 | 145.8 | Ruth, Paul Niklas; Herbst-Irmer, Regine; Stalke, Dietmar Hirshfeld atom refinement based on projector augmented wave densities with periodic boundary conditions IUCrJ, 2022, 9, 286-297 |
| 1566521 | CIF | C64 H86 Cl2 N6 O6 | P 31 | 20.2894; 20.2894; 13.6577 90; 90; 120 | 4869.1 | Ding, Yanjun; Alimi, Lukman O.; Du, Jing; Hua, Bin; Dey, Avishek; Yu, Pei; Khashab, Niveen M. Pillar[3]trianglamines: deeper cavity triangular macrocycles for selective hexene isomer separation Chemical Science, 2022 |
| 1566522 | CIF | C69 H96 N6 O6 | R 3 :H | 20.366; 20.366; 13.791 90; 90; 120 | 4953.79 | Ding, Yanjun; Alimi, Lukman O.; Du, Jing; Hua, Bin; Dey, Avishek; Yu, Pei; Khashab, Niveen M. Pillar[3]trianglamines: deeper cavity triangular macrocycles for selective hexene isomer separation Chemical Science, 2022 |
| 1566523 | CIF | C66 H90 N6 O6 | R 3 :H | 20.3338; 20.3338; 13.7372 90; 90; 120 | 4918.88 | Ding, Yanjun; Alimi, Lukman O.; Du, Jing; Hua, Bin; Dey, Avishek; Yu, Pei; Khashab, Niveen M. Pillar[3]trianglamines: deeper cavity triangular macrocycles for selective hexene isomer separation Chemical Science, 2022 |
| 1566524 | CIF | C74 H104 Ga2 N8 Sb2 | P -1 | 10.4552; 11.9732; 14.9227 93.2189; 97.3354; 107.995 | 1753.06 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566525 | CIF | C66 H102 Ga2 N4 O2 Sb2 Si | C 1 2/c 1 | 59.557; 11.8135; 21.011 90; 108.078; 90 | 14053 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566526 | CIF | C78 H116 Ga2 N6 Sb2 Si | P -1 | 10.919; 14.343; 26.014 83.994; 78.718; 88.053 | 3973 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566527 | CIF | C64.5 H98 Cl2 Ga2 N4 Sb2 Si | P 1 21/c 1 | 19.7547; 10.5843; 33.512 90; 96.97; 90 | 6955.2 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566528 | CIF | C71.5 H103 Ga2 N7 Sb2 | P 1 21/c 1 | 19.9634; 12.5667; 29.4717 90; 109.028; 90 | 6989.7 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566529 | CIF | C65 H103 Ga2 N7 Sb2 Si | P 1 21 1 | 10.7967; 21.163; 15.164 90; 96.979; 90 | 3439.2 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566530 | CIF | C79 H117 Ga2 N7 Sb2 | P 1 21/n 1 | 10.9672; 45.894; 15.2335 90; 94.502; 90 | 7643.8 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566531 | CIF | C72.5 H102 F3 Ga2 N7 Sb2 | P -1 | 10.6581; 12.7136; 27.5744 102.129; 92.993; 98.869 | 3595.5 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566532 | CIF | C78 H119 F3 Ga2 N7 Sb2 | P 1 21/n 1 | 12.1758; 27.211; 24.248 90; 99.805; 90 | 7916.4 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566533 | CIF | C68 H110 Ga2 N8 Sb2 Si2 | P 1 21/n 1 | 11.889; 18.46; 33.366 90; 96.36; 90 | 7278 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566534 | CIF | C81 H112 Ga2 N8 Sb2 | P -1 | 11.6222; 17.8727; 19.5796 108.099; 90.076; 93.817 | 3856.2 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566535 | CIF | C77 H110 Ga2 N8 Sb2 | P 1 21/c 1 | 13.6969; 28.763; 20.711 90; 94.587; 90 | 8133.3 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566536 | CIF | C84 H108 Ga2 N6 Sb4 | P -1 | 12.0886; 12.3645; 14.1831 86.028; 75.849; 74.786 | 1983.54 | Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides Chemical Science, 2022 |
| 1566537 | CIF | C44 H45 F6 N6 P Ru2 | P 1 21/n 1 | 12.6141; 12.2041; 27.463 90; 98.846; 90 | 4177.47 | Bellini, Marco; Bösken, Jonas; Bartoli, Francesco; Miller, Hamish; Thöny, Debora; Poggini, Lorenzo; Wörle, Michael; Oberhauser, Werner; Gamboa-Carballo, Juan José; Lavacchi, Alessandro; Krumeich, Frank; Grützmacher, Hansjörg; Vizza, Francesco Remarkable Stability of a Molecular Ruthenium Complex in PEM Water Electrolysis Chemical Science, 2022 |
| 1566538 | CIF | C36 H35 B F4 N2 O Ru2 | P -1 | 9.5469; 10.1082; 17.4002 78.96; 76.819; 85.773 | 1603.87 | Bellini, Marco; Bösken, Jonas; Bartoli, Francesco; Miller, Hamish; Thöny, Debora; Poggini, Lorenzo; Wörle, Michael; Oberhauser, Werner; Gamboa-Carballo, Juan José; Lavacchi, Alessandro; Krumeich, Frank; Grützmacher, Hansjörg; Vizza, Francesco Remarkable Stability of a Molecular Ruthenium Complex in PEM Water Electrolysis Chemical Science, 2022 |
| 1566539 | CIF | C37 H33 N | C 1 2/c 1 | 35.402; 9.1778; 17.961 90; 110.844; 90 | 5453.8 | Duan, Shengzu; Zi, Yujin; Wang, Lingling; Cong, Jielun; Chen, Wen; Li, Minyan; Zhang, Hongbin; Yang, Xiaodong; Walsh, Patrick α-Branched Amines through Radical Coupling with 2-Azaallyl Anions, Redox Active Esters and Alkenes Chemical Science, 2022 |
| 1566540 | CIF | C21 H15 Cl F3 N3 O2 | P 1 21/n 1 | 15.287; 15.859; 17.629 90; 114.523; 90 | 3888 | Yang, Hefei; Wang, Le-Cheng; Zhang, Yu; Zheng, Dongling; Chen, Zhengkai; Wu, Xiao-Feng Controllable access to trifluoromethyl-containing indoles and indolines: Palladium-catalyzed regioselective functionalization of unactivated alkenes with trifluoroacetimidoyl chlorides Chemical Science, 2022 |
| 1566541 | CIF | C22 H15 F3 N3 O | P 1 21/c 1 | 15.6657; 33.014; 7.2436 90; 98.651; 90 | 3703.7 | Yang, Hefei; Wang, Le-Cheng; Zhang, Yu; Zheng, Dongling; Chen, Zhengkai; Wu, Xiao-Feng Controllable access to trifluoromethyl-containing indoles and indolines: Palladium-catalyzed regioselective functionalization of unactivated alkenes with trifluoroacetimidoyl chlorides Chemical Science, 2022 |
| 1566542 | CIF | C492 H528 N48 O60 | P 3 c 1 | 32.5182; 32.5182; 51.424 90; 90; 120 | 47092 | Xu, Ning; Su, Kongzhao; M. El-Sayed, El-Sayed; Ju, Zhanfeng; Yuan, Daqiang Chiral Proline-Substituted Porous Organic Cages in Asymmetric Organocatalysis Chemical Science, 2022 |
| 1566543 | CIF | C280 H320 N32 O40 | P 1 | 28.4101; 30.2731; 32.7364 82.444; 81.795; 63.273 | 24818 | Xu, Ning; Su, Kongzhao; M. El-Sayed, El-Sayed; Ju, Zhanfeng; Yuan, Daqiang Chiral Proline-Substituted Porous Organic Cages in Asymmetric Organocatalysis Chemical Science, 2022 |
| 1566544 | CIF | C28 H28 Br Cl Cu N6 O2 | P 1 21/c 1 | 16.1127; 8.9758; 19.2463 90; 103.825; 90 | 2702.85 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566545 | CIF | C28 H28 Cl Cu N6 O1.5 | P 1 21/c 1 | 15.0147; 34.2629; 10.2999 90; 107.565; 90 | 5051.7 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566546 | CIF | C32 H39 Cl3 Cu N8 O3 | P 1 | 7.2313; 9.2604; 14.1201 78.16; 77.214; 70.423 | 859.9 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566547 | CIF | C60 H63 Br2 Cl N14 Ni O4 | P -1 | 9.7632; 15.6735; 19.622 87.172; 75.925; 85.319 | 2901.4 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566548 | CIF | C33 H39 Cl Cu N8 O3 | C 1 2/c 1 | 37.667; 10.5159; 19.22 90; 118.948; 90 | 6661.9 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566549 | CIF | C26 H23 Br N6 O | P -1 | 12.22; 12.7328; 16.424 76.485; 82.598; 67.698 | 2296.6 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566550 | CIF | C12 H16 N2 O2 | P -1 | 7.7366; 7.9072; 10.7395 99.872; 102.594; 113.64 | 562.21 | Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B. Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile. Journal of medicinal chemistry, 2022, 65, 2238-2261 |
| 1566551 | CIF | C17 H29 N O | P 1 21 1 | 7.18; 4.628; 48.944 90; 92.55; 90 | 1624.8 | Wu, Zhen-Long; Zhang, Wei-Yan; Zhong, Jin-Cheng; Huang, Xiao-Jun; Xu, Wei; Chen, Min-Feng; Weng, Shao-Quan; Zhang, Dong-Mei; Che, Chun-Tao; Ye, Wen-Cai; Wang, Ying Angiogenesis-Inhibitory Piperidine Alkaloids from the Leaves of <i>Microcos paniculata</i>. Journal of natural products, 2022, 85, 375-383 |
| 1566552 | CIF | C17 H31 N O3 | P 1 21 1 | 12.37896; 5.01515; 13.9105 90; 99.1891; 90 | 852.51 | Wu, Zhen-Long; Zhang, Wei-Yan; Zhong, Jin-Cheng; Huang, Xiao-Jun; Xu, Wei; Chen, Min-Feng; Weng, Shao-Quan; Zhang, Dong-Mei; Che, Chun-Tao; Ye, Wen-Cai; Wang, Ying Angiogenesis-Inhibitory Piperidine Alkaloids from the Leaves of <i>Microcos paniculata</i>. Journal of natural products, 2022, 85, 375-383 |
| 1566553 | CIF | C16 H27 N O | P 21 21 21 | 5.1556; 9.493; 31.8376 90; 90; 90 | 1558.2 | Wu, Zhen-Long; Zhang, Wei-Yan; Zhong, Jin-Cheng; Huang, Xiao-Jun; Xu, Wei; Chen, Min-Feng; Weng, Shao-Quan; Zhang, Dong-Mei; Che, Chun-Tao; Ye, Wen-Cai; Wang, Ying Angiogenesis-Inhibitory Piperidine Alkaloids from the Leaves of <i>Microcos paniculata</i>. Journal of natural products, 2022, 85, 375-383 |
| 1566554 | CIF | C16 H25 N O | P 21 21 21 | 5.0809; 9.5095; 31.1268 90; 90; 90 | 1503.95 | Wu, Zhen-Long; Zhang, Wei-Yan; Zhong, Jin-Cheng; Huang, Xiao-Jun; Xu, Wei; Chen, Min-Feng; Weng, Shao-Quan; Zhang, Dong-Mei; Che, Chun-Tao; Ye, Wen-Cai; Wang, Ying Angiogenesis-Inhibitory Piperidine Alkaloids from the Leaves of <i>Microcos paniculata</i>. Journal of natural products, 2022, 85, 375-383 |
| 1566555 | CIF | C21 H22 O8 S | P 1 21/c 1 | 9.3577; 25.184; 9.0558 90; 96.873; 90 | 2118.8 | Xu, Yanchao; Liu, Wen; Wu, Dan; He, Wenwen; Zuo, Mingxing; Wang, Dongyang; Fu, Peng; Wang, Liping; Zhu, Weiming Sulfur-Containing Phenolic Compounds from the Cave Soil-Derived <i>Aspergillus fumigatus</i> GZWMJZ-152. Journal of natural products, 2022, 85, 433-440 |
| 1566556 | CIF | C9 H9 N O3 S | P 21 21 21 | 8.2204; 8.5993; 13.4964 90; 90; 90 | 954.06 | Xu, Yanchao; Liu, Wen; Wu, Dan; He, Wenwen; Zuo, Mingxing; Wang, Dongyang; Fu, Peng; Wang, Liping; Zhu, Weiming Sulfur-Containing Phenolic Compounds from the Cave Soil-Derived <i>Aspergillus fumigatus</i> GZWMJZ-152. Journal of natural products, 2022, 85, 433-440 |
| 1566557 | CIF | C19 H20 O8 S | P -1 | 8.1509; 10.0095; 12.0777 106.945; 90.36; 90.567 | 942.51 | Xu, Yanchao; Liu, Wen; Wu, Dan; He, Wenwen; Zuo, Mingxing; Wang, Dongyang; Fu, Peng; Wang, Liping; Zhu, Weiming Sulfur-Containing Phenolic Compounds from the Cave Soil-Derived <i>Aspergillus fumigatus</i> GZWMJZ-152. Journal of natural products, 2022, 85, 433-440 |
| 1566558 | CIF | C21 H22 O9 S | P -1 | 8.1167; 9.0623; 15.8947 86.54; 87.286; 65.417 | 1060.92 | Xu, Yanchao; Liu, Wen; Wu, Dan; He, Wenwen; Zuo, Mingxing; Wang, Dongyang; Fu, Peng; Wang, Liping; Zhu, Weiming Sulfur-Containing Phenolic Compounds from the Cave Soil-Derived <i>Aspergillus fumigatus</i> GZWMJZ-152. Journal of natural products, 2022, 85, 433-440 |
| 1566559 | CIF | Bi O2 | P 1 21/m 1 | 11.6212; 3.4067; 7.3247 90; 99.9889; 90 | 285.589 | Feng, Xuezhen; Zou, Haiyuan; Zheng, Renji; Wei, Wenfei; Wang, Ranhao; Zou, Wensong; Lim, Gukhyun; Hong, Jihyun; Duan, Lele; Chen, Hong Bi<sub>2</sub>O<sub>3</sub>/BiO<sub>2</sub> Nanoheterojunction for Highly Efficient Electrocatalytic CO<sub>2</sub> Reduction to Formate. Nano letters, 2022, 22, 1656-1664 |
| 1566560 | CIF HKL Paper | C6 H13 Cl6 N3 O2 Sn | P -1 | 7.4224; 7.4518; 8.4986 105.726; 97.426; 112.383 | 403.85 | Ghallab, Rochdi; Bougueria, Hassiba; Merazig, Hocine 4-Amidinopyridinium hexachloridostannate(IV) dihydrate IUCrData, 2022, 7, x220195 |
| 1566561 | CIF HKL Paper | C10 H14 Cl10 N4 O2 Sn | P -1 | 7.4624; 8.4715; 10.1324 101.434; 90.043; 107.554 | 597.34 | Ghallab, Rochdi; Bougueria, Hassiba; Merazig, Hocine Bis(2-amino-3,5-dichloropyridinium) hexachloridostannate(IV) dihydrate IUCrData, 2022, 7, x220191 |
| 1566562 | CIF | C34 H38 Au2 O4 P2 S2 | P 1 21/n 1 | 11.7462; 39.197; 15.6529 90; 107.882; 90 | 6858.7 | Duminy, Welni; Pillay, Michael N.; van Zyl, Werner E. Silver(I) and Gold(I) Monothiocarbonate Complexes: Synthesis, Structure, Luminescence Inorganics, 2022, 10, 19 |
| 1566563 | CIF | C17 H22 O10 | P 21 21 21 | 7.776; 8.6993; 26.8196 90; 90; 90 | 1814.23 | Chen, Jianwei; Chen, Jun; Wang, Siqi; Bao, Xiaoze; Li, Songwei; Wei, Bin; Zhang, Huawei; Wang, Hong Amycolachromones A–F, Isolated from a Streptomycin-Resistant Strain of the Deep-Sea Marine Actinomycete Amycolatopsis sp. WP1 Marine Drugs, 2022, 20, 162 |
| 1566564 | CIF | C1.21 H1.21 O0.6 | P 21 21 21 | 7.776; 8.6993; 26.8196 90; 90; 90 | 1814.23 | Chen, Jianwei; Chen, Jun; Wang, Siqi; Bao, Xiaoze; Li, Songwei; Wei, Bin; Zhang, Huawei; Wang, Hong Amycolachromones A–F, Isolated from a Streptomycin-Resistant Strain of the Deep-Sea Marine Actinomycete Amycolatopsis sp. WP1 Marine Drugs, 2022, 20, 162 |
| 1566565 | CIF | C13.25 H13.25 O13.25 | P 21 21 21 | 7.776; 8.6993; 26.8196 90; 90; 90 | 1814.23 | Chen, Jianwei; Chen, Jun; Wang, Siqi; Bao, Xiaoze; Li, Songwei; Wei, Bin; Zhang, Huawei; Wang, Hong Amycolachromones A–F, Isolated from a Streptomycin-Resistant Strain of the Deep-Sea Marine Actinomycete Amycolatopsis sp. WP1 Marine Drugs, 2022, 20, 162 |
| 1566566 | CIF | C17 H22 O10 | P 21 21 21 | 7.776; 8.6993; 26.8196 90; 90; 90 | 1814.23 | Chen, Jianwei; Chen, Jun; Wang, Siqi; Bao, Xiaoze; Li, Songwei; Wei, Bin; Zhang, Huawei; Wang, Hong Amycolachromones A–F, Isolated from a Streptomycin-Resistant Strain of the Deep-Sea Marine Actinomycete Amycolatopsis sp. WP1 Marine Drugs, 2022, 20, 162 |
| 1566567 | CIF | C36 H31 N5 O | P -1 | 7.8563; 9.2517; 21.803 95.923; 98.136; 96.538 | 1547.1 | Guillon, Jean; Savrimoutou, Solène; Albenque-Rubio, Sandra; Pinaud, Noël; Moreau, Stéphane; Desplat, Vanessa Synthesis, Crystal Structure and Anti-Leukemic Activity of 1,3-Dihydro-1-{1-[4-(4-phenylpyrrolo[1,2-a]quinoxalin-3-yl)benzyl]piperidin-4-yl}-2H-benzimidazol-2-one Molbank, 2022, 2022, M1333 |
| 1566568 | CIF | C80 H110 Cu4 O2 P6 | P 1 21/n 1 | 17.127; 19.946; 23.841 90; 105.715; 90 | 7840 | Dannenberg, Steven G.; Waterman, Rory Cyclo-Tetrakis(μ-diphenylphosphido)-1,5-bis(tri-tert-butylphosphine)-Tetracopper Molbank, 2022, 2022, M1334 |
| 1566569 | CIF | C28 H37 Cl4 I N2 S | P 1 21/n 1 | 10.5912; 18.7089; 16.071 90; 102.093; 90 | 3113.8 | Saab, Marina; Nahra, Fady; Van Hecke, Kristof Charge-Transfer Adducts of Chalcogenourea Derivatives of N-Heterocyclic Carbenes with Iodine Monochloride Molbank, 2022, 2022, M1344 |
| 1566570 | CIF | C30 H42 Cl3 I N2 Se | P 1 21/n 1 | 9.741; 16.9218; 19.8068 90; 97.399; 90 | 3237.67 | Saab, Marina; Nahra, Fady; Van Hecke, Kristof Charge-Transfer Adducts of Chalcogenourea Derivatives of N-Heterocyclic Carbenes with Iodine Monochloride Molbank, 2022, 2022, M1344 |
| 1566571 | CIF | C20 H24 N6 O4 | P -1 | 9.6243; 9.859; 12.5952 68.645; 72.467; 75.23 | 1047.06 | Lopes, Susana M. M.; Lemos, Américo; Paixão, José A.; Pinho e Melo, Teresa M. V. D. Ethyl 7-Acetyl-8a-methyl-3-(1-phenyl-1H-tetrazol-5-yl)-1,4,4a,5,6,8a-hexahydro-7H-pyrano[2,3-c]pyridazine-1-carboxylate Molbank, 2022, 2022, M1338 |
| 1566572 | CIF | C26 H31 N O12 | P 1 21 1 | 10.1989; 8.7455; 15.8721 90; 99.068; 90 | 1398.01 | Fitzgerald, Liam S.; O’Malley, Ciaran; Murphy, Paul V. (1R,2R,3S,4R)-1-(Acetylamino)-2,4,5-tris(acetyloxy)-1-((2S)-4-(benzyloxy)-5-oxo-2,5-dihydrofuran-2-yl)pentan-3-yl Acetate Molbank, 2022, 2022, M1337 |
| 1566573 | CIF | C13 H13 Cl N2 | P 1 21/c 1 | 9.4547; 16.2237; 7.9004 90; 104.169; 90 | 1174.98 | Adeleke, Adesola A.; Omondi, Bernard Crystal Structure of a Chiral Sec-Amine, 4-Chloro-N-(1-(pyridin-2-yl)ethyl)aniline Molbank, 2022, 2022, M1335 |
| 1566574 | CIF | C11 H10 N4 O3 | C 1 c 1 | 23.794; 5.347; 8.9367 90; 96.216; 90 | 1130.3 | Pokhodylo, Nazariy T.; Slyvka, Yuriy I.; Goreshnik, Evgeny A.; Obushak, Mykola D. Ethyl 5-Formyl-1-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylate: Synthesis, Crystal Structure, Hirshfeld Surface Analysis, and DFT Calculation Molbank, 2022, 2022, M1340 |
| 1566575 | CIF | C14 H16 Co N2 O12 | P 1 21/n 1 | 6.9863; 23.7443; 10.6564 90; 100.456; 90 | 1738.38 | Xia, Zhengyao; Li, Yan; Ji, Cheng; Jiang, Yucheng; Ma, Chunlan; Gao, Ju; Zhang, Jinlei Slow-Relaxation Behavior of a Mononuclear Co(II) Complex Featuring Long Axial Co-O Bond. Nanomaterials (Basel, Switzerland), 2022, 12, 707 |
| 1566576 | CIF | C70 H81 B N2 O4 | P 1 21/c 1 | 25.398; 21.296; 11.522 90; 96.49; 90 | 6192 | Han, Jianmei; Huang, Zhongyan; Miao, Jingsheng; Qiu, Yuntao; Xie, Ziyang; Yang, Chuluo Narrowband blue emission with insensitivity to the doping concentration from an oxygen-bridged triarylboron-based TADF emitter: nondoped OLEDs with a high external quantum efficiency up to 21.4% Chemical Science, 2022 |
| 1566577 | CIF | C20 H46 Cl N2 P2 Re | P 1 21/n 1 | 8.5852; 23.581; 12.2292 90; 92.515; 90 | 2473.39 | Connor, Gannon P.; Delony, Daniel; Weber, Jeremy E.; Mercado, Brandon Q.; Curley, Julia B.; Schneider, Sven; Mayer, James M.; Holland, Patrick L. Facile conversion of ammonia to a nitride in a rhenium system that cleaves dinitrogen Chemical Science, 2022 |
| 1566578 | CIF | C54 H67 B Cl F24 N3 O0.5 P2 Re | P -1 | 12.2681; 15.3208; 17.9247 92.777; 109.357; 97.022 | 3140.5 | Connor, Gannon P.; Delony, Daniel; Weber, Jeremy E.; Mercado, Brandon Q.; Curley, Julia B.; Schneider, Sven; Mayer, James M.; Holland, Patrick L. Facile conversion of ammonia to a nitride in a rhenium system that cleaves dinitrogen Chemical Science, 2022 |
| 1566579 | CIF | C14 H22 O | P 41 | 10.0087; 10.0087; 12.7456 90; 90; 90 | 1276.78 | Pan, Aaron; Chojnacka, Maja; Crowley, Robert; Göttemann, Lucas; Haines, Brandon E.; Kou, Kevin G. M. Synergistic Brønsted/Lewis acid catalyzed aromatic alkylation with unactivated tertiary alcohols or di-tert-butylperoxide to synthesize quaternary carbon centers Chemical Science, 2022 |
| 1566580 | CIF | C261 H476 Ag55 Cu3 F3 Mo8 O38 S43 | P -1 | 23.3674; 23.7497; 38.3998 73.33; 75.236; 73.633 | 19233.6 | Gao, Jin-Ping; Qi, Zhikai; Zhang, Fu-Qiang; Zhang, Xian-Ming In situ insertion of copper to form heteroanionic D3h-symmetric [Cu3Mo8O32]10− for a templated Ag55 nanocluster Nanoscale, 2022 |
| 1566581 | CIF Paper | C68.39 H67.65 Cl6 N12 O4 Zn3 | C 1 2/c 1 | 33.3132; 14.4948; 31.7714 90; 102.245; 90 | 14992.4 | Meurer, Florian; von Essen, Carolina; Kühn, Clemens; Puschmann, Horst; Bodensteiner, Michael The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges IUCrJ, 2022, 9 |
| 1566582 | CIF | C68.62 H68.92 Cl6 N12 O4 Zn3 | C 1 2/c 1 | 33.306; 14.488; 31.8026 90; 102.247; 90 | 14996.7 | Meurer, Florian; von Essen, Carolina; Kühn, Clemens; Puschmann, Horst; Bodensteiner, Michael The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges IUCrJ, 2022, 9 |
| 1566583 | CIF | C54.5 H43 I6 N12 O4 Zn3 | C 1 2/c 1 | 34.4866; 14.9746; 31.0009 90; 101.933; 90 | 15663.6 | Meurer, Florian; von Essen, Carolina; Kühn, Clemens; Puschmann, Horst; Bodensteiner, Michael The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges IUCrJ, 2022, 9 |
| 1566584 | CIF | C55 H42 I6 N12 O4 Zn3 | C 1 2/c 1 | 34.4862; 15.0052; 31.125 90; 101.958; 90 | 15756.8 | Meurer, Florian; von Essen, Carolina; Kühn, Clemens; Puschmann, Horst; Bodensteiner, Michael The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges IUCrJ, 2022, 9 |
| 1566585 | CIF | C63 H78 I6 N12 Zn3 | C 1 2/c 1 | 34.5713; 15.1587; 29.5198 90; 100.649; 90 | 15203.6 | Meurer, Florian; von Essen, Carolina; Kühn, Clemens; Puschmann, Horst; Bodensteiner, Michael The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges IUCrJ, 2022, 9 |
| 1566586 | CIF | C64.69 H81.39 I6 N12 Zn3 | C 1 2/c 1 | 34.595; 15.1725; 29.535 90; 100.647; 90 | 15235.8 | Meurer, Florian; von Essen, Carolina; Kühn, Clemens; Puschmann, Horst; Bodensteiner, Michael The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges IUCrJ, 2022, 9 |
| 1566587 | CIF | C25 H21 F3 N2 O3 S | P 1 21/c 1 | 15.2479; 19.58181; 16.7407 90; 116.095; 90 | 4488.95 | Dai, Yating; Liang, Shuangshuang; Zeng, Guangkuo; Huang, Hongchun; Zhao, Xiaowei; Cao, Shanshan; Jiang, Zhiyong Asymmetric [3 + 2] photocycloadditions of cyclopropylamines with electron-rich and electron-neutral olefins Chemical Science, 2022 |
| 1566588 | CIF | C36 H32 F3 N O5 S | C 1 2 1 | 29.3277; 7.49483; 18.2663 90; 124.382; 90 | 3313.6 | Dai, Yating; Liang, Shuangshuang; Zeng, Guangkuo; Huang, Hongchun; Zhao, Xiaowei; Cao, Shanshan; Jiang, Zhiyong Asymmetric [3 + 2] photocycloadditions of cyclopropylamines with electron-rich and electron-neutral olefins Chemical Science, 2022 |
| 1566589 | CIF | C33 H34 Cl N O2 | P 1 21 1 | 11.1324; 7.5493; 16.7445 90; 90.526; 90 | 1407.18 | Dai, Yating; Liang, Shuangshuang; Zeng, Guangkuo; Huang, Hongchun; Zhao, Xiaowei; Cao, Shanshan; Jiang, Zhiyong Asymmetric [3 + 2] photocycloadditions of cyclopropylamines with electron-rich and electron-neutral olefins Chemical Science, 2022 |
| 1566590 | CIF | C30 H29 Cl N2 O3 | P 21 21 21 | 12.3663; 16.7129; 25.3786 90; 90; 90 | 5245.17 | Dai, Yating; Liang, Shuangshuang; Zeng, Guangkuo; Huang, Hongchun; Zhao, Xiaowei; Cao, Shanshan; Jiang, Zhiyong Asymmetric [3 + 2] photocycloadditions of cyclopropylamines with electron-rich and electron-neutral olefins Chemical Science, 2022 |
| 1566591 | CIF | C25 H25 O2 P | P 21 21 21 | 5.89107; 16.00327; 22.3169 90; 90; 90 | 2103.96 | Zhang, Ya-Qian; Zhang, Qingwei; Han, Xue-Yu; Wu, Yue; Qi, Peng-Jia; Zhang, Qing Ni-Catalyzed Asymmetric Hydrophosphinylation of Conjugated Enynes and Mechanistic Studies Chemical Science, 2022 |
| 1566592 | CIF | C23 H22 O3 S | P 1 | 7.2748; 12.2905; 12.5063 63.599; 79.446; 75.302 | 965.6 | Li, Yanjun; Liou, Yan-Cheng; Chen, Xinran; Ackermann, Lutz Thioether-enabled palladium-catalyzed atroposelective C–H olefination for N−C and C−C axial chirality Chemical Science, 2022 |
| 1566593 | CIF | C20 H20 N2 O S | P 1 21 1 | 11.0831; 6.8389; 12.0729 90; 109.142; 90 | 864.48 | Li, Yanjun; Liou, Yan-Cheng; Chen, Xinran; Ackermann, Lutz Thioether-enabled palladium-catalyzed atroposelective C–H olefination for N−C and C−C axial chirality Chemical Science, 2022 |
| 1566594 | CIF HKL Paper | C15 H26 I N3 O6 | P 1 21 1 | 10.816; 7.0106; 13.169 90; 106.833; 90 | 955.8 | Lambrecht, Sina; Villinger, Alexander; Jopp, Stefan 1-(Methyl-α-<small>D</small>-glucopyranosid-6-yl)-3-vinylimidazolium iodide dimethylformamide monosolvate IUCrData, 2022, 7, x220265 |
| 1566595 | CIF HKL Paper | C77 H83 Cl4 K Mn N6 O8 S | P b c a | 19.5585; 24.7224; 29.8538 90; 90; 90 | 14435.3 | Yuan, Yiwen; Li, Jianfeng ([2.2.2]Cryptand)potassium (4-methylbenzenethiolato)[5,10,15,20-tetrakis(4-chlorophenyl)porphyrinato]manganate(II) tetrahydrofuran disolvate IUCrData, 2022, 7, x220241 |
| 1566596 | CIF HKL Paper | C17 H15 B F4 N2 | P 1 21/n 1 | 11.426; 9.0735; 15.5434 90; 102.118; 90 | 1575.54 | Welton, Claire E.; Nesterov, Vladimir N.; Smucker, Bradley W. 1-(2-Methylphenyl)-4,4'-bipyridin-1-ium tetrafluoridoborate IUCrData, 2022, 7, x220248 |
| 1566597 | CIF | C28 H24 O6 S2 | P 21 21 21 | 9.2608; 14.3014; 18.9339 90; 90; 90 | 2507.65 | Hu, Linfeng; Li, Jinzhao; Zhang, Yongyan; Feng, Xiaoming; Liu, Xiaohua Enantioselective [1,2]-Stevens Rearrangement of Thiosulfonates to Construct Dithio-Substituted Quaternary Carbon Centers Chemical Science, 2022 |
| 1566598 | CIF | C33 H43 Cl2 Cr N2 O2 | P -1 | 16.326; 16.389; 16.464 70.953; 89.935; 71.859 | 3932.2 | Tian, Jiliang; Zhang, Xingwang; Liu, Shaofeng; Li, Zhibo Chromium complexes supported by NNO-tridentate ligands: an unprecedented activity with the requirement of a small amount of MAO Polymer Chemistry, 2022, 13, 1852-1860 |
| 1566599 | CIF | C31 H37 Cl2 Cr F2 N2 O2 | P 1 21/c 1 | 14.4764; 14.5398; 15.5208 90; 109.539; 90 | 3078.75 | Tian, Jiliang; Zhang, Xingwang; Liu, Shaofeng; Li, Zhibo Chromium complexes supported by NNO-tridentate ligands: an unprecedented activity with the requirement of a small amount of MAO Polymer Chemistry, 2022, 13, 1852-1860 |
| 1566600 | CIF | C36 H48 Ca Gd K O3 | P 1 21/c 1 | 9.2772; 13.9703; 26.2056 90; 90.079; 90 | 3396.4 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566601 | CIF | C36 H48 Ca Er K O3 | P 1 21/c 1 | 9.2555; 13.9514; 26.113 90; 90.709; 90 | 3371.6 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566602 | CIF | C36 H48 Ca Dy K O3 | P 1 21/c 1 | 9.2628; 13.9533; 26.1417 90; 90.377; 90 | 3378.7 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566603 | CIF | C36 H48 Ca Ho K O3 | P 1 21/c 1 | 9.2613; 13.9568; 26.1226 90; 90.566; 90 | 3376.4 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566604 | CIF | C36 H48 Ca K O3 Tm | P 1 21/c 1 | 9.2649; 13.9648; 26.111 90; 90.8583; 90 | 3377.9 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566605 | CIF | C36 H48 Ca K O3 Tb | P 1 21/c 1 | 9.2738; 13.9561; 26.155 90; 90.302; 90 | 3385.1 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566606 | CIF | C36 H48 Ca K O3 Yb | P 1 21/c 1 | 9.2602; 13.9561; 26.1046 90; 90.935; 90 | 3373.2 | Zhou, Zheng; McNeely, James; Greenough, Joshua; Wei, Zheng; Han, Haixiang; Rouzières, Mathieu; Rogachev, Andrey Yu.; Clérac, Rodolphe; Petrukhina, Marina A. Lanthanide-mediated tuning of electronic and magnetic properties in heterotrimetallic cyclooctatetraenyl multidecker self-assemblies Chemical Science, 2022 |
| 1566607 | CIF | C92 H166 Fe N4 O28 Si16 | P 21 21 21 | 16.2474; 17.2899; 46.6858 90; 90; 90 | 13114.8 | Zong, Zhaohui; Hao, Aiyou; Xing, Pengyao; Zhao, Yanli Chiral Molecular Nanosilicas Chemical Science, 2022 |
| 1566608 | CIF | C92 H182 Fe N4 O32 Si16 | P 1 21 1 | 16.9205; 17.5657; 21.7093 90; 90.98; 90 | 6451.5 | Zong, Zhaohui; Hao, Aiyou; Xing, Pengyao; Zhao, Yanli Chiral Molecular Nanosilicas Chemical Science, 2022 |
| 1566609 | CIF | C76.5 Fe N4 O27.5 S2 Si16 | I 1 2 1 | 37.4731; 17.2234; 42.6209 90; 103.053; 90 | 26797.4 | Zong, Zhaohui; Hao, Aiyou; Xing, Pengyao; Zhao, Yanli Chiral Molecular Nanosilicas Chemical Science, 2022 |
| 1566610 | CIF | Cl Ga6 K3 Mn2 S12 | P 3 1 c | 10.9208; 10.9208; 6.1774 90; 90; 120 | 638.04 | Liu, Bin-Wen; Pei, Shao-Min; Jiang, Xiao-Ming; Guo, Guo-Cong Broad transparency and wide band gap achieved in a magnetic infrared nonlinear optical chalcogenide by suppressing d-d transitions. Materials horizons, 2022, 9, 1513-1517 |
| 1566611 | CIF | C28 H41 F O4 | P 1 21 1 | 10.3779; 7.2974; 33.47 90; 98.797; 90 | 2504.9 | Jiang, Liyin; Sarró, Pau; Teo, Wei Jie; Llop, Jordi; Suero, Marcos Catalytic alkene skeletal modification for the construction of fluorinated tertiary stereocenters Chemical Science, 2022 |
| 1566612 | CIF | C26 H39 F O4 | C 1 2 1 | 14.7648; 6.0876; 26.974 90; 96.281; 90 | 2409.9 | Jiang, Liyin; Sarró, Pau; Teo, Wei Jie; Llop, Jordi; Suero, Marcos Catalytic alkene skeletal modification for the construction of fluorinated tertiary stereocenters Chemical Science, 2022 |
| 1566613 | CIF | C227 H209 Ag6 Au19 B2 F8 O17 P6 S17 | P -1 | 20.4536; 20.7898; 33.6586 72.945; 82.104; 63.917 | 12289 | Shi, Wan-Qi; Guan, Zong-Jie; Li, Jiao-Jiao; Han, Xu-Shuang; Wang, Quan-Ming Site-Specified Doping of Silver Atoms into Au25 Nanocluster as Directed by Ligand Binding Preference Chemical Science, 2022 |
| 1566614 | CIF | C66 H72 N4 Ni Si4 | P -1 | 11.7807; 11.8079; 22.9033 80.502; 78.053; 71.215 | 2934.25 | Shimamoto, Kento; Sunada, Yusuke Metalation-Induced Denitrogenative Reductive Coupling of Isocyanides on a Silylene-Bridged Nickel Cluster Chemical Science, 2022 |
| 1566615 | CIF | C34 H29 N2 Si2 | P -1 | 10.31; 12.326; 12.941 77.219; 79.312; 79.801 | 1560 | Shimamoto, Kento; Sunada, Yusuke Metalation-Induced Denitrogenative Reductive Coupling of Isocyanides on a Silylene-Bridged Nickel Cluster Chemical Science, 2022 |
| 1566616 | CIF | C83 H103 N7 Ni5 Si4 | P -1 | 13.9645; 14.7686; 24.4091 89.5959; 79.412; 63.052 | 4394.3 | Shimamoto, Kento; Sunada, Yusuke Metalation-Induced Denitrogenative Reductive Coupling of Isocyanides on a Silylene-Bridged Nickel Cluster Chemical Science, 2022 |
| 1566617 | CIF | C73 H85 N5 Ni2 Si4 | P -1 | 14.392; 22.272; 22.51 97.75; 95.438; 102.855 | 6912 | Shimamoto, Kento; Sunada, Yusuke Metalation-Induced Denitrogenative Reductive Coupling of Isocyanides on a Silylene-Bridged Nickel Cluster Chemical Science, 2022 |
| 1566618 | CIF | C35 H48 N P | P -1 | 10.677; 11.8045; 12.4452 96.831; 101.037; 111.157 | 1405.1 | Chen, Zicong; Gu, Changxue; Yuen, On Ying; So, Chau Ming Palladium-catalyzed chemoselective direct α-arylation of carbonyl compounds with chloroaryl triflates at the C–Cl site Chemical Science, 2022 |
| 1566619 | CIF | C42 H34 B F3 P2 Se | P -1 | 9.6724; 12.8821; 14.5407 84.961; 77.687; 74.085 | 1701.43 | Kelty, Margaret L.; McNeece, Andrew J.; Kurutz, Josh W.; Filatov, Alexander S.; Anderson, John S. Electrostatic vs. Inductive Effects in Phosphine Ligand Donor Properties and Reactivity Chemical Science, 2022 |
| 1566620 | CIF | C43 H39 B F3 O3 P2 Rh | P -1 | 9.1533; 13.0253; 33.273 83.172; 88.634; 79.181 | 3868.8 | Kelty, Margaret L.; McNeece, Andrew J.; Kurutz, Josh W.; Filatov, Alexander S.; Anderson, John S. Electrostatic vs. Inductive Effects in Phosphine Ligand Donor Properties and Reactivity Chemical Science, 2022 |
| 1566621 | CIF | C36.96 H31.91 B0.95 F2.87 I0.05 P2 Se0.95 | P n a 21 | 14.5444; 19.8328; 11.0256 90; 90; 90 | 3180.4 | Kelty, Margaret L.; McNeece, Andrew J.; Kurutz, Josh W.; Filatov, Alexander S.; Anderson, John S. Electrostatic vs. Inductive Effects in Phosphine Ligand Donor Properties and Reactivity Chemical Science, 2022 |
| 1566622 | CIF | C15 H16 B F3 K O0.5 P | P -1 | 5.6907; 21.5917; 26.847 78.455; 89.976; 89.948 | 3232 | Kelty, Margaret L.; McNeece, Andrew J.; Kurutz, Josh W.; Filatov, Alexander S.; Anderson, John S. Electrostatic vs. Inductive Effects in Phosphine Ligand Donor Properties and Reactivity Chemical Science, 2022 |
| 1566623 | CIF | C91 H144 O10 | P -1 | 11.9787; 17.3956; 22.0177 110.06; 90.8994; 101.377 | 4207.6 | Onishi, Katsuto; Ohtani, Shunsuke; Kato, Kenichi; Fa, Shixin; Sakata, Yoko; Akine, Shigehisa; Ogasawara, Moe; Asakawa, Hitoshi; Nagano, Shusaku; Takashima, Yoshinori; Mizuno, Motohiro; Ogoshi, Tomoki State- and water repellency-controllable molecular glass of pillar[5]arenes with fluoroalkyl groups by guest vapors Chemical Science, 2022 |
| 1566624 | CIF | C16 H16 F10 O2 | P 1 21/a 1 | 11.164; 5.0419; 15.9267 90; 91.317; 90 | 896.2 | Onishi, Katsuto; Ohtani, Shunsuke; Kato, Kenichi; Fa, Shixin; Sakata, Yoko; Akine, Shigehisa; Ogasawara, Moe; Asakawa, Hitoshi; Nagano, Shusaku; Takashima, Yoshinori; Mizuno, Motohiro; Ogoshi, Tomoki State- and water repellency-controllable molecular glass of pillar[5]arenes with fluoroalkyl groups by guest vapors Chemical Science, 2022 |
| 1566625 | CIF | C108 H108 F60 O12 | C 1 2/c 1 | 69.979; 13.9205; 24.2019 90; 96.4154; 90 | 23428.5 | Onishi, Katsuto; Ohtani, Shunsuke; Kato, Kenichi; Fa, Shixin; Sakata, Yoko; Akine, Shigehisa; Ogasawara, Moe; Asakawa, Hitoshi; Nagano, Shusaku; Takashima, Yoshinori; Mizuno, Motohiro; Ogoshi, Tomoki State- and water repellency-controllable molecular glass of pillar[5]arenes with fluoroalkyl groups by guest vapors Chemical Science, 2022 |
| 1566626 | CIF | C81 H94 F30 O10 | P 1 21/a 1 | 23.6441; 22.5243; 31.147 90; 95.0726; 90 | 16522.9 | Onishi, Katsuto; Ohtani, Shunsuke; Kato, Kenichi; Fa, Shixin; Sakata, Yoko; Akine, Shigehisa; Ogasawara, Moe; Asakawa, Hitoshi; Nagano, Shusaku; Takashima, Yoshinori; Mizuno, Motohiro; Ogoshi, Tomoki State- and water repellency-controllable molecular glass of pillar[5]arenes with fluoroalkyl groups by guest vapors Chemical Science, 2022 |
| 1566627 | CIF | C91 H94 F50 O10 | P -1 | 20.9282; 22.7403; 24.2682 98.976; 98.951; 114.017 | 10108.6 | Onishi, Katsuto; Ohtani, Shunsuke; Kato, Kenichi; Fa, Shixin; Sakata, Yoko; Akine, Shigehisa; Ogasawara, Moe; Asakawa, Hitoshi; Nagano, Shusaku; Takashima, Yoshinori; Mizuno, Motohiro; Ogoshi, Tomoki State- and water repellency-controllable molecular glass of pillar[5]arenes with fluoroalkyl groups by guest vapors Chemical Science, 2022 |
| 1566628 | CIF | C90.65 H93.56 F50 O10 | P 1 21/n 1 | 22.9793; 21.8597; 40.474 90; 102.22; 90 | 19870 | Onishi, Katsuto; Ohtani, Shunsuke; Kato, Kenichi; Fa, Shixin; Sakata, Yoko; Akine, Shigehisa; Ogasawara, Moe; Asakawa, Hitoshi; Nagano, Shusaku; Takashima, Yoshinori; Mizuno, Motohiro; Ogoshi, Tomoki State- and water repellency-controllable molecular glass of pillar[5]arenes with fluoroalkyl groups by guest vapors Chemical Science, 2022 |
| 1566629 | CIF | C18 H26 Cd N4 O6 P2 S4 | P -1 | 7.2387; 9.6411; 10.4545 81.448; 75.399; 70.165 | 662.56 | Tan, Yee Seng; Yeo, Chien Ing; Kwong, Huey Chong; Tiekink, Edward R. T. Unusual {⋯HNC <sub>2</sub> O⋯HC <sub> <i>n</i> </sub> O}, <i>n</i> = 1 or 2, synthons predominate in the molecular packing of one-dimensional coordination polymers, {Cd[S <sub>2</sub> P(OR) <sub>2</sub> ] <sub>2</sub> ( <sup>3</sup> LH <sub>2</sub> )} <sub> <i>n</i> </sub> , for R = Me and Et, but are precluded when R = i-Pr; <sup>3</sup> LH <sub>2</sub> = <i>N</i> , <i>N</i> ′-bis(3-pyridylmethyl)oxalamide CrystEngComm, 2022, 24, 2992-3004 |
| 1566630 | CIF | C26 H42 Cd N4 O6 P2 S4 | P -1 | 9.9154; 12.3655; 15.4749 106.08; 99.172; 91.827 | 1794.03 | Tan, Yee Seng; Yeo, Chien Ing; Kwong, Huey Chong; Tiekink, Edward R. T. Unusual {⋯HNC <sub>2</sub> O⋯HC <sub> <i>n</i> </sub> O}, <i>n</i> = 1 or 2, synthons predominate in the molecular packing of one-dimensional coordination polymers, {Cd[S <sub>2</sub> P(OR) <sub>2</sub> ] <sub>2</sub> ( <sup>3</sup> LH <sub>2</sub> )} <sub> <i>n</i> </sub> , for R = Me and Et, but are precluded when R = i-Pr; <sup>3</sup> LH <sub>2</sub> = <i>N</i> , <i>N</i> ′-bis(3-pyridylmethyl)oxalamide CrystEngComm, 2022, 24, 2992-3004 |
| 1566631 | CIF | C22 H34 Cd N4 O6 P2 S4 | P -1 | 9.0611; 9.2065; 10.5703 82.436; 77.672; 64.113 | 774.27 | Tan, Yee Seng; Yeo, Chien Ing; Kwong, Huey Chong; Tiekink, Edward R. T. Unusual {⋯HNC <sub>2</sub> O⋯HC <sub> <i>n</i> </sub> O}, <i>n</i> = 1 or 2, synthons predominate in the molecular packing of one-dimensional coordination polymers, {Cd[S <sub>2</sub> P(OR) <sub>2</sub> ] <sub>2</sub> ( <sup>3</sup> LH <sub>2</sub> )} <sub> <i>n</i> </sub> , for R = Me and Et, but are precluded when R = i-Pr; <sup>3</sup> LH <sub>2</sub> = <i>N</i> , <i>N</i> ′-bis(3-pyridylmethyl)oxalamide CrystEngComm, 2022, 24, 2992-3004 |
| 1566632 | CIF | C78 H78 N6 O3 | P -1 | 14.2538; 17.1903; 17.3592 79.038; 72.546; 68.828 | 3767.7 | Fang, Lingyi; Zhang, Yuyan; Ren, Ming; Xie, Xinrui; Li, Tianyu; Yuan, Yi; Zhang, Jing; Wang, Peng A triple helicene based molecular semiconductor characteristic of a fully fused conjugated backbone for perovskite solar cells Energy & Environmental Science, 2022, 15, 1630-1637 |
| 1566633 | CIF | C15 H15 N3 O S | P 1 21/n 1 | 6.6492; 13.731; 15.329 90; 101.032; 90 | 1373.7 | Kshtriya, Vivekshinh; Koshti, Bharti; Mehmood, Tahir; Singh, Ramesh; Joshi, Khashti Ballabh; Bandyopadhyay, Sujoy; Boukhvalov, Danil W.; Reddy, J. Prakasha; Gour, Nidhi A new aggregation induced emission enhancement (AIEE) dye which self-assembles to panchromatic fluorescent flowers and has application in sensing dichromate ions. Soft matter, 2022, 18, 3019-3030 |
| 1566634 | CIF | D2 O | F d -3 m :2 | 6.356; 6.356; 6.356 90; 90; 90 | 256.774 | Komatsu, K.; Machida, S.; Noritake, F.; Hattori, T.; Sano-Furukawa, A.; Yamane, R.; Yamashita, K.; Kagi, H. Ice Ic without stacking disorder by evacuating hydrogen from hydrogen hydrate Nature Communications, 2020, 11, 464 |
| 1566635 | CIF | D2 O | F d -3 m :2 | 6.37451; 6.37451; 6.37451 90; 90; 90 | 259.024 | del Rosso, L.; Celli, M.; Grazzi, F.; Catti, M.; Hansen, T. C.; Fortes, A. D.; Ulivi, L. Cubic ice Ic without stacking defects obtained from ice XVII Nature Materials, 2020, 19, 663 |
| 1566636 | CIF | D2 O | R -3 :H | 12.91771; 12.91771; 6.22087 90; 90; 120 | 898.99 | Lobban, C.; Finney, J. L.; Kuhs, W. F. The p-T dependency of the ice II crystal structure and the effect of helium inclusion The Journal of Chemical Physics, 2002, 117, 3928 |
| 1566637 | CIF | D2 O | R -3 :R | 7.78; 7.78; 7.78 113.1; 113.1; 113.1 | 304 | Kamb, B.; Hamilton, W.C.; LaPlaca, S.J.; Prakash, A. Ordered Proton Configuration in Ice II, from Single - Crystal Neutron Diffraction The Journal of Chemical Physics, 1971, 55, 1934 |
| 1566638 | CIF | D2 O | P 41 21 2 | 6.676; 6.676; 6.955 90; 90; 90 | 309.98 | Lobban, C.; Finney, J. L.; Kuhs, W. F. The structure and ordering of ices III and V The Journal of Chemical Physics, 2000, 112, 7169 |
| 1566639 | CIF | D2 O | A 1 2/a 1 | 9.0926; 7.5409; 10.2547 90; 109.144; 90 | 664.24 | Lobban, C.; Finney, J. L.; Kuhs, W. F. The structure and ordering of ices III and V The Journal of Chemical Physics, 2000, 112, 7169 |
| 1566640 | CIF | D2 O | R -3 c :H | 8.67849; 8.67849; 17.0181 90; 90; 120 | 1110.02 | Lobban, C. Neutron diffraction studies of ices Ph.D. Thesis, The University of London, 1998, 209 |
| 1566641 | CIF | D2 O | P 42/n m c :2 | 6.21; 6.21; 5.73 90; 90; 90 | 220.972 | Kuhs, W. F.; Ahsbahs, H.; Londono, D.; Finney, J. L. In-situ crystal growth and neutron four-circle diffractometry under high pressure Physica B: Condensed Matter, 1989, 684 |
| 1566642 | CIF | D2 O | P n -3 m :2 | 3.344; 3.344; 3.344 90; 90; 90 | 37.39 | Kuhs, W. F.; Finney, J. L.; Vettier, C.; Bliss, D. V. Structure and hydrogen ordering in ices VI, VII, and VIII by neutron powder diffraction Journal of Chemical Physics, 1984, 81, 3612 |
| 1566643 | CIF | D2 O | I 41/a m d :2 | 4.669; 4.669; 6.81 90; 90; 90 | 148.46 | Kuhs, W. F.; Finney, J. L.; Vettier, C.; Bliss, D. V. Structure and hydrogen ordering in ices VI, VII, and VIII by neutron powder diffraction Journal of Chemical Physics, 1984, 81, 3612 |
| 1566644 | CIF | D2 O | P 41 21 2 | 6.73; 6.73; 6.83 90; 90; 90 | 309.4 | La Placa, S. J.; Hamilton, W. C.; Kamb, B.; Prakash, A. On a nearly proton-ordered structure for ice IX The Journal of Chemical Physics, 1973, 58, 567 |
| 1566645 | CIF | D2 O | C m c 21 | 4.5019; 7.7978; 7.328 90; 90; 90 | 257.25 | Leadbetter, A. J.; Ward, R. C.; Clark, J. W.; Tucker, P. A.; Matsuo, T.; Suga, H. The equilibrium low-temperature structure of ice The Journal of Chemical Physics, 1985, 82, 424 |
| 1566646 | CIF | D2 O | I -4 2 d | 8.304; 8.304; 4.024 90; 90; 90 | 277.481 | Lobban, C.; Finney, J. L.; Kuhs, W. F. The structure of a new phase of ice Nature, 1998, 391, 268 |
| 1566647 | CIF | D2 O | P 1 21/a 1 | 9.2417; 7.4724; 10.297 90; 109.687; 90 | 669.521 | Salzmann, C. G.; Radaelli, P. G.; Hallbrucker, A.; Mayer, E.; Finney, J. L. The preparation and structures of hydrogen ordered phases of ice Science, 2006, 311, 1758 |
| 1566648 | CIF | D2 O | P 21 21 21 | 8.3499; 8.1391; 4.0825 90; 90; 90 | 277.449 | Salzmann, C. G.; Radaelli, P. G.; Hallbrucker, A.; Mayer, E.; Finney, J. L. The preparation and structures of hydrogen ordered phases of ice Science, 2006, 311, 1758 |
| 1566649 | CIF | D2 O | P -1 | 6.23416; 6.21697; 5.83377 90.033; 89.922; 89.999 | 226.103 | Salzmann, C. G.; Slater, B.; Radaelli, P. G.; Finney, J. L.; Shephard, J. J.; Rosillo-Lopez, M.; Hindley, J. Detailed crystallographic analysis of the ice VI to ice XV hydrogen ordering phase transition The Journal of Chemical Physics, 2016, 145, 204501 |
| 1566650 | CIF | D2 O | P m m n :2 | 6.245; 6.242; 5.77577 90; 90; 90 | 225.15 | Komatsu, K.; Noritake, F.; Machida, S.; Sano-Furukawa, A.; Hattori, T.; Yamane, R.; Kagi, H. Partially ordered state of ice XV Scientific Reports, 2016, 6, 28920 |
| 1566651 | CIF | D2 O | F d -3 m :2 | 17.124; 17.124; 17.124 90; 90; 90 | 5021.29 | Falenty, A.; Hansen, T. C.; Kuhs, W. F. Formation and properties of ice XVI obtained by emptying a type sII clathrate hydrate Nature, 2014, 516, 231 |
| 1566652 | CIF | D2 O | P 61 2 2 | 6.32849; 6.32849; 6.05472 90; 90; 120 | 210.003 | del Rosso, L.; Grazzi, F.; Celli, M.; Colognesi, D.; Garcia-Sakai, V.; Ulivi, L. Refined structure of metastable ice XVII from neutron diffraction measurements The Journal of Physical Chemistry C, 2016, 120, 26955 |
| 1566653 | CIF | D2 O | P -4 | 8.61942; 8.61942; 5.59301 90; 90; 90 | 415.529 | Yamane, R.; Komatsu, K.; Gouchi, J.; Uwatoko, Y.; Machida, S.; Hattori, T.; Ito, H.; Kagi, H. Experimental evidence for the existence of a second partially-ordered phase of ice VI Nature Communications, 2021, 12, 1129 |
| 1566654 | CIF | D2 O | P c c 2 | 8.6278; 8.6114; 5.59299 90; 90; 90 | 415.54 | Yamane, R.; Komatsu, K.; Gouchi, J.; Uwatoko, Y.; Machida, S.; Hattori, T.; Ito, H.; Kagi, H. Experimental evidence for the existence of a second partially-ordered phase of ice VI Nature Communications, 2021, 12, 1129 |
| 1566655 | CIF | D2 O | P -4 | 8.834721; 8.834721; 5.75542 90; 90; 90 | 449.224 | Gasser, T. M.; Thoeny, A. V.; Fortes, A. D.; Loerting, T. Structural characterization of ice XIX as the second polymorph related to ice VI Nature Communications, 2021, 12, 1128 |
| 1566656 | CIF | D2 O | P b c n | 8.3966; 5.4546; 8.3737 90; 90; 90 | 383.52 | Salzmann, C. G.; Loveday, J. S.; Rosu-Finsen, A.; Bull, C. L. Structure and nature of ice XIX Nature Communications, 2021, 12, 3162 |
| 1566657 | CIF | D2 O | P 41 21 2 | 6.6925; 6.6925; 6.7152 90; 90; 90 | 300.771 | Londono, J. D.; Kuhs, W. F.; Finney, J. L. Neutron diffraction studies of ices III and IX on under-pressure and recovered samples The Journal of Chemical Physics, 1993, 98, 4878 |
| 1566658 | CIF | D2 O | I 41/a m d :2 | 4.6779; 4.6779; 6.8029 90; 90; 90 | 148.87 | Jorgensen, J. D.; Beyerlein, R. A.; Watanabe, N.; Worlton, T. G. Structure of D2O ice VIII from in situ powder neutron diffraction The Journal of Chemical Physics, 1984, 81, 3211 |
| 1566659 | CIF | D2 O | P 42/n m c :2 | 6.1812; 6.1812; 5.698 90; 90; 90 | 217.7 | Kuhs, W.F.; Finney, J.L.; Vettier, C.; Bliss, D.V. Structure and hydrogen ordering in ices VI, VII, and VIII by neutron powder diffraction The Journal of Chemical Physics, 1984, 81, 3612 |
| 1566660 | CIF | D2 O | P 42/n m c :2 | 6.2446; 6.2446; 5.76203 90; 90; 90 | 224.691 | Komatsu, K.; Noritake, F.; Machida, S.; Sano-Furukawa, A.; Hattori, T.; Yamane, R.; Kagi, H. Partially ordered state of ice XV Scientific Reports, 2016, 6, 28920 |
| 1566661 | CIF | D2 O | I 41/a m d :2 | 4.4493; 4.4493; 6.413 90; 90; 90 | 126.95 | Besson, J. M.; Pruzan, Ph.; Klotz, S.; Hamel, G.; Silvi, B.; Nelmes, R. J.; Loveday, J. S.; Wilson, R. M.; Hull, S. Variation of interatomic distances in ice VIII to 10 GPa Physical Review B, 1984, 49, 12540 |
| 1566662 | CIF | D2 O | I 41/a m d :2 | 4.39005; 4.39005; 6.303 90; 90; 90 | 121.475 | Komatsu, K.; Klotz, S.; Machida, S.; Sano-Furukawa, A.; Hattori, T.; Kagi, H. Anomalous hydrogen dynamics of the ice VII-VIII transition revealed by high-pressure neutron diffraction Proceedings of the National Academy of Sciences, 2020, 117, 6356 |
| 1566663 | CIF | C36 H37 K N3 O3 P2 Ru S | P c a 21 | 12.6529; 18.7504; 15.5836 90; 90; 90 | 3697.2 | Tossaint, Alex S.; Rebreyend, Christophe; Sinha, Vivek; Weber, Manuela; Canossa, Stefano; Pidko, Evgeny A.; Filonenko, Georgy A. Two step activation of Ru-PN3P pincer catalysts for CO2 hydrogenation Catalysis Science & Technology, 2022, 12, 2972-2977 |
| 1566664 | CIF | C100 H83 N6 O3 P6 Ru2 | P 1 21/c 1 | 14.8971; 22.753; 28.6172 90; 100.332; 90 | 9542.6 | Tossaint, Alex S.; Rebreyend, Christophe; Sinha, Vivek; Weber, Manuela; Canossa, Stefano; Pidko, Evgeny A.; Filonenko, Georgy A. Two step activation of Ru-PN3P pincer catalysts for CO2 hydrogenation Catalysis Science & Technology, 2022, 12, 2972-2977 |
| 1566665 | CIF | C51 H48 Cl N4 O2 P3 Ru | P b c n | 25.849; 19.5041; 21.0152 90; 90; 90 | 10595 | Tossaint, Alex S.; Rebreyend, Christophe; Sinha, Vivek; Weber, Manuela; Canossa, Stefano; Pidko, Evgeny A.; Filonenko, Georgy A. Two step activation of Ru-PN3P pincer catalysts for CO2 hydrogenation Catalysis Science & Technology, 2022, 12, 2972-2977 |
| 1566666 | CIF | C23 H27 B O3 | P n a 21 | 12.912; 10.1397; 15.597 90; 90; 90 | 2042 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic Mimicry of Formaldehyde-Induced DNA–Protein Crosslinks in the Confined Space of Metal–Organic Framework Chemical Science, 2022 |
| 1566667 | CIF | C23 H27 B O3 | P 1 21/n 1 | 12.4943; 9.9586; 16.762 90; 95.6616; 90 | 2075.5 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic Mimicry of Formaldehyde-Induced DNA–Protein Crosslinks in the Confined Space of Metal–Organic Framework Chemical Science, 2022 |
| 1566668 | CIF | C16 H29 N O6 S | P 21 21 21 | 5.46991; 10.15896; 34.3303 90; 90; 90 | 1907.69 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566669 | CIF | C18 H22 O2 S | P n a 21 | 9.3374; 6.0661; 28.5106 90; 90; 90 | 1614.89 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566670 | CIF | C15 H20 Cl N O3 S | P -1 | 5.0188; 9.6241; 16.1198 89.487; 85.132; 82.136 | 768.5 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566671 | CIF | C10 H18 O4 S2 | P 1 21/n 1 | 6.4691; 11.4368; 8.7387 90; 102.114; 90 | 632.143 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566672 | CIF | C11 H14 O3 S | P -1 | 5.72076; 8.13039; 11.8424 91.8184; 91.4466; 103.412 | 535.219 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566673 | CIF | C10 H11 F O3 S | P 1 c 1 | 5.7165; 12.1828; 14.7356 90; 91.722; 90 | 1025.77 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566674 | CIF | C15 H27 N O6 S | P 1 21/c 1 | 11.1742; 16.6182; 10.3665 90; 116.394; 90 | 1724.34 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566675 | CIF | C10 H18 O4 S2 | P 1 21/c 1 | 6.09765; 8.92648; 22.0926 90; 91.4743; 90 | 1202.11 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566676 | CIF | C15 H17 N O2 S | P 1 21/c 1 | 9.0612; 15.82137; 10.2622 90; 114.837; 90 | 1335.12 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566677 | CIF | C25 H30 O8 S | P 1 21 1 | 10.04584; 19.87397; 12.32816 90; 95.9688; 90 | 2447.98 | Nguyen, Vu T.; Haug, Graham C.; Nguyen, Viet D.; Vuong, Ngan T. H.; Karki, Guna B.; Arman, Hadi; Larionov, Oleg V. Functional Group Divergence and the Structural Basis of Acridine Photocatalysis Revealed by Direct Decarboxysulfonylation Chemical Science, 2022 |
| 1566678 | CIF | C23 H27 B O3 | P n a 21 | 12.912; 10.1397; 15.597 90; 90; 90 | 2042 | wu, Fu-Peng; Wu, Xiao-Feng Catalyst-Controlled Selective Borocarbonylation of Benzylidenecyclopropanes: Regiodivergent Synthesis of γ-Vinylboryl Ketones and β-Cyclopropylboryl Ketones Chemical Science, 2022 |
| 1566679 | CIF | C23 H27 B O3 | P 1 21/n 1 | 12.4943; 9.9586; 16.762 90; 95.6616; 90 | 2075.5 | wu, Fu-Peng; Wu, Xiao-Feng Catalyst-Controlled Selective Borocarbonylation of Benzylidenecyclopropanes: Regiodivergent Synthesis of γ-Vinylboryl Ketones and β-Cyclopropylboryl Ketones Chemical Science, 2022 |
| 1566680 | CIF | C50.5 H47 Co O3 P2 | P 1 21/n 1 | 9.9652; 18.349; 23.3602 90; 96.462; 90 | 4244.3 | Martínez-Carrión, Alicia; Romero-Navarro, Andrés; Núñez-Rico, José Luis; Gutiérrez, Albert; Grabulosa, Arnald; Vidal-Ferran, Anton Valorisation of mixtures of linear alkenes using cobalt-mediated isomerisation and hydroformylation chemistries Catalysis Science & Technology, 2022, 12, 3219-3227 |
| 1566681 | CIF | C45 H32 Co2 O7 P2 | P -1 | 10.8578; 11.6947; 17.4282 106.744; 95.84; 112.496 | 1900.9 | Martínez-Carrión, Alicia; Romero-Navarro, Andrés; Núñez-Rico, José Luis; Gutiérrez, Albert; Grabulosa, Arnald; Vidal-Ferran, Anton Valorisation of mixtures of linear alkenes using cobalt-mediated isomerisation and hydroformylation chemistries Catalysis Science & Technology, 2022, 12, 3219-3227 |
| 1566682 | CIF | C16 H19 N O6 S | P 21 21 21 | 8.0346; 12.621; 16.5455 90; 90; 90 | 1677.79 | Li, Gonglin; Zhang, Yan; Zeng, Hongkun; Feng, Xiaoming; Su, Zhishan; Lin, Lili Water Enables Diastereodivergency in Bispidine-Based Chiral Amine-Catalyzed Asymmetric Mannich Reaction of Cyclic N-Sulfonyl Ketimines with Ketones Chemical Science, 2022 |
| 1566683 | CIF | C16 H19 N O6 S | P 1 21 1 | 10.1269; 8.043; 10.8756 90; 114.408; 90 | 806.66 | Li, Gonglin; Zhang, Yan; Zeng, Hongkun; Feng, Xiaoming; Su, Zhishan; Lin, Lili Water Enables Diastereodivergency in Bispidine-Based Chiral Amine-Catalyzed Asymmetric Mannich Reaction of Cyclic N-Sulfonyl Ketimines with Ketones Chemical Science, 2022 |
| 1566684 | CIF | C17 H26 F6 N3 O7 S2 | P 1 21 1 | 11.0402; 9.5966; 12.5085 90; 115.079; 90 | 1200.32 | Li, Gonglin; Zhang, Yan; Zeng, Hongkun; Feng, Xiaoming; Su, Zhishan; Lin, Lili Water Enables Diastereodivergency in Bispidine-Based Chiral Amine-Catalyzed Asymmetric Mannich Reaction of Cyclic N-Sulfonyl Ketimines with Ketones Chemical Science, 2022 |
| 1566685 | CIF | C16 H20 N2 O6 S | P 21 21 21 | 8.1051; 14.1921; 15.2659 90; 90; 90 | 1756.01 | Li, Gonglin; Zhang, Yan; Zeng, Hongkun; Feng, Xiaoming; Su, Zhishan; Lin, Lili Water Enables Diastereodivergency in Bispidine-Based Chiral Amine-Catalyzed Asymmetric Mannich Reaction of Cyclic N-Sulfonyl Ketimines with Ketones Chemical Science, 2022 |
| 1566686 | CIF | C160 H218 N8 O49 S8 | P 1 21 1 | 13.5261; 12.674; 25.4683 90; 99.78; 90 | 4302.6 | Li, Gonglin; Zhang, Yan; Zeng, Hongkun; Feng, Xiaoming; Su, Zhishan; Lin, Lili Water Enables Diastereodivergency in Bispidine-Based Chiral Amine-Catalyzed Asymmetric Mannich Reaction of Cyclic N-Sulfonyl Ketimines with Ketones Chemical Science, 2022 |
| 1566687 | CIF | C1220 H968 B11.95 Cu24 F47.82 N52 O104 | P 1 21/n 1 | 18.838; 32.458; 64.439 90; 94.55; 90 | 39277 | Domoto, Yuya; Yamamoto, Kidai; Horie, Shumpei; Yu, Zhengsu; Fujita, Makoto Multiplication of weak chiral inductions for excellent control over the helical orientation of discrete topologically chiral (M3L2)n polyhedra Chemical Science, 2022 |
| 1566688 | CIF | C29.4 H40.8 Cl8.8 N2 P2 Pd | P 1 21/n 1 | 15.262; 12.8154; 20.9917 90; 108.535; 90 | 3892.8 | Kucmierczyk, Peter; Behrens, Stephan; Kubis, Christoph; Baumann, Wolfgang; Wei, Zhihong; Jiao, Haijun; Dong, Kaiwu; Spannenberg, Anke; Neumann, Helfried; Jackstell, Ralf; Börner, Armin; Franke, Robert; Beller, Matthias (In situ) spectroscopic studies on state-of-the-art Pd(ii) catalysts in solution for the alkoxycarbonylation of alkenes Catalysis Science & Technology, 2022, 12, 3175-3189 |
| 1566689 | CIF | C26 H40 B2 N2 P2 | P -1 | 9.1591; 11.3142; 15.1394 103.273; 102.525; 105.201 | 1408 | Kucmierczyk, Peter; Behrens, Stephan; Kubis, Christoph; Baumann, Wolfgang; Wei, Zhihong; Jiao, Haijun; Dong, Kaiwu; Spannenberg, Anke; Neumann, Helfried; Jackstell, Ralf; Börner, Armin; Franke, Robert; Beller, Matthias (In situ) spectroscopic studies on state-of-the-art Pd(ii) catalysts in solution for the alkoxycarbonylation of alkenes Catalysis Science & Technology, 2022, 12, 3175-3189 |
| 1566690 | CIF | C28 H34 F6 N2 O6 P2 Pd S2 | P -1 | 11.2734; 12.1729; 13.5903 73.9005; 72.8892; 73.6404 | 1671.4 | Kucmierczyk, Peter; Behrens, Stephan; Kubis, Christoph; Baumann, Wolfgang; Wei, Zhihong; Jiao, Haijun; Dong, Kaiwu; Spannenberg, Anke; Neumann, Helfried; Jackstell, Ralf; Börner, Armin; Franke, Robert; Beller, Matthias (In situ) spectroscopic studies on state-of-the-art Pd(ii) catalysts in solution for the alkoxycarbonylation of alkenes Catalysis Science & Technology, 2022, 12, 3175-3189 |
| 1566691 | CIF | C17 H21 B F2 N4 O | P 21 21 21 | 8.9883; 11.1112; 17.485 90; 90; 90 | 1746.2 | Zeng, Lintao; Chen, Tianhong; Zhu, Beitong; Koo, Seyoung; Tang, Yonghe; Lin, Weiying; James, Tony D.; Kim, Jong Seung A molecular recognition platform for the simultaneous sensing of diverse chemical weapons Chemical Science, 2022 |
| 1566692 | CIF | C15 H19 B F2 N4 | P 41 | 10.5675; 10.5675; 13.404 90; 90; 90 | 1496.9 | Zeng, Lintao; Chen, Tianhong; Zhu, Beitong; Koo, Seyoung; Tang, Yonghe; Lin, Weiying; James, Tony D.; Kim, Jong Seung A molecular recognition platform for the simultaneous sensing of diverse chemical weapons Chemical Science, 2022 |
| 1566693 | CIF | C16 H17 B F2 N4 O | P -1 | 6.9141; 9.2485; 12.7582 93.651; 101.649; 97.353 | 789.08 | Zeng, Lintao; Chen, Tianhong; Zhu, Beitong; Koo, Seyoung; Tang, Yonghe; Lin, Weiying; James, Tony D.; Kim, Jong Seung A molecular recognition platform for the simultaneous sensing of diverse chemical weapons Chemical Science, 2022 |
| 1566694 | CIF | C83 H135 As7 K La2 O6 Si8 | P -1 | 15.7346; 18.2731; 19.7473 106.435; 102.572; 100.222 | 5139 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566695 | CIF | C96 H164 As14 Ce2 K2 O12 Si8 | P -1 | 11.223; 16.579; 18.693 72.888; 89.816; 73.008 | 3166 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566696 | CIF | C80 H132 As7 K Nd2 O6 Si8 | P -1 | 15.6899; 18.4469; 20.1223 111.299; 104.839; 100.119 | 5006.3 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566697 | CIF | C77 H129 As3 K Nd2 O6 Si8 | P -1 | 11.7764; 17.4676; 26.292 84.855; 79.39; 71.581 | 5040.7 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566698 | CIF | C58 H102 As7 K2 Nd O12 Si4 | P 1 21/n 1 | 14.2709; 31.995; 17.4941 90; 98.678; 90 | 7896.3 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566699 | CIF | C77 H132 As7 Ce2 K O6 Si8 | P 1 21/n 1 | 20.0117; 18.0444; 27.5019 90; 96.273; 90 | 9871.5 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566700 | CIF | C74 H138 As14 K2 Nd2 O12 Si8 | C 1 2/c 1 | 41.591; 13.2497; 19.5306 90; 95.516; 90 | 10712.9 | Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W. From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides Chemical Science, 2022 |
| 1566701 | CIF | C43 H40 Au N O6 | P 21 21 21 | 9.9306; 13.2468; 27.4297 90; 90; 90 | 3608.3 | Guo, Jia; Xiong, Wen-Bin; Ma, Hao-Ran; Fan, Luoyi; Zhou, You-Yun; Wong, Henry N. C.; Cui, Jian-Fang Optical Resolution of 1,16-Dihydroxytetraphenylene by Chiral Gold(III) Complexation and Its Applications as Chiral Ligands in Asymmetric Catalysis Chemical Science, 2022 |
| 1566702 | CIF | C38 H24 N O2 P | P 21 21 21 | 11.8935; 12.6595; 18.8734 90; 90; 90 | 2841.7 | Guo, Jia; Xiong, Wen-Bin; Ma, Hao-Ran; Fan, Luoyi; Zhou, You-Yun; Wong, Henry N. C.; Cui, Jian-Fang Optical Resolution of 1,16-Dihydroxytetraphenylene by Chiral Gold(III) Complexation and Its Applications as Chiral Ligands in Asymmetric Catalysis Chemical Science, 2022 |
| 1566703 | CIF | C41.17 H29.17 Au Cl3.5 N O3 | P 21 21 21 | 12.999; 13.954; 22.15 90; 90; 90 | 4018 | Guo, Jia; Xiong, Wen-Bin; Ma, Hao-Ran; Fan, Luoyi; Zhou, You-Yun; Wong, Henry N. C.; Cui, Jian-Fang Optical Resolution of 1,16-Dihydroxytetraphenylene by Chiral Gold(III) Complexation and Its Applications as Chiral Ligands in Asymmetric Catalysis Chemical Science, 2022 |
| 1566704 | CIF | C42 H32 Au Cl4 N O3 | P 21 21 21 | 12.578; 13.7123; 21.0398 90; 90; 90 | 3628.8 | Guo, Jia; Xiong, Wen-Bin; Ma, Hao-Ran; Fan, Luoyi; Zhou, You-Yun; Wong, Henry N. C.; Cui, Jian-Fang Optical Resolution of 1,16-Dihydroxytetraphenylene by Chiral Gold(III) Complexation and Its Applications as Chiral Ligands in Asymmetric Catalysis Chemical Science, 2022 |
| 1566705 | CIF | C42 H36 Au N O5 | P 21 21 21 | 9.9266; 13.1669; 27.3976 90; 90; 90 | 3580.9 | Guo, Jia; Xiong, Wen-Bin; Ma, Hao-Ran; Fan, Luoyi; Zhou, You-Yun; Wong, Henry N. C.; Cui, Jian-Fang Optical Resolution of 1,16-Dihydroxytetraphenylene by Chiral Gold(III) Complexation and Its Applications as Chiral Ligands in Asymmetric Catalysis Chemical Science, 2022 |
| 1566706 | CIF | H66 Mo60 Na8 O187 | I 41/a c d :2 | 23.5571; 23.5571; 61.035 90; 90; 90 | 33870.6 | Li, xuexin; Ji, Tuo; Gao, Jun-Yang; Chen, Wei-Chao; Yuan, Ye; Sha, Haoyan; Faller, Roland; Shan, Guo-Gang; Shao, Kui-Zhan; Wang, Xinlong; Su, Zhong-Min An Unprecedented Fully Reduced {MoV60} Polyoxometalate: From All-Inorganic Molecular Light-Absorber Model to Improved Photoelectronic Performance Chemical Science, 2022 |
| 1566707 | CIF | C54.5 H53 B Cl P2 S | P -1 | 8.8424; 11.4067; 24.8662 81.957; 80.897; 69.046 | 2303.2 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566708 | CIF | C29.25 H31.5 B Cl0.5 F4 P2 Pt S | P b a m | 20.9374; 10.9959; 14.9555 90; 90; 90 | 3443.14 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566709 | CIF | C28 H28 Cl O P2 Rh S | P 21 21 21 | 10.4581; 14.2792; 17.4031 90; 90; 90 | 2598.86 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566710 | CIF | C54 H53 B Cl P2 Rh S | P 1 21/n 1 | 10.9915; 34.1432; 12.5533 90; 99.76; 90 | 4642.9 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566711 | CIF | C45.5 H36 Cl F7 P3 Rh S | P -1 | 9.1404; 12.3384; 19.4965 102.063; 92.077; 103.656 | 2080.95 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566712 | CIF | C43 H32 F4 O3 P2 S2 | P 1 21/n 1 | 12.4956; 28.031; 12.6611 90; 119.324; 90 | 3866.48 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566713 | CIF | C56 H59 B P2 Pt S | P 1 21/c 1 | 16.6775; 15.3273; 19.3126 90; 102.496; 90 | 4819.76 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566714 | CIF | C47 H35 F13 N2 O8 P2 Pt S5 | P 1 21/c 1 | 23.6369; 12.7303; 18.9449 90; 98.297; 90 | 5640.95 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566715 | CIF | C32 H39 B2 F8 N O2 P2 Pt S | P -1 | 10.727; 13.1882; 15.143 65.687; 75.111; 75.546 | 1861.41 | Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri Sulfonium cations as versatile strongly π-acidic ligands Chemical Science, 2022 |
| 1566716 | CIF | D2 O | P n -3 m :2 | 3.3501; 3.3501; 3.3501 90; 90; 90 | 37.5987 | Jorgensen, James D.; Worlton, Thomas G. Disordered structure of D2O ice VII from in situ neutron powder diffraction Journal of Chemical Physics, 1985, 83, 329-333 |
| 1566717 | CIF | D0.24 Fe0.95 Si0.05 | P 63/m m c | 2.54579; 2.54579; 4.1282 90; 90; 120 | 23.171 | Mori, Y.; Kagi, H.; Kakizawa, S.; Komatsu, K.; Shito, C.; Iizuka-Oku, R.; Aoki, K.; Hattori, T.; Sano-Furukawa, A.; Funakoshi, K.; Saitoh, H. Neutron diffraction study of hydrogen site occupancy in Fe0.95Si0.05 at 14.7 GPa and 800 K Journal of Mineralogical and Petrological Sciences, 2021, 1136, 309-313 |
| 1566718 | CIF HKL Paper | C21 H18 N2 O | C 1 2/c 1 | 30.3989; 8.7177; 14.0581 90; 115.367; 90 | 3366.3 | Meenatchi, C. Selva; Athimoolam, S.; Suresh, J.; Priya, R. Vishnu; Rubina, S. Raja; Bhandari, S. R. (<i>E</i>)-5-(4-Methylbenzylidene)-1-phenyl-4,5,6,7-tetrahydro-1<i>H</i>-indazol-4-one IUCrData, 2022, 7, x220283 |
| 1566719 | CIF | C20 H56 Bi2 Br10 N4 | P -1 | 12.4378; 13.2166; 14.021 97.835; 93.139; 90.289 | 2279.7 | Su, Chang-Yuan; Yao, Yefeng; Zhang, Zhixu; Wang, Ying; Chen, Ming; Huang, Pei-Zhi; Zhang, Yi; Qiao, Wencheng; Fu, Da-Wei The construction of a two-dimensional organic-inorganic hybrid double perovskite ferroelastic with high Tc and narrow band gap Chemical Science, 2022 |
| 1566720 | CIF | C20 H56 Ag Bi Br8 N4 | P -1 | 8.4797; 8.7683; 13.9411 73.253; 88.908; 87.415 | 991.56 | Su, Chang-Yuan; Yao, Yefeng; Zhang, Zhixu; Wang, Ying; Chen, Ming; Huang, Pei-Zhi; Zhang, Yi; Qiao, Wencheng; Fu, Da-Wei The construction of a two-dimensional organic-inorganic hybrid double perovskite ferroelastic with high Tc and narrow band gap Chemical Science, 2022 |
| 1566721 | CIF | C20 Ag Bi Br8 N8 | C m m m | 8.774; 27.47; 8.771 90; 90; 90 | 2114 | Su, Chang-Yuan; Yao, Yefeng; Zhang, Zhixu; Wang, Ying; Chen, Ming; Huang, Pei-Zhi; Zhang, Yi; Qiao, Wencheng; Fu, Da-Wei The construction of a two-dimensional organic-inorganic hybrid double perovskite ferroelastic with high Tc and narrow band gap Chemical Science, 2022 |
| 1566722 | CIF | C25 H69 Br9 N5 Pb2 | P -1 | 11.996; 13.422; 17.477 72.658; 70.158; 77.179 | 2503.7 | Su, Chang-Yuan; Yao, Yefeng; Zhang, Zhixu; Wang, Ying; Chen, Ming; Huang, Pei-Zhi; Zhang, Yi; Qiao, Wencheng; Fu, Da-Wei The construction of a two-dimensional organic-inorganic hybrid double perovskite ferroelastic with high Tc and narrow band gap Chemical Science, 2022 |
| 1566723 | CIF | C25 H70 Br9 N5 Pb2 | P -1 | 11.975; 13.366; 17.472 72.618; 70.213; 77.258 | 2488.9 | Su, Chang-Yuan; Yao, Yefeng; Zhang, Zhixu; Wang, Ying; Chen, Ming; Huang, Pei-Zhi; Zhang, Yi; Qiao, Wencheng; Fu, Da-Wei The construction of a two-dimensional organic-inorganic hybrid double perovskite ferroelastic with high Tc and narrow band gap Chemical Science, 2022 |
| 1566724 | CIF | C23 H23 Cl N2 O2 | P 1 21 1 | 9.6064; 7.9331; 13.748 90; 101.106; 90 | 1028.09 | Xiao, Lu; Li, Bo; Xiao, Fan; Fu, Cong; Wei, Liang; Dang, Yanfeng; Dong, Xiu-Qin; Wang, Chun-Jiang Stereodivergent Synthesis of Enantioenriched Azepino[3,4,5-cd]-Indoles via Cooperative Cu/Ir-Catalyzed Asymmetric Allylic Alkylation and Intramolecular Friedel-Crafts Reaction Chemical Science, 2022 |
| 1566725 | CIF | C23 H23 Cl N2 O2 | P 21 21 21 | 9.2992; 18.0846; 24.744 90; 90; 90 | 4161.26 | Xiao, Lu; Li, Bo; Xiao, Fan; Fu, Cong; Wei, Liang; Dang, Yanfeng; Dong, Xiu-Qin; Wang, Chun-Jiang Stereodivergent Synthesis of Enantioenriched Azepino[3,4,5-cd]-Indoles via Cooperative Cu/Ir-Catalyzed Asymmetric Allylic Alkylation and Intramolecular Friedel-Crafts Reaction Chemical Science, 2022 |
| 1566726 | CIF | C23 H23 Cl N2 O2 | P 21 21 21 | 9.11893; 17.37833; 50.2087 90; 90; 90 | 7956.66 | Xiao, Lu; Li, Bo; Xiao, Fan; Fu, Cong; Wei, Liang; Dang, Yanfeng; Dong, Xiu-Qin; Wang, Chun-Jiang Stereodivergent Synthesis of Enantioenriched Azepino[3,4,5-cd]-Indoles via Cooperative Cu/Ir-Catalyzed Asymmetric Allylic Alkylation and Intramolecular Friedel-Crafts Reaction Chemical Science, 2022 |
| 1566727 | CIF | C23 H30 N4 O2 | P 1 21/c 1 | 16.0767; 12.9097; 10.9767 90; 99.712; 90 | 2245.51 | Zhan, Yi-Zhou; Meng, Huan; Shu, Wei Rapid Access to t-Butylalkylated Olefins Enabled by Ni-Catalyzed Intermolecular Regio- and trans-Selective Cross-Electrophile t-Butylalkylation of Alkynes Chemical Science, 2022 |
| 1566728 | CIF HKL Paper | C15 H14 Cl N5 O2 | P 1 21 1 | 7.1533; 11.936; 9.004 90; 98.128; 90 | 761.1 | Song, Jingjing; Jiang, Xinyu; Wang, Ziyi; Pei, Jingyao; Li, Hongsen 4-Chloro-5-(dimethylamino)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridazin-3(2<i>H</i>)-one IUCrData, 2022, 7, x220342 |
| 1566729 | CIF HKL Paper | C16 H9 N O2 S | P 1 21/c 1 | 4.60717; 20.7275; 12.6444 90; 91.911; 90 | 1206.81 | Abdallah, Amira E. M.; Elgemeie, Galal H.; Jones, Peter G. 3-(Benzo[<i>d</i>]thiazol-2-yl)-2<i>H</i>-chromen-2-one IUCrData, 2022, 7, x220332 |
| 1566730 | CIF | C61 H45 Cl3 | P -1 | 13.1323; 14.2033; 14.7079 94.606; 111.041; 97.973 | 2510.43 | Bergman, Harrison; Beattie, D. Dawson; Kiel, Gavin R.; Handford, Rex; Liu, Yi; Tilley, T. Don A sequential cyclization/π-extension strategy for modular construction of nanographenes enabled by stannole cycloadditions Chemical Science, 2022 |
| 1566731 | CIF | C22 H9 Br N4 S | P -1 | 7.5508; 8.0138; 8.139 85.38; 77.75; 75.07 | 464.86 | Liu, Kun; Li, Shuai; Fu, Liyuan; Lei, Yilong; Liao, Qing; Fu, Hongbing Cocrystallization Tailoring Radiative Decay Pathways for Thermally Activated Delayed Fluorescence and Room Temperature Phosphorescence Emission Nanoscale, 2022 |
| 1566732 | CIF | C22 H9 Br N4 S | P 1 21/c 1 | 7.4921; 8.1212; 30.277 90; 92.33; 90 | 1840.7 | Liu, Kun; Li, Shuai; Fu, Liyuan; Lei, Yilong; Liao, Qing; Fu, Hongbing Cocrystallization Tailoring Radiative Decay Pathways for Thermally Activated Delayed Fluorescence and Room Temperature Phosphorescence Emission Nanoscale, 2022 |
| 1566733 | CIF | C32 H28 N2 O5 S | P -1 | 7.2319; 11.7336; 16.6396 102.141; 94.257; 104.092 | 1327.08 | Dong, Jingyue; Gao, Wei; Li, Kun; Hong, Zeyu; Tang, Liangfu; Han, Lijun; Wang, Zhihong; Fan, Zhijin Design, Synthesis, and Biological Evaluation of Novel Psoralen-Based 1,3,4-Oxadiazoles as Potent Fungicide Candidates Targeting Pyruvate Kinase. Journal of agricultural and food chemistry, 2022, 70, 3435-3446 |
| 1566734 | CIF | C29 H22 N2 O4 S | P b c a | 9.6146; 15.9025; 29.7245 90; 90; 90 | 4544.8 | Dong, Jingyue; Gao, Wei; Li, Kun; Hong, Zeyu; Tang, Liangfu; Han, Lijun; Wang, Zhihong; Fan, Zhijin Design, Synthesis, and Biological Evaluation of Novel Psoralen-Based 1,3,4-Oxadiazoles as Potent Fungicide Candidates Targeting Pyruvate Kinase. Journal of agricultural and food chemistry, 2022, 70, 3435-3446 |
| 1566735 | CIF | C22 H22 Cl F3 N4 O | C 1 2/c 1 | 19.4942; 8.0752; 27.7657 90; 102.868; 90 | 4261.09 | Sun, Susu; Chen, Lai; Huo, Jingqian; Wang, Ying; Kou, Song; Yuan, Shitao; Fu, Yining; Zhang, Jinlin Discovery of Novel Pyrazole Amides as Potent Fungicide Candidates and Evaluation of Their Mode of Action. Journal of agricultural and food chemistry, 2022, 70, 3447-3457 |
| 1566736 | CIF | C15 H14 O3 | P 21 21 21 | 5.5437; 8.4551; 52.42 90; 90; 90 | 2457.06 | Müller, Christoph; Gleixner, Jakob; Tahk, Maris-Johanna; Kopanchuk, Sergei; Laasfeld, Tõnis; Weinhart, Michael; Schollmeyer, Dieter; Betschart, Martin U.; Lüdeke, Steffen; Koch, Pierre; Rinken, Ago; Keller, Max Structure-Based Design of High-Affinity Fluorescent Probes for the Neuropeptide Y Y<sub>1</sub> Receptor. Journal of medicinal chemistry, 2022, 65, 4832-4853 |
| 1566737 | CIF | C108.96 H78.42 Cl1.5 N5 O12 | P -1 | 10.4997; 15.5071; 35.5889 83.392; 82.236; 71.57 | 5430.8 | Loong, Hao; Zhou, Jiadong; Jiang, Nianqiang; Feng, Yi; Xie, Guojing; Liu, Linlin; Xie, Zengqi Photoinduced Cascading Charge Transfer in Perylene Bisimide-Based Triads. The journal of physical chemistry. B, 2022, 126, 2441-2448 |
| 1566738 | CIF | C46 H31 N3 O2 | P 1 21/c 1 | 12.1514; 26.995; 10.64 90; 99.479; 90 | 3442.6 | Dey, Suvendu; Hasan, Monirul; Shukla, Atul; Acharya, Nirmalya; Upadhyay, Manoj; Lo, Shih-Chun; Namdas, Ebinazar B.; Ray, Debdas Thermally Activated Delayed Fluorescence and Room-Temperature Phosphorescence in Asymmetric Phenoxazine-Quinoline (D2–A) Conjugates and Dual Electroluminescence The Journal of Physical Chemistry C, 2022, 126, 5649-5657 |
| 1566739 | CIF | C17 H15 N O2 | P 21 21 21 | 6.562; 14.232; 14.4563 90; 90; 90 | 1350.1 | Kim, Alexia N.; Ngamnithiporn, Aurapat; Bartberger, Michael D.; Stoltz, Brian M. Iridium-catalyzed asymmetric trans-selective hydrogenation of 1,3-disubstituted isoquinolines Chemical Science, 2022, 13, 3227-3232 |
| 1566740 | CIF | C20 H10 B11 Cl11 F6 | C 1 2 1 | 21.8423; 11.6968; 19.7476 90; 98.58; 90 | 4988.8 | Gunther, S. Olivia; Lee, Chun-I; Song, Ellen; Bhuvanesh, Nattamai; Ozerov, Oleg V. Isolable Fluorinated Triphenymethyl Cation Salts of [HCB11Cl11]-: Demonstration of Remarkable Hydride Affinity Chemical Science, 2022 |
| 1566741 | CIF | C24.5 H17 B11 Cl12.5 F2 | P -1 | 12.5709; 13.3424; 23.0855 83.592; 88.189; 73.431 | 3688.1 | Gunther, S. Olivia; Lee, Chun-I; Song, Ellen; Bhuvanesh, Nattamai; Ozerov, Oleg V. Isolable Fluorinated Triphenymethyl Cation Salts of [HCB11Cl11]-: Demonstration of Remarkable Hydride Affinity Chemical Science, 2022 |
| 1566742 | CIF | C23 H16 O | P -1 | 10.9971; 21.3867; 28.861 76.152; 85.884; 86.204 | 6565.14 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566743 | CIF | C45 H34 O2 | P -1 | 10.26982; 12.9; 13.4161 101.787; 98.9295; 108.913 | 1598.21 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566744 | CIF | C41 H26 O | P -1 | 10.4122; 11.1627; 14.3485 103.578; 103.147; 112.391 | 1402.62 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566745 | CIF | C77 H89 Ni O3 P2 | P -1 | 10.9952; 14.137; 21.6909 104.76; 97.213; 100.584 | 3151.76 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566746 | CIF | C69 H76 Ni O P2 | P 1 21/c 1 | 33.7405; 13.5307; 24.6084 90; 105.039; 90 | 10849.8 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566747 | CIF | C43 H30 O | P 1 21/n 1 | 13.0907; 10.1466; 22.1188 90; 94.055; 90 | 2930.6 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566748 | CIF | C29.5 H32 N2 Ni O3 | P 1 21/c 1 | 19.0889; 15.9034; 18.9504 90; 106.854; 90 | 5505.8 | Kodama, Takuya; Saito, Kanako; Tobisu, Mamoru Nickel-Catalyzed Skeletal Transformation of Tropone Derivatives via C–C Bond Activation: Catalyst-Controlled Access to Diverse Ring Systems Chemical Science, 2022 |
| 1566749 | CIF | C12 H4 F6 N2 | P 1 21/n 1 | 4.487; 9.3652; 13.1716 90; 97.27; 90 | 549.04 | Peng, Hang; Qi, Jun-Chao; Song, Xian-Jiang; Xiong, Ren-Gen; Liao, Wei-Qiang An Unprecedented Azobenzene-Based Organic Single-Component Ferroelectric Chemical Science, 2022 |
| 1566750 | CIF | C12 H6 F5 N3 | P 1 21 1 | 3.76719; 6.2632; 24.1516 90; 92.008; 90 | 569.5 | Peng, Hang; Qi, Jun-Chao; Song, Xian-Jiang; Xiong, Ren-Gen; Liao, Wei-Qiang An Unprecedented Azobenzene-Based Organic Single-Component Ferroelectric Chemical Science, 2022 |
| 1566751 | CIF | C123 H116 F21 N12 O21 Rh4 S7 | P 1 21/c 1 | 24.6083; 12.7106; 23.5913 90; 114.206; 90 | 6730.2 | Dang, Li-Long; Li, Ting-Ting; Zhang, Ting-Ting; Zhao, Ying; Chen, Tian; Gao, Xiang; Ma, Lufang; Jin, Guo-Xin Highly selective synthesis and near-infrared photothermal conversion of metalla-Borromean ring and [2]catenane assemblies Chemical Science, 2022 |
| 1566752 | CIF | C211.76 H184 F35.28 Ir8 N8 O51.28 S11.76 | P 1 21/c 1 | 21.3182; 15.4343; 19.1459 90; 99.14; 90 | 6219.6 | Dang, Li-Long; Li, Ting-Ting; Zhang, Ting-Ting; Zhao, Ying; Chen, Tian; Gao, Xiang; Ma, Lufang; Jin, Guo-Xin Highly selective synthesis and near-infrared photothermal conversion of metalla-Borromean ring and [2]catenane assemblies Chemical Science, 2022 |
| 1566753 | CIF | C113.5 H132 F12 N4 O24.5 Rh4 S4 | P 1 21 1 | 15.5383; 19.2201; 41.5739 90; 94.273; 90 | 12381.4 | Dang, Li-Long; Li, Ting-Ting; Zhang, Ting-Ting; Zhao, Ying; Chen, Tian; Gao, Xiang; Ma, Lufang; Jin, Guo-Xin Highly selective synthesis and near-infrared photothermal conversion of metalla-Borromean ring and [2]catenane assemblies Chemical Science, 2022 |
| 1566754 | CIF | C134 H116 F30 N4 O38 Rh4 S10 | P n a 21 | 29.3957; 27.2297; 40.625 90; 90; 90 | 32518 | Dang, Li-Long; Li, Ting-Ting; Zhang, Ting-Ting; Zhao, Ying; Chen, Tian; Gao, Xiang; Ma, Lufang; Jin, Guo-Xin Highly selective synthesis and near-infrared photothermal conversion of metalla-Borromean ring and [2]catenane assemblies Chemical Science, 2022 |
| 1566755 | CIF | C366 H318 F54 N24 O94 Rh14 S18 | P 1 21/c 1 | 20.474; 34.09; 38.801 90; 105.086; 90 | 26148 | Dang, Li-Long; Li, Ting-Ting; Zhang, Ting-Ting; Zhao, Ying; Chen, Tian; Gao, Xiang; Ma, Lufang; Jin, Guo-Xin Highly selective synthesis and near-infrared photothermal conversion of metalla-Borromean ring and [2]catenane assemblies Chemical Science, 2022 |
| 1566756 | CIF | C122 H100 F18 N4 O26 Rh4 S6 | P 1 21/n 1 | 23.67; 36.843; 25.731 90; 112.251; 90 | 20768 | Dang, Li-Long; Li, Ting-Ting; Zhang, Ting-Ting; Zhao, Ying; Chen, Tian; Gao, Xiang; Ma, Lufang; Jin, Guo-Xin Highly selective synthesis and near-infrared photothermal conversion of metalla-Borromean ring and [2]catenane assemblies Chemical Science, 2022 |
| 1566757 | CIF HKL | Al0.067 Fe0.067 Mg1.94 O6 Si1.93 | P b c a | 5.1815; 18.2321; 8.8085 90; 90; 90 | 832.14 | Glazyrin, K.; Khandarkhaeva, S.; Fedotenko, T.; Dong, W.; Laniel, D.; Seiboth, F.; Schropp, A.; Garrevoet, J.; Brückner, D.; Falkenberg, G.; Kubec, A.; David, C.; Wendt, M.; Wenz, S.; Dubrovinsky, L.; Dubrovinskaia, N.; Liermann, H.-P. Sub-micrometer focusing setup for high-pressure crystallography at the Extreme Conditions beamline at PETRAIII Journal of Synchrotron Radiation, 2022, 29, 654-663 |
| 1566758 | CIF | Fe0.091 Mg0.909 O3 Si | P b n m | 4.194; 4.525; 6.191 90; 90; 90 | 117.49 | Glazyrin, K.; Khandarkhaeva, S.; Fedotenko, T.; Dong, W.; Laniel, D.; Seiboth, F.; Schropp, A.; Garrevoet, J.; Brückner, D.; Falkenberg, G.; Kubec, A.; David, C.; Wendt, M.; Wenz, S.; Dubrovinsky, L.; Dubrovinskaia, N.; Liermann, H.-P. Sub-micrometer focusing setup for high-pressure crystallography at the Extreme Conditions beamline at PETRAIII Journal of Synchrotron Radiation, 2022, 29, 654-663 |
| 1566759 | CIF | Co Sb3 | I m -3 | 9.036; 9.036; 9.036 90; 90; 90 | 737.783 | Glazyrin, K.; Khandarkhaeva, S.; Fedotenko, T.; Dong, W.; Laniel, D.; Seiboth, F.; Schropp, A.; Garrevoet, J.; Brückner, D.; Falkenberg, G.; Kubec, A.; David, C.; Wendt, M.; Wenz, S.; Dubrovinsky, L.; Dubrovinskaia, N.; Liermann, H.-P. Sub-micrometer focusing setup for high-pressure crystallography at the Extreme Conditions beamline at PETRAIII Journal of Synchrotron Radiation, 2022, 29, 654-663 |
| 1566760 | CIF | C151 H250 Al4 K4 N8 O4 S4 Si8 | P 1 21/c 1 | 25.01159; 19.41543; 33.7313 90; 100.884; 90 | 16085.6 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566761 | CIF | C82 H140 Al2 K2 N4 O12 Se2 Si4 | P 1 21/n 1 | 15.4374; 13.47603; 22.5971 90; 93.2318; 90 | 4693.51 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566762 | CIF | C49 H66 Al K N2 O3 S Si2 | P 1 21/n 1 | 14.78551; 13.04163; 25.96015 90; 104.132; 90 | 4854.33 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566763 | CIF | C53 H80 Al K N2 O5 Se Si2 | P 1 21/n 1 | 9.75833; 31.8983; 17.54162 90; 92.6949; 90 | 5454.21 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566764 | CIF | C50 H90 Al K N4 O8 S Si2 | P -1 | 10.0626; 17.1004; 17.2361 88.851; 83.037; 84.293 | 2929.33 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566765 | CIF | C45 H66 Al K N2 O3 S Si2 | P 1 21/c 1 | 15.45971; 12.3875; 24.7548 90; 90.4615; 90 | 4740.57 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566766 | CIF | C74 H132 Al2 K2 N4 O10 S2 Si4 | P 1 21 1 | 12.27766; 24.87997; 14.9006 90; 94.3187; 90 | 4538.73 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566767 | CIF | C49 H66 Al K N2 O3 Se Si2 | P 1 21/n 1 | 14.84213; 13.02613; 26.0062 90; 103.725; 90 | 4884.35 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P. Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds Chemical Science, 2022 |
| 1566768 | CIF HKL Paper | C36 H48 N4 O14 | P -1 | 6.0921; 8.5778; 18.726 94.922; 90.428; 98.945 | 962.88 | Naeem, Marilyn; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. Bis(oxotremorine) fumarate bis(fumaric acid) IUCrData, 2022, 7, x220364 |
| 1566769 | CIF | C48 H28 Bi N4 O9 | P 21 21 21 | 17.3; 17.4; 18.975 90; 90; 90 | 5711.9 | Xie, Dale; Wang, Sheng; Li, Shihao; Yang, Wenqing; Feng, Yi-Si A two-dimensional Bi-based porphyrin metal–organic framework photocatalyst for white light-driven selective oxidation of sulfides Catalysis Science & Technology, 2022, 12, 3254-3260 |
| 1566770 | CIF | C54 H78 Cl2 N10 O4 | C 1 2 1 | 20.799; 14.2717; 20.0159 90; 114.881; 90 | 5390 | Li, Hongfei; Kou, Lei; Liang, Lin; Li, Boyang; Zhao, Wei; Yang, Xiao-Juan; Wu, Biao Anion-coordination-driven single-double helix switching and chiroptical molecular switch based on oligoureas Chemical Science, 2022 |
| 1566771 | CIF | C99 H134 N20 O15.5 P | P 1 | 13.8456; 13.8504; 26.594 98.63; 90.112; 101.91 | 4930.7 | Li, Hongfei; Kou, Lei; Liang, Lin; Li, Boyang; Zhao, Wei; Yang, Xiao-Juan; Wu, Biao Anion-coordination-driven single-double helix switching and chiroptical molecular switch based on oligoureas Chemical Science, 2022 |
| 1566772 | CIF | C67 H96 N15 O13 P | P 1 21 1 | 13.007; 20.8259; 13.9625 90; 106.566; 90 | 3625.2 | Li, Hongfei; Kou, Lei; Liang, Lin; Li, Boyang; Zhao, Wei; Yang, Xiao-Juan; Wu, Biao Anion-coordination-driven single-double helix switching and chiroptical molecular switch based on oligoureas Chemical Science, 2022 |
| 1566773 | CIF | C77 H44 Cl2 N12 O5 | P 1 21 1 | 11.9428; 25.5121; 12.5127 90; 92.975; 90 | 3807.3 | Li, Hongfei; Kou, Lei; Liang, Lin; Li, Boyang; Zhao, Wei; Yang, Xiao-Juan; Wu, Biao Anion-coordination-driven single-double helix switching and chiroptical molecular switch based on oligoureas Chemical Science, 2022 |
| 1566774 | CIF | C29 H18 N | P -1 | 8.4867; 12.972; 18.128 105.478; 90.206; 96.312 | 1910.5 | Wei, Xiao; Xu, Chao; Li, Hao; Kang, Xi; Zhu, Manzhou Fabrication of a Family of Atomically Precise Silver Nanoclusters via Dual-Level Kinetical Control Chemical Science, 2022 |
| 1566775 | CIF | C30 H38 B2 N2 O4 | P 1 21/n 1 | 15.0763; 9.9694; 19.4363 90; 103.775; 90 | 2837.29 | Li, Manhong; Liu, Siqi; Bao, Haoshi; Li, Qini; Deng, Yi-Hui; Sun, Tian-Yu; Wang, Leifeng Photoinduced metal-free borylation of aryl halides catalysed by an in situ formed donor–acceptor complex Chemical Science, 2022 |
| 1566776 | CIF | C56 H71.75 Li5 Ni2 O5 | P 1 21/c 1 | 16.24036; 14.66026; 22.76116 90; 101.713; 90 | 5306.3 | Somerville, Rosie J.; Campos, Jesús; Carmona, Ernesto; Grabowsky, Simon; Malaspina, Lorraine A.; Balcells, David; Hevia, Eva; Nova, Ainara; Pérez-Jiménez, Marina; Borys, Andryj M. Unmasking the constitution and bonding of the proposed lithium nickelate “Li3NiPh3(solv)3”: Revealing the hidden C6H4 ligand Chemical Science, 2022 |
| 1566777 | CIF | C64 H112 Br2 Li6 Ni2 O8 | P 1 21/c 1 | 18.677; 19.8681; 39.575 90; 91.001; 90 | 14683.1 | Somerville, Rosie J.; Campos, Jesús; Carmona, Ernesto; Grabowsky, Simon; Malaspina, Lorraine A.; Balcells, David; Hevia, Eva; Nova, Ainara; Pérez-Jiménez, Marina; Borys, Andryj M. Unmasking the constitution and bonding of the proposed lithium nickelate “Li3NiPh3(solv)3”: Revealing the hidden C6H4 ligand Chemical Science, 2022 |
| 1566778 | CIF | C58 H73 Li6 Ni2 O4 | P -1 | 13.176; 14.1453; 15.9321 101.573; 103.502; 101.439 | 2733.3 | Somerville, Rosie J.; Campos, Jesús; Carmona, Ernesto; Grabowsky, Simon; Malaspina, Lorraine A.; Balcells, David; Hevia, Eva; Nova, Ainara; Pérez-Jiménez, Marina; Borys, Andryj M. Unmasking the constitution and bonding of the proposed lithium nickelate “Li3NiPh3(solv)3”: Revealing the hidden C6H4 ligand Chemical Science, 2022 |
| 1566779 | CIF | C88 H124 Li12 N4 Ni4 O12 | P 1 21/c 1 | 19.0297; 12.2915; 21.1653 90; 110.588; 90 | 4634.5 | Somerville, Rosie J.; Campos, Jesús; Carmona, Ernesto; Grabowsky, Simon; Malaspina, Lorraine A.; Balcells, David; Hevia, Eva; Nova, Ainara; Pérez-Jiménez, Marina; Borys, Andryj M. Unmasking the constitution and bonding of the proposed lithium nickelate “Li3NiPh3(solv)3”: Revealing the hidden C6H4 ligand Chemical Science, 2022 |
| 1566780 | CIF | C64 H92 Na4 Ni2 O6 | P -1 | 11.6655; 12.7905; 22.787 104.121; 90.47; 109.712 | 3088.75 | Somerville, Rosie J.; Campos, Jesús; Carmona, Ernesto; Grabowsky, Simon; Malaspina, Lorraine A.; Balcells, David; Hevia, Eva; Nova, Ainara; Pérez-Jiménez, Marina; Borys, Andryj M. Unmasking the constitution and bonding of the proposed lithium nickelate “Li3NiPh3(solv)3”: Revealing the hidden C6H4 ligand Chemical Science, 2022 |
| 1566781 | CIF | C80 H126 Na6 Ni2 O6 | C 1 2/c 1 | 21.45144; 17.82545; 22.25202 90; 109.731; 90 | 8009.22 | Somerville, Rosie J.; Campos, Jesús; Carmona, Ernesto; Grabowsky, Simon; Malaspina, Lorraine A.; Balcells, David; Hevia, Eva; Nova, Ainara; Pérez-Jiménez, Marina; Borys, Andryj M. Unmasking the constitution and bonding of the proposed lithium nickelate “Li3NiPh3(solv)3”: Revealing the hidden C6H4 ligand Chemical Science, 2022 |
| 1566782 | CIF | C188.19 H213.43 N59.05 Ni6 O59.05 | R -3 :H | 45.98; 45.98; 9.5196 90; 90; 120 | 17429.6 | Cui, Mengxing; Murase, Ryuichi; Shen, Yongbing; Sato, Tetsu; Koyama, Shohei; Uchida, Kaiji; Tanabe, Tappei; Takaishi, Shinya; Yamashita, Masahiro; Iguchi, Hiroaki An electrically conductive metallocycle: densely packed molecular hexagons with π-stacked radicals Chemical Science, 2022 |
| 1566783 | CIF | C26 H35 N5 O2 | P 1 21/c 1 | 10.3083; 24.752; 10.4153 90; 108.265; 90 | 2523.58 | Liu, Hong-Chao; Kong, Xiangtao; Gong, Xiao-Ping; Li, Yuke; Niu, Zhi-Jie; Gou, Xue-Ya; Li, Xue-Song; Wang, Yu-Zhao; Shi, Wei-Yu; Huang, Yan-Chong; Liu, Xue-Yuan; Liang, Yong-Min Site-Selective Coupling of Remote C(sp3)−H/meta-C(sp2)−H Bonds Enabled by Ru/Photoredox Dual Catalysis and Mechanistic Studies Chemical Science, 2022 |
| 1566784 | CIF | C20 H26 Br N3 O | P 1 21/c 1 | 6.36816; 31.0073; 10.01092 90; 97.3165; 90 | 1960.66 | Liu, Hong-Chao; Kong, Xiangtao; Gong, Xiao-Ping; Li, Yuke; Niu, Zhi-Jie; Gou, Xue-Ya; Li, Xue-Song; Wang, Yu-Zhao; Shi, Wei-Yu; Huang, Yan-Chong; Liu, Xue-Yuan; Liang, Yong-Min Site-Selective Coupling of Remote C(sp3)−H/meta-C(sp2)−H Bonds Enabled by Ru/Photoredox Dual Catalysis and Mechanistic Studies Chemical Science, 2022 |
| 1566785 | CIF | C22 H30 N2 O2 | P 1 21/c 1 | 19.4831; 10.88; 9.8987 90; 99.028; 90 | 2072.29 | Liu, Hong-Chao; Kong, Xiangtao; Gong, Xiao-Ping; Li, Yuke; Niu, Zhi-Jie; Gou, Xue-Ya; Li, Xue-Song; Wang, Yu-Zhao; Shi, Wei-Yu; Huang, Yan-Chong; Liu, Xue-Yuan; Liang, Yong-Min Site-Selective Coupling of Remote C(sp3)−H/meta-C(sp2)−H Bonds Enabled by Ru/Photoredox Dual Catalysis and Mechanistic Studies Chemical Science, 2022 |
| 1566786 | CIF | O S6 Sn2 Sr2 Zn | P -4 21 m | 9.664; 9.664; 6.33 90; 90; 90 | 591.177 | Cheng, Yansong; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng Rational Design of a Promising Oxychalcogenide Infrared Nonlinear Optical Crystal Chemical Science, 2022 |
| 1566787 | CIF | C82 H82 Si2 | C 1 2/c 1 | 39.1632; 5.9464; 27.7746 90; 96.8606; 90 | 6421.8 | Ringström, Rasmus; Edhborg, Fredrik; Schroeder, Zachary W.; Chen, Lan; Ferguson, Michael J.; Tykwinski, Rik R.; Albinsson, Bo Molecular rotational conformation controls the rate of singlet fission and triplet decay in pentacene dimers Chemical Science, 2022 |
| 1566788 | CIF | C106 H126 Cl4 Si4 | P 1 21/c 1 | 8.3982; 34.669; 16.6828 90; 90.028; 90 | 4857.3 | Ringström, Rasmus; Edhborg, Fredrik; Schroeder, Zachary W.; Chen, Lan; Ferguson, Michael J.; Tykwinski, Rik R.; Albinsson, Bo Molecular rotational conformation controls the rate of singlet fission and triplet decay in pentacene dimers Chemical Science, 2022 |
| 1566789 | CIF | C106.65 H135.3 Cl1.3 Si4 | P 1 21/c 1 | 8.0655; 14.6582; 41.104 90; 91.616; 90 | 4857.6 | Ringström, Rasmus; Edhborg, Fredrik; Schroeder, Zachary W.; Chen, Lan; Ferguson, Michael J.; Tykwinski, Rik R.; Albinsson, Bo Molecular rotational conformation controls the rate of singlet fission and triplet decay in pentacene dimers Chemical Science, 2022 |
| 1566790 | CIF HKL Paper | C26 H13 F8 I4 N3 | P -1 | 9.1574; 12.0339; 14.0667 91.989; 96.924; 102.996 | 1496.35 | Bosch, Eric; Bowling, Nathan P. 5-{[4-(Dimethylamino)phenyl]ethynyl}pyrimidine–1,2,3,5-tetrafluoro-4,6-diiodobenzene (1/2) IUCrData, 2022, 7, x220380 |
| 1566791 | CIF | C38 H63 In N2 O3 | P -1 | 11.4082; 13.035; 14.939 66.497; 68.941; 83.213 | 1900.3 | Bruckmoser, Jonas; Henschel, Daniel; Vagin, Sergei; Rieger, Bernhard Combining high activity with broad monomer scope: indium salan catalysts in the ring-opening polymerization of various cyclic esters Catalysis Science & Technology, 2022, 12, 3295-3302 |
| 1566792 | CIF | C20 H17 N S | P 1 | 8.3698; 8.6024; 11.6963 103.438; 103.111; 102.977 | 762.79 | Yan, Qiaolin; Duan, Meng; Chen, Cien; Deng, Zhiqin; Wu, Mandi; Yu, Peiyuan; He, Ming-Liang; Zhu, Guangyu; Houk, Kendall N.; Sun, Jianwei Organocatalytic Discrimination of Non-Directing Aryl and Heteroaryl Groups: Enantioselective Synthesis of Bioactive Indole-Containing Triarylmethanes Chemical Science, 2022 |
| 1566793 | CIF | C20 H17 N S | P 1 | 8.4366; 8.5299; 11.8199 103.482; 103.756; 102.858 | 767.86 | Yan, Qiaolin; Duan, Meng; Chen, Cien; Deng, Zhiqin; Wu, Mandi; Yu, Peiyuan; He, Ming-Liang; Zhu, Guangyu; Houk, Kendall N.; Sun, Jianwei Organocatalytic Discrimination of Non-Directing Aryl and Heteroaryl Groups: Enantioselective Synthesis of Bioactive Indole-Containing Triarylmethanes Chemical Science, 2022 |
| 1566794 | CIF | C14 H12 F6 O | P 21 21 21 | 5.8199; 11.7062; 18.082 90; 90; 90 | 1231.9 | Sathe, Devavrat; Zhou, Junfeng; Chen, Hanlin; Schrage, Briana R.; Yoon, Seiyoung; Wang, Zeyu; Ziegler, Christopher J.; Wang, Junpeng Depolymerizable semi-fluorinated polymers for sustainable functional materials Polymer Chemistry, 2022, 13, 2608-2614 |
| 1566795 | CIF | C155 H119 Er2 N16 O21 Pr | P -1 | 16.3636; 19.5224; 23.3873 108.669; 108.321; 92.112 | 6640.37 | Aromi, Guillem; Maniaki, Diamantoula; Garay-Ruiz, Diego; Barrios, Leoní A.; Aguilà, David; Reta, Daniel; Roubeau, Olivier; Bo, Carles; Tuna, Floriana; Martins, Daniel O. T. A. Unparalleled selectivity and electronic structure of heterometallic [LnLn’Ln] molecules as 3-qubit quantum gates Chemical Science, 2022 |
| 1566796 | CIF | C463 H730 N26 O239 P8 V52 | P -1 | 26.268; 27.835; 30.643 87.768; 71.483; 69.654 | 19855 | Guo, Ji; Liu, Junrui; Cui, Yingcui; Liu, Chuanhong; Wang, Yangming; Wang, Mou; Huang, Danmeng; Chen, Guanying; Wang, Wei; Xia, Debin; Fang, Xikui Timing matters: pre-assembly versus post-assembly functionalization of a polyoxovanadate–organic cuboid Chemical Science, 2022 |
| 1566797 | CIF | C423 H697 N33 O273 S8 V54 | P -1 | 20.5891; 28.609; 33.168 113.872; 92.142; 103.627 | 17168 | Guo, Ji; Liu, Junrui; Cui, Yingcui; Liu, Chuanhong; Wang, Yangming; Wang, Mou; Huang, Danmeng; Chen, Guanying; Wang, Wei; Xia, Debin; Fang, Xikui Timing matters: pre-assembly versus post-assembly functionalization of a polyoxovanadate–organic cuboid Chemical Science, 2022 |
| 1566798 | CIF | C462 H719 N29 O236 P8 S0 V48 | C 1 2/c 1 | 45.21; 27.4006; 55.215 90; 113.919; 90 | 62525 | Guo, Ji; Liu, Junrui; Cui, Yingcui; Liu, Chuanhong; Wang, Yangming; Wang, Mou; Huang, Danmeng; Chen, Guanying; Wang, Wei; Xia, Debin; Fang, Xikui Timing matters: pre-assembly versus post-assembly functionalization of a polyoxovanadate–organic cuboid Chemical Science, 2022 |
| 1566799 | CIF | C61 H75 N4 Y2 | P -1 | 10.5717; 11.0365; 12.4271 67.8112; 87.4492; 79.2874 | 1318.6 | Benner, Florian; Demir, Selvan Isolation of the elusive bisbenzimidazole Bbim3−˙ radical anion and its employment in a metal complex Chemical Science, 2022 |
| 1566800 | CIF | C84 H128 K N6 O9 Y2 | P -1 | 13.03; 18.0681; 18.371 86.907; 78.05; 76.349 | 4111.72 | Benner, Florian; Demir, Selvan Isolation of the elusive bisbenzimidazole Bbim3−˙ radical anion and its employment in a metal complex Chemical Science, 2022 |
| 1566801 | CIF | C21 H19 N3 | P 1 21/c 1 | 15.2933; 5.6759; 18.003 90; 99.217; 90 | 1542.5 | Begam, Hasina Mamataj; Nandi, Shantanu; Jana, Ranjan Directing group switch in copper-catalyzed electrophilic C–H amination/migratory annulation cascade: divergent access to benzimidazolone/benzimidazole Chemical Science, 2022 |
| 1566802 | CIF | C16 H12 N2 S | P 1 21/c 1 | 6.1282; 14.1422; 14.4603 90; 95.255; 90 | 1247.95 | Begam, Hasina Mamataj; Nandi, Shantanu; Jana, Ranjan Directing group switch in copper-catalyzed electrophilic C–H amination/migratory annulation cascade: divergent access to benzimidazolone/benzimidazole Chemical Science, 2022 |
| 1566803 | CIF | C2.44 H2.44 N0.44 O0.11 | P -1 | 7.9957; 10.4307; 12.5078 67.727; 89.073; 71.4 | 908.36 | Begam, Hasina Mamataj; Nandi, Shantanu; Jana, Ranjan Directing group switch in copper-catalyzed electrophilic C–H amination/migratory annulation cascade: divergent access to benzimidazolone/benzimidazole Chemical Science, 2022 |
| 1566804 | CIF | C17 H13 N3 | P 1 21/n 1 | 10.9333; 7.34; 16.2518 90; 98.655; 90 | 1289.36 | Begam, Hasina Mamataj; Nandi, Shantanu; Jana, Ranjan Directing group switch in copper-catalyzed electrophilic C–H amination/migratory annulation cascade: divergent access to benzimidazolone/benzimidazole Chemical Science, 2022 |
| 1566805 | CIF | C23 H17 N3 | P 1 21/n 1 | 11.8246; 8.7668; 16.2183 90; 90.457; 90 | 1681.2 | Begam, Hasina Mamataj; Nandi, Shantanu; Jana, Ranjan Directing group switch in copper-catalyzed electrophilic C–H amination/migratory annulation cascade: divergent access to benzimidazolone/benzimidazole Chemical Science, 2022 |
| 1566806 | CIF | C19 H19 N O6 | P 21 21 21 | 8.7619; 9.0395; 21.2088 90; 90; 90 | 1679.8 | Zhang, Fangqing; Ren, Bing-Tao; Zhou, Yuqiao; Liu, Yangbin; Feng, Xiaoming Enantioselective Construction of cis-Hydroindole Scaffolds via Asymmetric Inverse-Electron-Demand Diels–Alder Reaction: Application to the Formal Total Synthesis of (+)-Minovincine Chemical Science, 2022 |
| 1566807 | CIF | C10 H9 B N2 | P 1 21/c 1 | 8.8712; 11.4894; 9.7181 90; 114.973; 90 | 897.91 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566808 | CIF | C21 H15 B N4 | P -1 | 9.6002; 9.8523; 10.4405 112.05; 100.947; 100.116 | 864.9 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566809 | CIF | C22 H17 B Cl2 N4 | P -1 | 7.6707; 8.6999; 15.3408 95.995; 100.572; 91.45 | 999.84 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566810 | CIF | C22 H17 B N4 O | P -1 | 9.6949; 9.9989; 10.3454 74.22; 68.3124; 89.2819 | 892.41 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566811 | CIF | C15 H11 B N4 | P c a 21 | 15.4138; 5.2751; 15.4456 90; 90; 90 | 1255.87 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566812 | CIF | C22 H17 B N4 | P 1 21/n 1 | 7.1974; 14.8004; 16.7357 90; 100.303; 90 | 1754.01 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566813 | CIF | C23 H19 B N4 O2 | P 1 21/n 1 | 11.0625; 11.3405; 15.4611 90; 94.428; 90 | 1933.87 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566814 | CIF | C24 H14 B F6 N3 O4 | P 1 21/c 1 | 11.8628; 19.2303; 11.1122 90; 114.593; 90 | 2305.02 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566815 | CIF | C20 H14 B Cl3 N4 S | P -1 | 9.5849; 9.6966; 12.5042 102.614; 92.073; 115.981 | 1007.91 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566816 | CIF | C20 H16 B N3 | P 1 21/c 1 | 6.7975; 8.0452; 29.5872 90; 95.797; 90 | 1609.77 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566817 | CIF | C22 H14 B F3 N4 | P -1 | 8.8691; 9.7159; 11.5592 87.751; 85.002; 66.221 | 908.04 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566818 | CIF | C34 H30 B2 N8 O2 | P b c a | 15.0807; 9.7071; 19.4956 90; 90; 90 | 2853.96 | Tang, Qi; Shi, Xiaodong; Richardson, David; Wojtas, Lukasz; Shan, Chuan; He, Ying; Lan, Yu; Yuan, Teng; Ye, Xiaohan; Li, Shi-Jun; Zhao, Kai Design and Synthesis of Stable Four-Coordinated Benzotriazole-Borane with Tunable Fluorescence Emission Chemical Science, 2022 |
| 1566819 | CIF | C30 H25 F6 N S Sb | C 1 2/c 1 | 15.8665; 24.95; 16.2233 90; 99.104; 90 | 6341.4 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566820 | CIF | C48 H45 N S | P 1 21/n 1 | 16.8923; 13.2924; 17.9856 90; 113.172; 90 | 3712.68 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566821 | CIF | C31 H27 Cl2 N S | P 1 21/n 1 | 11.1803; 7.7394; 30.7513 90; 99.961; 90 | 2620.76 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566822 | CIF | C52 H47 N S | R -3 :H | 36.5917; 36.5917; 17.7385 90; 90; 120 | 20569 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566823 | CIF | C74 H69 N S | P -1 | 7.169; 17.2492; 25.1684 106.66; 90.552; 96.116 | 2962.06 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566824 | CIF | C11 H10 O S | P 1 | 7.0221; 7.9102; 9.5017 106.659; 105.234; 101.17 | 466.74 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566825 | CIF | C26 H23 N S | P c c n | 23.8497; 21.8615; 7.9142 90; 90; 90 | 4126.4 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566826 | CIF | C18 H16 O2 S | P b c n | 19.5758; 8.4512; 18.7056 90; 90; 90 | 3094.64 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566827 | CIF | C18 H10 F6 O6 S3 | P -1 | 8.4229; 10.6178; 12.2594 100.265; 102.985; 94.205 | 1043.88 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566828 | CIF | C13 H11.5 F3 N0.5 S0.5 Sb0.5 | C 1 2/m 1 | 27.184; 6.8384; 19.415 90; 133.036; 90 | 2638 | Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science, 2022 |
| 1566829 | CIF | C18 H20 B10 | P -1 | 7.1379; 19.799; 27.542 110.801; 90.566; 90.757 | 3637.9 | Ji, Lei; Riese, Stefan; Schmiedel, Alexander; Holzapfel, Marco; Fest, Maximillian; Nitsch, Jörn; Curchod, Basile F. E.; Friedrich, Alexandra; Wu, Lin; Al Mamari, Hamad H.; Hammer, Sebastian; Pflaum, Jens; Fox, Mark A.; Tozer, David J.; Finze, Maik; Lambert, Christoph; Marder, Todd B. Thermodynamic equilibrium between locally excited and charge-transfer states through thermally activated charge transfer in 1-(pyren-2′-yl)-o-carborane Chemical Science, 2022 |
| 1566830 | CIF | C24 H37 F6 N2 O P Ru | P -1 | 9.637; 9.944; 27.528 95.325; 97.691; 96.476 | 2582 | Sumitani, Ryo; Yamanaka, Masamichi; Mochida, Tomoyuki On-demand gelation of ionic liquids using photoresponsive organometallic gelators. Soft matter, 2022, 18, 3479-3486 |
| 1566831 | CIF | C36 H24 N3 P S4 | P 1 21 1 | 9.351; 14.475; 12.042 90; 111.149; 90 | 1520.2 | Jena, Satyam; Jusaina, Jusaina; Behera, Santosh Kumar; Kitahara, Maho; Imai, Yoshitane; Thilagar, P. Crystallization Induced Room-Temperature Phosphorescence and Chiral Photoluminescence Properties of Phosphoramides Chemical Science, 2022 |
| 1566832 | CIF | C36 H24 N3 O P S3 | C 1 2/c 1 | 27.1703; 14.9942; 17.8873 90; 111.203; 90 | 6793.9 | Jena, Satyam; Jusaina, Jusaina; Behera, Santosh Kumar; Kitahara, Maho; Imai, Yoshitane; Thilagar, P. Crystallization Induced Room-Temperature Phosphorescence and Chiral Photoluminescence Properties of Phosphoramides Chemical Science, 2022 |
| 1566833 | CIF | C36 H24 N3 P0.5 S4 Se | P 1 21 1 | 9.3508; 14.3508; 11.9256 90; 111.396; 90 | 1490.02 | Jena, Satyam; Jusaina, Jusaina; Behera, Santosh Kumar; Kitahara, Maho; Imai, Yoshitane; Thilagar, P. Crystallization Induced Room-Temperature Phosphorescence and Chiral Photoluminescence Properties of Phosphoramides Chemical Science, 2022 |
| 1566834 | CIF | C9 H11 N O3 | P 1 21 1 | 7.6764; 5.887; 9.6143 90; 94.575; 90 | 433.1 | Smalley, Christopher J. H.; Hoskyns, Harriet E.; Hughes, Colan E.; Johnstone, Duncan N.; Willhammar, Tom; Young, Mark T.; Pickard, Christopher J.; Logsdail, Andrew J.; Midgley, Paul A.; Harris, Kenneth D. M. A structure determination protocol based on combined analysis of 3D-ED data, powder XRD data, solid-state NMR data and DFT-D calculations reveals the structure of a new polymorph of l-tyrosine Chemical Science, 2022 |
| 1566835 | CIF | C18 H15 N3 | P 1 21/c 1 | 13.5606; 14.1429; 7.6056 90; 93.62; 90 | 1455.7 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566836 | CIF | C23 H19 N3 | P -1 | 7.4368; 11.5205; 11.7843 107.748; 101.471; 103.216 | 895.98 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566837 | CIF | C22 H17 N3 | P -1 | 7.5636; 10.607; 11.488 104.037; 99.019; 104.02 | 844.45 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566838 | CIF | C24 H21 N3 | P 1 21/c 1 | 10.9544; 15.459; 12.2647 90; 113.683; 90 | 1902 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566839 | CIF | C27 H19 N3 | P 1 21/n 1 | 7.4603; 14.026; 19.2722 90; 98.736; 90 | 1993.2 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566840 | CIF | C35 H23 N3 | P 1 21/c 1 | 9.7978; 27.007; 10.7502 90; 116.236; 90 | 2551.6 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566841 | CIF | C38 H25 Cl2 N3 | P 1 21/c 1 | 11.6662; 23.9537; 12.582 90; 115.611; 90 | 3170.6 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566842 | CIF | C26 H25 N3 | P b c n | 19.753; 10.6344; 20.535 90; 90; 90 | 4313.6 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566843 | CIF | C29 H23 N3 S2 | P 1 21/n 1 | 17.7692; 7.587; 17.8377 90; 91.248; 90 | 2404.2 | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives Chemical Science, 2022 |
| 1566844 | CIF | C16 H11 N O2 | C m c 21 | 14.732; 10.702; 7.661 90; 90; 90 | 1207.8 | Owatari, Yoshihiro; Iseki, Shuta; Ogata, Daiji; Yuasa, Junpei Catalytic electron drives host–guest recognition Chemical Science, 2022 |
| 1566845 | CIF | C117 H190 Br6 Mg6 N8 O6 | P 1 21 1 | 19.2717; 16.1154; 19.692 90; 93.454; 90 | 6104.66 | Monasterolo, Claudio; O'Gara, Ryan; Kavanagh, Saranna; Byrne, Sadbh Elise; Bieszczad, Bartosz; Murray, Orla; Wiesinger, Michael; Lynch, Rebecca; Nikitin, Kirill; Gilheany, Declan Gerard Asymmetric addition of Grignard reagents to ketones: culmination of the ligand-mediated methodology allows modular construction of chiral tertiary alcohols Chemical Science, 2022 |
| 1566846 | CIF | C20 H23 Br2 N O2 | P 1 21 1 | 15.0842; 18.1183; 15.8577 90; 109.235; 90 | 4091.96 | Monasterolo, Claudio; O'Gara, Ryan; Kavanagh, Saranna; Byrne, Sadbh Elise; Bieszczad, Bartosz; Murray, Orla; Wiesinger, Michael; Lynch, Rebecca; Nikitin, Kirill; Gilheany, Declan Gerard Asymmetric addition of Grignard reagents to ketones: culmination of the ligand-mediated methodology allows modular construction of chiral tertiary alcohols Chemical Science, 2022 |
| 1566847 | CIF | C15 H21 N O2 | P 1 21/n 1 | 9.7766; 13.914; 21.1903 90; 97.758; 90 | 2856.17 | Guan, Zhipeng; Zhong, Xingxing; Ye, Yayu; Li, Xiangwei; Cong, Hengjiang; Yi, Hong; Zhang, Heng; Huang, Zhiliang; Lei, Aiwen Selective Radical Cascade (4+2) Annulation with Olefins towards the Synthesis of Chroman Derivatives via Organo-Photoredox Catalysis Chemical Science, 2022 |
| 1566848 | CIF HKL Paper | C15 H11 N O3 S | P 1 21/c 1 | 12.6886; 9.2655; 11.6024 90; 105.374; 90 | 1315.24 | Pineda, Leslie W.; Ferllini, Natasha; Cabezas, Jorge A. 1-(Phenylsulfonyl)-1<i>H</i>-indole-2-carbaldehyde IUCrData, 2022, 7, x220401 |
| 1566849 | CIF HKL Paper | C50 H38 Mn N5 O3 | P c c n | 20.1021; 21.5505; 17.9807 90; 90; 90 | 7789.4 | Cao, Hongli; Wang, Junwen; Li, Jianfeng Nitrato(5,10,15,20-tetraphenylporphinato)manganese(III)–benzene–<i>n</i>-hexane (2/1/1) IUCrData, 2022, 7, x220386 |
| 1566850 | CIF | C3 H18 Al F9 O18 S3 | P 21 21 21 | 6.4503; 15.415; 22.904 90; 90; 90 | 2277.38 | Pastel, Glenn R.; Chen, Ying; Pollard, Travis P.; Schroeder, Marshall A.; Bowden, Mark E.; Zheng, Allen; Hahn, Nathan T.; Ma, Lin; Murugesan, Vijayakumar; Ho, Janet; Garaga, Mounesha; Borodin, Oleg; Mueller, Karl; Greenbaum, Steven; Xu, Kang A sobering examination of the feasibility of aqueous aluminum batteries Energy & Environmental Science, 2022, 15, 2460-2469 |
| 1566851 | CIF | C14 H17 N2 O P | P 21 21 21 | 7.2488; 10.7508; 17.638 90; 90; 90 | 1374.5 | Zhang, Ying; Yuan, Jia; Huang, Guanglong; Yu, Hong; Liu, Jinpeng; Chen, Jian; Meng, Sixuan; Zhong, Jian-Ji; Dang, Li; Yu, Guang-Ao; Che, Chi-Ming Direct visible-light-induced synthesis of P-stereogenic phosphine oxides under air conditions. Chemical science, 2022, 13, 6519-6524 |
| 1566852 | CIF | C18 H35 Cl N2 O P2 | P 1 21 1 | 10.2116; 22.6532; 10.5288 90; 114.869; 90 | 2209.74 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566853 | CIF | C27 H48 I N3 O P2 | P 21 21 21 | 11.3375; 16.044; 17.0248 90; 90; 90 | 3096.79 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566854 | CIF | C28 H50 I N3 O P2 | P 21 21 21 | 11.2847; 16.6693; 16.9948 90; 90; 90 | 3196.86 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566855 | CIF | C18 H36 N2 O2 P2 | P 1 | 10.1507; 10.483; 12.0198 71.0631; 77.4831; 65.8533 | 1098.71 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566856 | CIF | C28 H52 N2 O2 P2 | P 21 21 21 | 9.9457; 13.5082; 22.3174 90; 90; 90 | 2998.31 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566857 | CIF | C27 H47 N3 O P2 | P 1 | 9.5345; 11.9909; 13.3121 104.379; 90.136; 94.2154 | 1469.93 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566858 | CIF | C26 H45 N3 O P2 | P 1 21 1 | 15.1934; 13.5842; 20.878 90; 101.6; 90 | 4221.01 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566859 | CIF | C28 H50 I N3 O P2 | P 1 21 1 | 10.0206; 28.85; 11.9155 90; 110.382; 90 | 3229.03 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566860 | CIF | C28 H50 I N3 O P2 | P 21 21 21 | 11.3691; 16.4031; 17.294 90; 90; 90 | 3225.13 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566861 | CIF | C27 H47 N3 O P2 | P 1 | 9.5482; 12.0125; 13.2604 103.899; 90.8396; 94.8447 | 1470.17 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566862 | CIF | C26 H45 N3 O P2 | P 21 21 21 | 9.3035; 15.6398; 19.0287 90; 90; 90 | 2768.77 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566863 | CIF | C27 H47 N3 O P2 | P 1 | 9.5547; 11.9843; 13.3167 103.719; 90.305; 94.423 | 1476.49 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566864 | CIF | C28.5 H56 I N3 O P2 | C 1 2 1 | 14.361; 11.6776; 20.98 90; 92.239; 90 | 3515.7 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566865 | CIF | C27 H54 I N3 O P2 | P 21 21 21 | 11.0895; 16.8933; 17.0952 90; 90; 90 | 3202.6 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566866 | CIF | C27 H48 I N3 O P2 | P 21 21 21 | 11.7716; 15.9064; 16.4323 90; 90; 90 | 3076.85 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566867 | CIF | C23 H48 I N3 O P2 | C 1 2 1 | 14.3333; 11.7334; 18.0008 90; 97.111; 90 | 3004.1 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566868 | CIF | C28.5 H56 I N3 O P2 | C 1 2 1 | 14.3801; 11.8816; 20.9273 90; 100.971; 90 | 3510.3 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566869 | CIF | C28 H50 I N3 O P2 | P 1 21 1 | 9.9808; 28.802; 11.8786 90; 109.431; 90 | 3220.21 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566870 | CIF | C23 H48 I N3 O P2 | P 1 21 1 | 14.2761; 11.8123; 18.2335 90; 97.663; 90 | 3047.3 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566871 | CIF | C28 H50 I N3 O P2 | P 1 21 1 | 9.9968; 28.7847; 11.8857 90; 109.645; 90 | 3221.1 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566872 | CIF | C27 H54 I N3 O P2 | P 1 21 1 | 9.6161; 35.768; 9.7814 90; 98.955; 90 | 3323.3 | Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S. A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines Chemical Science, 2022 |
| 1566873 | CIF | C11 H10 F N O2 | P 1 21/c 1 | 13.2434; 3.8259; 19.122 90; 92.63; 90 | 967.85 | Xing, Yi; Li, Zhongyu; Baryshnikov, Glib; Shen, Shen; Ye, Danfeng; Ågren, Hans; Zhu, Liangliang Water Molecular Bridge-Induced Selective Dual Polarization in Crystals for Stable Multi-Emitter Chemical Science, 2022 |
| 1566874 | CIF | C16 H14 N2 O2 | P 1 2/c 1 | 9.948; 5.7541; 23.8405 90; 100.984; 90 | 1339.67 | Xing, Yi; Li, Zhongyu; Baryshnikov, Glib; Shen, Shen; Ye, Danfeng; Ågren, Hans; Zhu, Liangliang Water Molecular Bridge-Induced Selective Dual Polarization in Crystals for Stable Multi-Emitter Chemical Science, 2022 |
| 1566875 | CIF | C16 H13 F N2 O2 | P -1 | 10.5395; 10.6712; 13.2594 76.844; 85.075; 72.914 | 1387.8 | Xing, Yi; Li, Zhongyu; Baryshnikov, Glib; Shen, Shen; Ye, Danfeng; Ågren, Hans; Zhu, Liangliang Water Molecular Bridge-Induced Selective Dual Polarization in Crystals for Stable Multi-Emitter Chemical Science, 2022 |
| 1566876 | CIF | C15 H15 I O3 S | R -3 :H | 20.7704; 20.7704; 21.5736 90; 90; 120 | 8060.1 | Soldatova, Natalia S.; Postnikov, Pavel S.; Ivanov, Daniil M.; Semyonov, Oleg V.; Kukurina, Olga S.; Guselnikova, Olga; Yamauchi, Yusuke; Wirth, Thomas; Zhdankin, Viktor V.; Yusubov, Mekhman S.; Gomila, Rosa M.; Frontera, Antonio; Resnati, Giuseppe; Kukushkin, Vadim Yu. Zwitterionic iodonium species afford halogen bond-based porous organic frameworks Chemical Science, 2022 |
| 1566877 | CIF | C14 H13 I O3 S | P 1 21/c 1 | 7.0964; 23.1449; 8.145 90; 97.033; 90 | 1327.71 | Soldatova, Natalia S.; Postnikov, Pavel S.; Ivanov, Daniil M.; Semyonov, Oleg V.; Kukurina, Olga S.; Guselnikova, Olga; Yamauchi, Yusuke; Wirth, Thomas; Zhdankin, Viktor V.; Yusubov, Mekhman S.; Gomila, Rosa M.; Frontera, Antonio; Resnati, Giuseppe; Kukushkin, Vadim Yu. Zwitterionic iodonium species afford halogen bond-based porous organic frameworks Chemical Science, 2022 |
| 1566878 | CIF | C12 H8 Cl I O3 S | P -1 | 6.0981; 8.1137; 25.8853 94.961; 93.997; 91.858 | 1271.9 | Soldatova, Natalia S.; Postnikov, Pavel S.; Ivanov, Daniil M.; Semyonov, Oleg V.; Kukurina, Olga S.; Guselnikova, Olga; Yamauchi, Yusuke; Wirth, Thomas; Zhdankin, Viktor V.; Yusubov, Mekhman S.; Gomila, Rosa M.; Frontera, Antonio; Resnati, Giuseppe; Kukushkin, Vadim Yu. Zwitterionic iodonium species afford halogen bond-based porous organic frameworks Chemical Science, 2022 |
| 1566879 | CIF | C15 H15 I O3 S | P -1 | 10.1666; 14.3384; 20.5652 84.479; 82.633; 74.902 | 2864.29 | Soldatova, Natalia S.; Postnikov, Pavel S.; Ivanov, Daniil M.; Semyonov, Oleg V.; Kukurina, Olga S.; Guselnikova, Olga; Yamauchi, Yusuke; Wirth, Thomas; Zhdankin, Viktor V.; Yusubov, Mekhman S.; Gomila, Rosa M.; Frontera, Antonio; Resnati, Giuseppe; Kukushkin, Vadim Yu. Zwitterionic iodonium species afford halogen bond-based porous organic frameworks Chemical Science, 2022 |
| 1566880 | CIF | C50 H32 O4 | P 1 21 1 | 6.9528; 13.3069; 37.0562 90; 91.951; 90 | 3426.46 | Han, Jianlei; Shi, Yonghong; Jin, Xue; Yang, Xuefeng; Duan, Pengfei Regulating the Excited State Chirality to Fabricate High-Performance-Solid-State Circularly Polarized Luminescence Materials Chemical Science, 2022 |
| 1566881 | CIF | C52 H36 O5 | P 21 21 21 | 7.2123; 17.9092; 27.4926 90; 90; 90 | 3551.12 | Han, Jianlei; Shi, Yonghong; Jin, Xue; Yang, Xuefeng; Duan, Pengfei Regulating the Excited State Chirality to Fabricate High-Performance-Solid-State Circularly Polarized Luminescence Materials Chemical Science, 2022 |
| 1566882 | CIF | C54 H38 O4 | P 21 21 21 | 25.8331; 10.6809; 13.7334 90; 90; 90 | 3789.3 | Han, Jianlei; Shi, Yonghong; Jin, Xue; Yang, Xuefeng; Duan, Pengfei Regulating the Excited State Chirality to Fabricate High-Performance-Solid-State Circularly Polarized Luminescence Materials Chemical Science, 2022 |
| 1566883 | CIF | C54 H30 O4 | P 21 21 21 | 10.2762; 13.1669; 26.875 90; 90; 90 | 3636.3 | Han, Jianlei; Shi, Yonghong; Jin, Xue; Yang, Xuefeng; Duan, Pengfei Regulating the Excited State Chirality to Fabricate High-Performance-Solid-State Circularly Polarized Luminescence Materials Chemical Science, 2022 |
| 1566884 | CIF | C39 H34 O3 | P 1 21 1 | 10.9647; 18.7819; 14.2842 90; 98.404; 90 | 2910.07 | Han, Jianlei; Shi, Yonghong; Jin, Xue; Yang, Xuefeng; Duan, Pengfei Regulating the Excited State Chirality to Fabricate High-Performance-Solid-State Circularly Polarized Luminescence Materials Chemical Science, 2022 |
| 1566885 | CIF | C H N O S | C 1 m 1 | 9.1813; 32.2736; 40.651 90; 96.354; 90 | 11971.5 | Zhang, Zhe; Bai, Qixia; Manandhar, Erendra; Zeng, Yunting; Wu, Tun; Wang, Ming; Yao, Liao-Yuan; Newkome, George R.; Wang, Pingshan; Xie, Tingzheng Supramolecular Cuboctahedra with Aggregation-Induced Emission Enhancement and External Binding Ability Chemical Science, 2022 |
| 1566886 | CIF | C98 H61 N12 S2 | P -1 | 13.8636; 15.9137; 20.4987 83.865; 73.294; 85.019 | 4299.28 | Zhang, Zhe; Bai, Qixia; Manandhar, Erendra; Zeng, Yunting; Wu, Tun; Wang, Ming; Yao, Liao-Yuan; Newkome, George R.; Wang, Pingshan; Xie, Tingzheng Supramolecular Cuboctahedra with Aggregation-Induced Emission Enhancement and External Binding Ability Chemical Science, 2022 |
| 1566887 | CIF | C29 H18 N | P -1 | 8.4867; 12.972; 18.128 105.478; 90.206; 96.312 | 1910.5 | Meng, Guoyun; Zhang, Dongdong; Wei, Jinbei; Zhang, Yuewei; Huang, Tianyu; Liu, Ziyang; Yin, Chen; Hong, Xiangchen; Wang, Xiang; Zeng, Xuan; Yang, Dezhi; Ma, Dongge; Li, Guomeng; Duan, Lian Highly efficient and stable deep-blue OLEDs based on narrowband emitters featuring an orthogonal spiro-configured indolo[3,2,1-de]acridine structure Chemical Science, 2022 |
| 1566888 | CIF | C28 H31 Cl N2 O2 Si | P -1 | 8.2938; 10.0055; 17.6368 74.549; 88.4; 68.207 | 1305.72 | Miller, Stephen; Rao, Desaboini Nageswara; Ji, Xincai Silicon functionalization expands the repertoire of Si-rhodamine fluorescent probes Chemical Science, 2022 |
| 1566889 | CIF | C31 H39 Al N2 | P 1 21/n 1 | 8.6731; 13.6845; 22.6164 90; 95.026; 90 | 2673.95 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566890 | CIF | C68 H80 Al2 N4 | I 1 2/a 1 | 16.9198; 22.2833; 17.4576 90; 117.934; 90 | 5815.14 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566891 | CIF | C159 H188 Al4 I8 N8 | P -1 | 15.879; 16.076; 16.533 92.956; 109.505; 102.27 | 3853 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566892 | CIF | C78 H91 Al2 N4 | P 1 21/c 1 | 15.4528; 15.2329; 28.0296 90; 96.742; 90 | 6552.29 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566893 | CIF | C71 H83 Al2 N4 | P -1 | 13.438; 15.123; 15.478 75.326; 80.106; 84.764 | 2993.9 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566894 | CIF | C68 H88 Al2 N4 | P -1 | 11.884; 15.4141; 18.4138 112.49; 90.87; 105.49 | 2977.13 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566895 | CIF | C33 H34 F3 O12 P S | P 1 21 1 | 10.5045; 16.82; 11.0991 90; 112.514; 90 | 1811.6 | Liu, Fen; Huang, Haiyang; Sun, Longgen; Yan, Zeen; Tan, Xiao; Li, Jing; Luo, Xinyue; Ding, Haixin; Xiao, Qiang P(v) intermediate-mediated E1cB elimination for the synthesis of glycals Chemical Science, 2022 |
| 1566896 | CIF | C51 H54 B N3 | C 1 2/c 1 | 15.582; 33.295; 18.241 90; 90.452; 90 | 9463 | Jiang, Long; Wang, Yu; Tan, Dehui; Chen, Xiaobin; Ma, Tinghao; Zhang, Baoliang; Yang, Deng-Tao Access to tetracoordinate boron-doped polycyclic aromatic hydrocarbons with delayed fluorescence and aggregation-induced emission under mild conditions Chemical Science, 2022 |
| 1566897 | CIF | C59.42 H70.28 B N3 | I 1 2/a 1 | 21.747; 19.582; 23.834 90; 90.748; 90 | 10148.8 | Jiang, Long; Wang, Yu; Tan, Dehui; Chen, Xiaobin; Ma, Tinghao; Zhang, Baoliang; Yang, Deng-Tao Access to tetracoordinate boron-doped polycyclic aromatic hydrocarbons with delayed fluorescence and aggregation-induced emission under mild conditions Chemical Science, 2022 |
| 1566898 | CIF | C56 H62 B N3 | P -1 | 11.0795; 14.238; 15.3074 83.621; 78.486; 77.897 | 2307.5 | Jiang, Long; Wang, Yu; Tan, Dehui; Chen, Xiaobin; Ma, Tinghao; Zhang, Baoliang; Yang, Deng-Tao Access to tetracoordinate boron-doped polycyclic aromatic hydrocarbons with delayed fluorescence and aggregation-induced emission under mild conditions Chemical Science, 2022 |
| 1566899 | CIF | C22 H17 F3 O3 | P 1 21/c 1 | 11.6118; 9.7486; 17.4474 90; 102.403; 90 | 1928.9 | Zhang, Qi; Chiou, Mong-Feng; Ye, Changqing; Yuan, Xiaobin; Li, Yajun; Bao, Hongli Radical 1,2,3-Tricarbofunctionalization of α-Vinyl-β-Ketoesters Enabled by Carbon Shift from All-carbon Quaternary Center Chemical Science, 2022 |
| 1566900 | CIF | C23 H18 Cl F3 O4 | P 1 21/n 1 | 8.9925; 15.5533; 16.006 90; 105.451; 90 | 2157.7 | Zhang, Qi; Chiou, Mong-Feng; Ye, Changqing; Yuan, Xiaobin; Li, Yajun; Bao, Hongli Radical 1,2,3-Tricarbofunctionalization of α-Vinyl-β-Ketoesters Enabled by Carbon Shift from All-carbon Quaternary Center Chemical Science, 2022 |
| 1566901 | CIF | C23 H18 Cl F3 O3 | P 1 21/c 1 | 12.5234; 9.7432; 17.5168 90; 97.018; 90 | 2121.35 | Zhang, Qi; Chiou, Mong-Feng; Ye, Changqing; Yuan, Xiaobin; Li, Yajun; Bao, Hongli Radical 1,2,3-Tricarbofunctionalization of α-Vinyl-β-Ketoesters Enabled by Carbon Shift from All-carbon Quaternary Center Chemical Science, 2022 |
| 1566902 | CIF | C22 H19 F3 O3 | P 1 21/c 1 | 15.1282; 11.8989; 11.623 90; 111.112; 90 | 1951.8 | Zhang, Qi; Chiou, Mong-Feng; Ye, Changqing; Yuan, Xiaobin; Li, Yajun; Bao, Hongli Radical 1,2,3-Tricarbofunctionalization of α-Vinyl-β-Ketoesters Enabled by Carbon Shift from All-carbon Quaternary Center Chemical Science, 2022 |
| 1566903 | CIF HKL Paper | C32 H29 Br N2 O10 S3 | P 1 21 1 | 16.99261; 6.02635; 17.4076 90; 107.831; 90 | 1696.97 | Azzam, Rasha A.; Elgemeie, Galal H.; Gad, Nagwa M.; Jones, Peter G. 4-Amino-5-(4-bromobenzoyl)-3-(benzo[<i>d</i>]thiazol-2-yl)-2-[(2',3',4',6'-tetra-<i>O</i>-acetyl-β-<small>D</small>-galactopyranosyl)sulfanyl]thiophene IUCrData, 2022, 7, x220412 |
| 1566904 | CIF HKL Paper | C16 H20 Cl2 N2 O4 | P 1 21/c 1 | 19.1257; 9.3864; 10.0502 90; 103.546; 90 | 1754.04 | Obidova, Nodira; Ashurov, Jamshid; Izotova, Lidiya; Ibragimov, Bakhtiyar 2-Hydroxyethylammonium [2-(2,6-dichloroanilino)phenyl]acetate monohydrate IUCrData, 2022, 7, x220441 |
| 1566905 | CIF | C64 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.5713; 15.332; 21.6572 90; 96.891; 90 | 6781.3 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566906 | CIF | C66 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.7927; 15.218; 21.7299 90; 93.52; 90 | 6862.9 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566907 | CIF | C67 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.6916; 15.2813; 21.6745 90; 92.481; 90 | 6846.93 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566908 | CIF | C66 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.5389; 15.2128; 21.6422 90; 94.526; 90 | 6741.1 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566909 | CIF | C66 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.7798; 15.2345; 21.6564 90; 93.144; 90 | 6845.4 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566910 | CIF | C30 H20 As Co O2 | P -1 | 9.0514; 10.5907; 12.8357 76.116; 84.418; 78.076 | 1167.24 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566911 | CIF | C18 H12 As Co O2 | P n a 21 | 11.2347; 17.2771; 7.8356 90; 90; 90 | 1520.91 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566912 | CIF | C10 H12 As Cl2 Co Hg O2 | C 1 2/c 1 | 14.1928; 14.4745; 14.7169 90; 99.34; 90 | 2983.27 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566913 | CIF | C23 H12 As Co F10 O3 Pt | P 21 21 21 | 9.1891; 12.7559; 21.0227 90; 90; 90 | 2464.18 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566914 | CIF | C10 H12 As Cl2 Co Hg O2 | P 1 21/n 1 | 8.8304; 14.2969; 11.846 90; 94.222; 90 | 1491.47 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566915 | CIF | C16 H33 As Co O4 P Si2 | C 1 c 1 | 7.9385; 19.9045; 15.3637 90; 90.3; 90 | 2427.61 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566916 | CIF | C32 H24 As2 Au2 Co2 F10 O4 | P -1 | 15.1208; 21.7675; 23.8537 100.283; 104.78; 91.078 | 7452.43 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566917 | CIF | C12 H21 As Co O4 P | P 1 21/n 1 | 8.198; 14.8986; 26.2475 90; 97.071; 90 | 3181.45 | Kirk, Ryan M.; Hill, Anthony Arsolyl-Supported Intermetallic Dative Bonding Chemical Science, 2022 |
| 1566918 | CIF | C22 H38 N2 O7 | P 21 21 21 | 9.608; 13.2461; 20.0321 90; 90; 90 | 2549.46 | Chen, Wei-An; Chen, Yu-Hsin; Hsieh, Chiao-Yun; Hung, Pi-Fang; Chen, Chiao-Wen; Chen, Chien-Hung; Lin, Jung-Lee; Cheng, Ting-Jen R.; Hsu, Tsui-Ling; Wu, Ying-Ta; Shen, Chia-Ning; Cheng, Wei-Chieh Harnessing natural-product-inspired combinatorial chemistry and computation-guided synthesis to develop N-glycan modulators as anticancer agents Chemical Science, 2022 |
| 1566920 | CIF | C30 H28 O4 | P -1 | 10.891; 11.4276; 11.5284 116.793; 90.271; 101.247 | 1249.11 | Zhang, Qiao; Wang, Wenbo; Cai, Changyong; Wu, Shuanggen; Li, Jialing; Li, Fenfang; Dong, Shengyi Underwater luminescent labeling materials constructed from a supramolecular approach. Materials horizons, 2022, 9, 1984-1991 |
| 1566921 | CIF | C30 H28 O4 | P -1 | 7.8756; 11.8787; 13.8525 84.512; 84.625; 71.646 | 1221.59 | Zhang, Qiao; Wang, Wenbo; Cai, Changyong; Wu, Shuanggen; Li, Jialing; Li, Fenfang; Dong, Shengyi Underwater luminescent labeling materials constructed from a supramolecular approach. Materials horizons, 2022, 9, 1984-1991 |
| 1566922 | CIF | C108 H99 Cl9 O12 | P -1 | 14.9569; 17.9039; 22.5745 69.1; 74.702; 88.173 | 5434.3 | Fang, Shuai; Wang, Mengbin; Wu, Yating; Guo, Qing-Hui; Li, Errui; Li, Hao; Huang, Feihe Cagearenes: synthesis, characterization, and application for programmed vapor release Chemical Science, 2022 |
| 1566923 | CIF | C123 H114 O12 | C 1 2/c 1 | 25.7782; 18.2534; 27.4389 90; 117.813; 90 | 11419.5 | Fang, Shuai; Wang, Mengbin; Wu, Yating; Guo, Qing-Hui; Li, Errui; Li, Hao; Huang, Feihe Cagearenes: synthesis, characterization, and application for programmed vapor release Chemical Science, 2022 |
| 1566924 | CIF | C145 H148 O12 | P -1 | 14.166; 18.6824; 23.8099 82.321; 87.364; 74.141 | 6006.9 | Fang, Shuai; Wang, Mengbin; Wu, Yating; Guo, Qing-Hui; Li, Errui; Li, Hao; Huang, Feihe Cagearenes: synthesis, characterization, and application for programmed vapor release Chemical Science, 2022 |
| 1566925 | CIF | C114 H108 O12 | P -1 | 13.898; 19.031; 24.191 112.073; 103.948; 93.107 | 5680 | Fang, Shuai; Wang, Mengbin; Wu, Yating; Guo, Qing-Hui; Li, Errui; Li, Hao; Huang, Feihe Cagearenes: synthesis, characterization, and application for programmed vapor release Chemical Science, 2022 |
| 1566926 | CIF | C40 H58 Li2 O10 S2 | P 1 21/n 1 | 11.2936; 21.8827; 17.1083 90; 94.544; 90 | 4214.8 | Plajer, Alex Johannes; Pröhm, Patrick; Rupf, Susanne M. Lithium achieves sequence selective ring-opening terpolymerisation (ROTERP) of ternary monomer mixtures Chemical Science, 2022 |
| 1566927 | CIF | C12 H13 Na O3 S | P -1 | 5.9833; 9.3642; 11.7461 90.127; 101.89; 97.726 | 637.85 | Plajer, Alex Johannes; Pröhm, Patrick; Rupf, Susanne M. Lithium achieves sequence selective ring-opening terpolymerisation (ROTERP) of ternary monomer mixtures Chemical Science, 2022 |
| 1566928 | CIF | C12 H13 K O3 S | P 1 2/n 1 | 15.1783; 6.6961; 30.176 90; 104.412; 90 | 2970.4 | Plajer, Alex Johannes; Pröhm, Patrick; Rupf, Susanne M. Lithium achieves sequence selective ring-opening terpolymerisation (ROTERP) of ternary monomer mixtures Chemical Science, 2022 |
| 1566929 | CIF | C8 H8 Cr N4 Ni O5 | P 1 21 1 | 6.6931; 8.4975; 9.8328 90; 102.711; 90 | 545.53 | Tang, Hsu-Yen; Lee, Gene-Hsiang; Ng, Kwai-Kong; Yang, Chen-I A Three-Dimensional Coordination Framework with a Ferromagnetic Coupled Ni(II)-CrO4 Layer: Synthesis, Structure, and Magnetic Studies Polymers, 2022, 14, 1735 |
| 1566930 | CIF | C27 H27 N O2 | P 1 21 1 | 9.6464; 23.7748; 10.1622 90; 112.225; 90 | 2157.46 | Wei, Wan-Xu; Kong, Xiangtao; Jiao, Rui-Qiang; Li, Xue-Song; Wang, Cui-Tian; Li, Yuke; Liang, Yong-Min Regioselective Synthesis of Spirocyclic Pyrrolines via a Palladium-Catalyzed Narasaka-Heck/C-H Activation/[4+2] Annulation Cascade Reaction Chemical Science, 2022 |
| 1566931 | CIF | C30 H30 N O2 | P 1 21/c 1 | 13.2005; 19.9331; 9.2145 90; 94.679; 90 | 2416.5 | Wei, Wan-Xu; Kong, Xiangtao; Jiao, Rui-Qiang; Li, Xue-Song; Wang, Cui-Tian; Li, Yuke; Liang, Yong-Min Regioselective Synthesis of Spirocyclic Pyrrolines via a Palladium-Catalyzed Narasaka-Heck/C-H Activation/[4+2] Annulation Cascade Reaction Chemical Science, 2022 |
| 1566932 | CIF | C48 H36 B Cu F24 | P b c a | 18.0783; 19.0664; 27.2154 90; 90; 90 | 9380.8 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566933 | CIF | C71 H75 B Cu F24 N4 P3 | P 1 21/n 1 | 14.9684; 25.1887; 19.9836 90; 95.937; 90 | 7494.1 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566934 | CIF | C41 H65 Al Cu N4 O0.5 P3 | P -1 | 11.2148; 14.0921; 14.3396 70.906; 82.68; 80.584 | 2106 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566935 | CIF | C42.5 H64 Cu Ga N4 P3 | P -1 | 11.344; 14.194; 14.285 70.274; 79.551; 82.067 | 2121.9 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566936 | CIF | C78 H120 B12 Cl12 Cu2 Ga2 N8 P6 | P -3 c 1 | 14.9147; 14.9147; 26.629 90; 90; 120 | 5130 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566937 | CIF | C78 H120 Al2 B12 Cl12 Cu2 N8 P6 | P -3 c 1 | 14.9086; 14.9086; 26.6016 90; 90; 120 | 5120.5 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566938 | CIF | C34 H58 Tm | P 1 21/c 1 | 19.4715; 18.0905; 19.5394 90; 109.702; 90 | 6479.8 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566939 | CIF | C70 H116 O2 Tm2 | P 1 21/n 1 | 18.1868; 11.4972; 31.4355 90; 93.696; 90 | 6559.4 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566940 | CIF | C71 H116 O3 Tm2 | P c a 21 | 21.251; 10.8765; 28.794 90; 90; 90 | 6655.3 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566941 | CIF | C74 H128 O3 Tm2 | P 1 2/n 1 | 18.6229; 10.3489; 19.6817 90; 111.234; 90 | 3535.7 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566942 | CIF | C74.25 H121.4 O5 Tm2 | P -1 | 10.596; 17.174; 21.404 98.599; 99.006; 106.877 | 3602.1 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566943 | CIF | C109 H177 O6 Tm3 | I 1 2/a 1 | 29.457; 16.1306; 46.333 90; 105.969; 90 | 21166 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566944 | CIF | C93 H170 O4 Si2 Tm2 | P -1 | 13.4591; 17.361; 20.0159 65.739; 85.671; 77.074 | 4155.2 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566945 | CIF | C159 H272 O12 Tm4 | P -1 | 14.9953; 17.8272; 28.3472 75.491; 82.62; 70.215 | 6895.2 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566946 | CIF | C127 H196 O12 Tm4 | P -1 | 17.9662; 18.3952; 19.483 83.851; 83.324; 75.907 | 6182 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1566947 | CIF | C15 H14 Er N9 O12.5 | P -1 | 8.9555; 9.4191; 15.4553 75.154; 77.176; 67.936 | 1156.33 | Monni, Noemi N.; Baldoví, José J.; García-López, Víctor; Oggianu, Mariangela M.; cadoni, enzo; Quochi, Francesco; Clemente Leon, Miguel; Mercuri, Maria Laura; Coronado, Eugenio Reversible Tuning of Luminescence and Magnetism in a Structurally Flexible Erbium-Anilato MOF Chemical Science, 2022 |
| 1566948 | CIF | C15 H8 Er N9 O7.5 | P -1 | 9.0051; 9.3427; 12.533 93.979; 97.759; 115.991 | 929.3 | Monni, Noemi N.; Baldoví, José J.; García-López, Víctor; Oggianu, Mariangela M.; cadoni, enzo; Quochi, Francesco; Clemente Leon, Miguel; Mercuri, Maria Laura; Coronado, Eugenio Reversible Tuning of Luminescence and Magnetism in a Structurally Flexible Erbium-Anilato MOF Chemical Science, 2022 |
| 1566949 | CIF | C15 H14 Er N9 O10 | P -1 | 8.6201; 10.422; 11.9887 80.139; 79.145; 82.373 | 1036.52 | Monni, Noemi N.; Baldoví, José J.; García-López, Víctor; Oggianu, Mariangela M.; cadoni, enzo; Quochi, Francesco; Clemente Leon, Miguel; Mercuri, Maria Laura; Coronado, Eugenio Reversible Tuning of Luminescence and Magnetism in a Structurally Flexible Erbium-Anilato MOF Chemical Science, 2022 |
| 1566950 | CIF | C15 H10 Er N9 O8 | P -1 | 9.013; 9.2; 12.495 94.9; 98.1; 115.67 | 912 | Monni, Noemi N.; Baldoví, José J.; García-López, Víctor; Oggianu, Mariangela M.; cadoni, enzo; Quochi, Francesco; Clemente Leon, Miguel; Mercuri, Maria Laura; Coronado, Eugenio Reversible Tuning of Luminescence and Magnetism in a Structurally Flexible Erbium-Anilato MOF Chemical Science, 2022 |
| 1566951 | CIF | C38 H40 N4 Zn2 | P 1 21/c 1 | 10.9337; 16.6716; 9.6093 90; 98.976; 90 | 1730.15 | Liao, Xi; Cui, Feng-Chao; He, Jiang-Hua; Ren, Wei-Min; Lu, Xiao-Bing; Zhang, Yue-Tao A sustainable approach for the synthesis of recyclable cyclic CO2-based polycarbonates Chemical Science, 2022 |
| 1566952 | CIF | C39 H34 N2 O6 S2 | P -1 | 9.9015; 11.8523; 14.5872 93.222; 99.421; 100.578 | 1653.52 | Li, Xia; Xie, Jialin; Du, Zhenglin; Jiang, Long; Li, Guangqin; Ling, Sanliang; Zhu, Kelong Docking rings in a solid: reversible assembling of pseudorotaxanes inside a zirconium metal–organic framework Chemical Science, 2022 |
| 1566953 | CIF | C249 H289 N25 O80 Zr6 | F m -3 | 38.4865; 38.4865; 38.4865 90; 90; 90 | 57006.6 | Li, Xia; Xie, Jialin; Du, Zhenglin; Jiang, Long; Li, Guangqin; Ling, Sanliang; Zhu, Kelong Docking rings in a solid: reversible assembling of pseudorotaxanes inside a zirconium metal–organic framework Chemical Science, 2022 |
| 1566954 | CIF | C8 H5 F3 N2 O6 | P 1 21/c 1 | 6.1503; 12.5829; 13.1818 90; 93.683; 90 | 1018.01 | Sandvoß, Alexander; Maag, Henning; Daniliuc, Constantin G.; Schollmeyer, Dieter; Wahl, Johannes M. Dynamic kinetic resolution of transient hemiketals: a strategy for the desymmetrisation of prochiral oxetanols Chemical Science, 2022 |
| 1566955 | CIF | C17 H12 Br F3 N2 O7 | P 21 21 21 | 10.9727; 11.795; 14.1878 90; 90; 90 | 1836.23 | Sandvoß, Alexander; Maag, Henning; Daniliuc, Constantin G.; Schollmeyer, Dieter; Wahl, Johannes M. Dynamic kinetic resolution of transient hemiketals: a strategy for the desymmetrisation of prochiral oxetanols Chemical Science, 2022 |
| 1566956 | CIF | C15 H12 F3 N O4 | P b c a | 13.5889; 9.9317; 20.9678 90; 90; 90 | 2829.83 | Sandvoß, Alexander; Maag, Henning; Daniliuc, Constantin G.; Schollmeyer, Dieter; Wahl, Johannes M. Dynamic kinetic resolution of transient hemiketals: a strategy for the desymmetrisation of prochiral oxetanols Chemical Science, 2022 |
| 1566957 | CIF | C40 H38 O10 | P 1 | 13.5907; 15.0346; 18.9632 97.644; 101.994; 104.537 | 3598 | Zhao, Gaoyuan; Mukherjee, Upasana; Zhou, Lin; Wu, Yue; Yao, Wang; Mauro, Jaclyn N.; Liu, Peng; Ngai, Ming-Yu C2-ketonylation of carbohydrates via excited-state palladium-catalyzed 1,2-spin-center shift Chemical Science, 2022 |
| 1566958 | CIF | C5 H11 B O3 | P b c n | 14.303; 13.119; 7.702 90; 90; 90 | 1445.2 | Itou, Takahiko; Kitai, Hideyuki; Shimazu, Akira; Miyazaki, Tsukasa; Tashiro, Kohji Clarification of Cross-Linkage Structure in Boric Acid Doped Poly(vinyl alcohol) and Its Model Compound As Studied by an Organized Combination of X-ray Single-Crystal Structure Analysis, Raman Spectroscopy, and Density Functional Theoretical Calculation The Journal of Physical Chemistry B, 2014, 118, 6032-6037 |
| 1566959 | CIF | C18 H8 N2 O2 | P 1 21/c 1 | 4.3819; 13.469; 10.1801 90; 97.073; 90 | 596.3 | Valentini, Cataldo; Gowland, Duncan; Bezzu, C. Grazia; Romito, Deborah; Demitri, Nicola; Bonini, Nicola; Bonifazi, Davide Customising excitation properties of polycyclic aromatic hydrocarbons by rational positional heteroatom doping: the peri-xanthenoxanthene (PXX) case Chemical Science, 2022 |
| 1566960 | CIF | C18 H12 N2 O4 | P 1 21/c 1 | 7.5646; 3.6755; 23.933 90; 95.995; 90 | 661.79 | Valentini, Cataldo; Gowland, Duncan; Bezzu, C. Grazia; Romito, Deborah; Demitri, Nicola; Bonini, Nicola; Bonifazi, Davide Customising excitation properties of polycyclic aromatic hydrocarbons by rational positional heteroatom doping: the peri-xanthenoxanthene (PXX) case Chemical Science, 2022 |
| 1566961 | CIF | C24 H8 F4 I2 N2 O2 | P -1 | 4.1848; 7.7399; 16.2513 92.097; 90.002; 99.199 | 519.25 | Valentini, Cataldo; Gowland, Duncan; Bezzu, C. Grazia; Romito, Deborah; Demitri, Nicola; Bonini, Nicola; Bonifazi, Davide Customising excitation properties of polycyclic aromatic hydrocarbons by rational positional heteroatom doping: the peri-xanthenoxanthene (PXX) case Chemical Science, 2022 |
| 1566962 | CIF | C18 H8 N2 O2 | P 1 21/n 1 | 11.589; 3.7599; 14.384 90; 112.54; 90 | 578.9 | Valentini, Cataldo; Gowland, Duncan; Bezzu, C. Grazia; Romito, Deborah; Demitri, Nicola; Bonini, Nicola; Bonifazi, Davide Customising excitation properties of polycyclic aromatic hydrocarbons by rational positional heteroatom doping: the peri-xanthenoxanthene (PXX) case Chemical Science, 2022 |
| 1566963 | CIF | C24 H8 F4 I2 N2 O2 | P -1 | 4.2046; 6.7216; 18.2394 94.632; 93.684; 99.922 | 504.5 | Valentini, Cataldo; Gowland, Duncan; Bezzu, C. Grazia; Romito, Deborah; Demitri, Nicola; Bonini, Nicola; Bonifazi, Davide Customising excitation properties of polycyclic aromatic hydrocarbons by rational positional heteroatom doping: the peri-xanthenoxanthene (PXX) case Chemical Science, 2022 |
| 1566964 | CIF | C27 H24.75 N3 O7.88 | C 1 2/c 1 | 12.826; 28.416; 27.47 90; 101.61; 90 | 9807 | Valentini, Cataldo; Gowland, Duncan; Bezzu, C. Grazia; Romito, Deborah; Demitri, Nicola; Bonini, Nicola; Bonifazi, Davide Customising excitation properties of polycyclic aromatic hydrocarbons by rational positional heteroatom doping: the peri-xanthenoxanthene (PXX) case Chemical Science, 2022 |
| 1566965 | CIF | C37 H54 N5 Nb O3 | P -1 | 10.17; 12.074; 15.7696 91.221; 90.452; 114.46 | 1761.9 | Weberg, Alexander B.; Schelter, Eric J.; Carroll, Patrick; Gau, Michael; Pandey, Pragati; Lapsheva, Ekaterina; Schatz, George C.; Cheisson, Thibault; Chaudhuri, Subhajyoti; Uruburo, Christian Tantalum, Easy as Pi: Understanding Differences in Metal-Imido Bonding Towards Improving Ta/Nb Separations Chemical Science, 2022 |
| 1566966 | CIF | C37 H54 N5 O3 Ta | P -1 | 10.178; 12.1307; 15.7705 91.362; 90.315; 114.43 | 1772.04 | Weberg, Alexander B.; Schelter, Eric J.; Carroll, Patrick; Gau, Michael; Pandey, Pragati; Lapsheva, Ekaterina; Schatz, George C.; Cheisson, Thibault; Chaudhuri, Subhajyoti; Uruburo, Christian Tantalum, Easy as Pi: Understanding Differences in Metal-Imido Bonding Towards Improving Ta/Nb Separations Chemical Science, 2022 |
| 1566967 | CIF | C38 H54 N5 O5 Ta | P 1 21 1 | 10.8852; 15.2484; 12.4719 90; 114.466; 90 | 1884.23 | Weberg, Alexander B.; Schelter, Eric J.; Carroll, Patrick; Gau, Michael; Pandey, Pragati; Lapsheva, Ekaterina; Schatz, George C.; Cheisson, Thibault; Chaudhuri, Subhajyoti; Uruburo, Christian Tantalum, Easy as Pi: Understanding Differences in Metal-Imido Bonding Towards Improving Ta/Nb Separations Chemical Science, 2022 |
| 1566968 | CIF | C42 H33 Cu2 F10 N7 O5 S2 | P -1 | 12.9678; 14.3694; 14.5813 63.797; 69.859; 65.255 | 2171.18 | Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand. Chemical science, 2022, 13, 6619-6625 |
| 1566969 | CIF | C38 H24 B Cu2 F8 N7 O6 S2 | P 1 21/n 1 | 13.3106; 22.6847; 15.3728 90; 107.618; 90 | 4424.05 | Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand. Chemical science, 2022, 13, 6619-6625 |
| 1566970 | CIF | C78 H69 B2 Cu4 F16 N14 O12.5 S4 | P 1 21/n 1 | 12.4859; 32.2974; 21.2406 90; 90.543; 90 | 8565.14 | Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand. Chemical science, 2022, 13, 6619-6625 |
| 1566971 | CIF | C20 H10 F2 N2 O2 | P 1 21/c 1 | 13.6961; 3.76836; 28.7891 90; 105.163; 90 | 1434.1 | Schlesinger, Carina; Fitterer, Arnd; Buchsbaum, Christian; Habermehl, Stefan; Chierotti, Michele R.; Nervi, Carlo; Schmidt, Martin U. Ambiguous structure determination from powder data: four different structural models of 4,11-difluoroquinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D IUCrJ, 2022, 9 |
| 1566972 | CIF | C20 H10 F2 N2 O2 | P 1 21/c 1 | 14.2172; 3.76778; 13.7038 90; 102.504; 90 | 716.66 | Schlesinger, Carina; Fitterer, Arnd; Buchsbaum, Christian; Habermehl, Stefan; Chierotti, Michele R.; Nervi, Carlo; Schmidt, Martin U. Ambiguous structure determination from powder data: four different structural models of 4,11-difluoroquinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D IUCrJ, 2022, 9 |
| 1566973 | CIF | C20 H10 F2 N2 O2 | P -1 | 3.8854; 7.0333; 14.1014 102.713; 86.084; 105.939 | 361.44 | Schlesinger, Carina; Fitterer, Arnd; Buchsbaum, Christian; Habermehl, Stefan; Chierotti, Michele R.; Nervi, Carlo; Schmidt, Martin U. Ambiguous structure determination from powder data: four different structural models of 4,11-difluoroquinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D IUCrJ, 2022, 9 |
| 1566974 | CIF | C20 H10 F2 N2 O2 | P 1 21/c 1 | 14.3352; 3.77265; 27.374 90; 103.686; 90 | 1438.4 | Schlesinger, Carina; Fitterer, Arnd; Buchsbaum, Christian; Habermehl, Stefan; Chierotti, Michele R.; Nervi, Carlo; Schmidt, Martin U. Ambiguous structure determination from powder data: four different structural models of 4,11-difluoroquinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D IUCrJ, 2022, 9 |
| 1566975 | CIF | C20 H10 F2 N2 O2 | P 1 21/c 1 | 14.166; 3.758; 13.762 90; 103.09; 90 | 713.6 | Schlesinger, Carina; Fitterer, Arnd; Buchsbaum, Christian; Habermehl, Stefan; Chierotti, Michele R.; Nervi, Carlo; Schmidt, Martin U. Ambiguous structure determination from powder data: four different structural models of 4,11-difluoroquinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D IUCrJ, 2022, 9 |
| 1566976 | CIF | C101 H175 As8 K3 N10 Nb O18 Zn4 | P 1 21/n 1 | 16.9909; 33.0617; 22.675 90; 104.519; 90 | 12330.9 | Zhang, Wei-Qiang; Morgan, Harry W. T.; McGrady, John E.; Sun, Zhong-Ming Synthesis and characterisation of the ternary intermetalloid clusters {M@[As<sub>8</sub>(ZnMes)<sub>4</sub>]}<sup>3-</sup> (M = Nb, Ta) from binary [M@As<sub>8</sub>]<sup>3-</sup> precursors. Chemical science, 2022, 13, 6744-6748 |
| 1566977 | CIF | C92 H160 As8 K3 N8 O18 Ta Zn4 | P 1 21/n 1 | 17.0926; 32.8161; 22.5199 90; 104.29; 90 | 12240.8 | Zhang, Wei-Qiang; Morgan, Harry W. T.; McGrady, John E.; Sun, Zhong-Ming Synthesis and characterisation of the ternary intermetalloid clusters {M@[As<sub>8</sub>(ZnMes)<sub>4</sub>]}<sup>3-</sup> (M = Nb, Ta) from binary [M@As<sub>8</sub>]<sup>3-</sup> precursors. Chemical science, 2022, 13, 6744-6748 |
| 1566978 | CIF | C71 H92 Cr Mg2 N4 O6 | P n a 21 | 35.2188; 15.3914; 12.77462 90; 90; 90 | 6924.7 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566979 | CIF | C71 H92 Mg2 N4 O6 W | P n a 21 | 35.3464; 15.4039; 12.869 90; 90; 90 | 7006.8 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566980 | CIF | C67 H91 Mg2 Mn N4 O3 | P 1 21/c 1 | 15.2588; 12.9668; 35.832 90; 97.903; 90 | 7022.3 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566981 | CIF | C79 H120 Mg2 N4 O2 Rh | P 1 21/n 1 | 14.0176; 13.9077; 40.2691 90; 99.749; 90 | 7737.2 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566982 | CIF | C104 H154 Cr Mg3 N6 O5 | P 1 21/c 1 | 19.433; 17.40489; 30.8931 90; 96.4115; 90 | 10383.6 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566983 | CIF | C79 H120 Ir Mg2 N4 O2 | P 1 21/n 1 | 14.0273; 13.9062; 40.2048 90; 99.779; 90 | 7728.7 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566984 | CIF | C67 H90 Cr Mg2 N4 O3 | P 1 21/c 1 | 15.3628; 12.9497; 35.885 90; 99.436; 90 | 7042.5 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566985 | CIF | C77 H100 Fe Mg2 N4 O5 | P -1 | 13.3957; 13.4353; 22.6744 99.136; 97.078; 112.627 | 3642.1 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566986 | CIF | C84 H115 Co Mg2 N4 O2 | P 1 21/c 1 | 13.9878; 13.5935; 41.687 90; 92.375; 90 | 7919.7 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566987 | CIF | C12 H48 As8 N12 Ni2 O26 V6 | I 41/a c d :2 | 20.3058; 20.3058; 24.3847 90; 90; 90 | 10054.4 | Kondinski, Aleksandar; Rasmussen, Maren; Mangelsen, Sebastian; Pienack, Nicole; Simjanoski, Viktor; Näther, Christian; Stares, Daniel L.; Schalley, Christoph A.; Bensch, Wolfgang Composition-driven archetype dynamics in polyoxovanadates Chemical Science, 2022 |
| 1566988 | CIF | C12 As8 N12 Ni2 O45 V12 | P 1 21/n 1 | 23.1578; 11.9216; 11.7372 90; 95.2333; 90 | 3226.88 | Kondinski, Aleksandar; Rasmussen, Maren; Mangelsen, Sebastian; Pienack, Nicole; Simjanoski, Viktor; Näther, Christian; Stares, Daniel L.; Schalley, Christoph A.; Bensch, Wolfgang Composition-driven archetype dynamics in polyoxovanadates Chemical Science, 2022 |
| 1566989 | CIF | C15.23 H28.13 Cu1.07 N4.3 | P b c n | 11.819; 12.632; 10.1183 90; 90; 90 | 1510.6 | Amdur, Moses J.; Mullin, Kathleen; Waters, Michael; Puggioni, Danilo; Wojnar, Michael; Gu, Mingqiang; Sun, Lei; Oyala, Paul; Rondinelli, James; Freedman, Danna Chemical Control of Spin-Lattice Relaxation to Create a Room Temperature Molecular Qubit Chemical Science, 2022 |
| 1566990 | CIF | C14 H26 N4 Zn | P b c n | 12.064; 11.9661; 10.878 90; 90; 90 | 1570.34 | Amdur, Moses J.; Mullin, Kathleen; Waters, Michael; Puggioni, Danilo; Wojnar, Michael; Gu, Mingqiang; Sun, Lei; Oyala, Paul; Rondinelli, James; Freedman, Danna Chemical Control of Spin-Lattice Relaxation to Create a Room Temperature Molecular Qubit Chemical Science, 2022 |
| 1566991 | CIF | C12 H19 N2 Ni O2.5 | C 1 2/c 1 | 22.1206; 8.3405; 17.7408 90; 128.032; 90 | 2578.1 | Amdur, Moses J.; Mullin, Kathleen; Waters, Michael; Puggioni, Danilo; Wojnar, Michael; Gu, Mingqiang; Sun, Lei; Oyala, Paul; Rondinelli, James; Freedman, Danna Chemical Control of Spin-Lattice Relaxation to Create a Room Temperature Molecular Qubit Chemical Science, 2022 |
| 1566992 | CIF | C12 H18.13 Cu N2 O2.07 | C 1 2/c 1 | 34.5296; 7.5713; 19.7903 90; 107.444; 90 | 4935.9 | Amdur, Moses J.; Mullin, Kathleen; Waters, Michael; Puggioni, Danilo; Wojnar, Michael; Gu, Mingqiang; Sun, Lei; Oyala, Paul; Rondinelli, James; Freedman, Danna Chemical Control of Spin-Lattice Relaxation to Create a Room Temperature Molecular Qubit Chemical Science, 2022 |
| 1566993 | CIF | C19 H14 B Cu F4 N2 O5 | P 1 21/n 1 | 6.6391; 33.5424; 11.4021 90; 106.155; 90 | 2438.9 | Kochetygov, Ilia; Justin, Anita; Asgari, Mehrdad; Yang, Shuliang; Karve, Vikram; Schertenleib, Till; Stoian, Dragos; Oveisi, Emad; Mensi, Mounir; Queen, Wendy L. 3D vs. turbostratic: controlling metal–organic framework dimensionality via N-heterocyclic carbene chemistry Chemical Science, 2022 |
| 1566994 | CIF | C17 H13 B Cu F4 N2 O4 | P 1 21/c 1 | 14.932; 31.562; 14.861 90; 98.45; 90 | 6928 | Kochetygov, Ilia; Justin, Anita; Asgari, Mehrdad; Yang, Shuliang; Karve, Vikram; Schertenleib, Till; Stoian, Dragos; Oveisi, Emad; Mensi, Mounir; Queen, Wendy L. 3D vs. turbostratic: controlling metal–organic framework dimensionality via N-heterocyclic carbene chemistry Chemical Science, 2022 |
| 1566995 | CIF | C22 H27 N O5 | P -1 | 7.4056; 9.453; 15.293 84.544; 81.654; 83.321 | 1048.73 | Martynova, Ekaterina A.; Voloshkin, Vladislav; Guillet, Sébastien; Bru, Francis; Belis, Marek; Van Hecke, Kristof; Cazin, Catherine; Nolan, Steven P. Energy transfer (EnT) photocatalysis enabled by Gold-N-heterocyclic carbene (NHC) complexes Chemical Science, 2022 |
| 1566996 | CIF | C15 H15 N O S | P 1 21/n 1 | 15.7788; 5.6659; 16.0675 90; 116.848; 90 | 1281.6 | Li, Zi-Qi; He, Wen-Ji; Ni, Hui-Qi; Engle, Keary M. Directed, nickel-catalyzed 1,2-alkylsulfenylation of alkenyl carbonyl compounds. Chemical science, 2022, 13, 6567-6572 |
| 1566997 | CIF | C23 H26 N2 O S | P 1 n 1 | 7.7413; 10.5757; 25.507 90; 98.727; 90 | 2064.1 | Li, Zi-Qi; He, Wen-Ji; Ni, Hui-Qi; Engle, Keary M. Directed, nickel-catalyzed 1,2-alkylsulfenylation of alkenyl carbonyl compounds. Chemical science, 2022, 13, 6567-6572 |
| 1566998 | CIF | C47 H28 B Cl F24 | P -1 | 12.4688; 12.8052; 15.4127 79.663; 83.931; 69.083 | 2259.1 | Karandikar, Shubhendu S.; Bhattacharjee, Avik; Metze, Bryan E.; Javaly, Nicole; Valente, Edward J.; McCormick, Theresa M.; Stuart, David R. Orbital analysis of bonding in diarylhalonium salts and relevance to periodic trends in structure and reactivity. Chemical science, 2022, 13, 6532-6540 |
| 1566999 | CIF | C47 H28 B Br F24 | P -1 | 12.4957; 12.7882; 15.4855 79.453; 83.941; 69.043 | 2269.6 | Karandikar, Shubhendu S.; Bhattacharjee, Avik; Metze, Bryan E.; Javaly, Nicole; Valente, Edward J.; McCormick, Theresa M.; Stuart, David R. Orbital analysis of bonding in diarylhalonium salts and relevance to periodic trends in structure and reactivity. Chemical science, 2022, 13, 6532-6540 |
| 1567000 | CIF | C47 H28 B F24 I | P -1 | 12.5291; 12.8808; 15.7078 79.342; 83.823; 68.734 | 2319.4 | Karandikar, Shubhendu S.; Bhattacharjee, Avik; Metze, Bryan E.; Javaly, Nicole; Valente, Edward J.; McCormick, Theresa M.; Stuart, David R. Orbital analysis of bonding in diarylhalonium salts and relevance to periodic trends in structure and reactivity. Chemical science, 2022, 13, 6532-6540 |
| 1567001 | CIF | C3 H4 K Li O5 | P n a 21 | 8.5885; 7.5236; 9.3685 90; 90; 90 | 605.36 | Cao, Liling; Tian, Haotian; Lin, Donghong; Lin, Chensheng; Xu, Feng; Han, Yinglei; Yan, Tao; Chen, Jindong; Li, Bing-Xuan; Ye, Ning; Luo, Min Flexible Functional Module Regulate Ultraviolet Optical Nonlinearity Achieving a Balance between Second-harmonic Generation Response and Birefringence Chemical Science, 2022 |
| 1567002 | CIF | C13 H18 B Cu F4 N4 | P -1 | 7.9267; 10.4752; 10.6827 107.079; 100.319; 102.013 | 801.49 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567003 | CIF | C31 H22 B Cu F18 N6 | P 1 21/m 1 | 11.064; 13.6074; 11.4278 90; 91.989; 90 | 1719.44 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567004 | CIF | C22 H16 Ag B F6 N4 | P 1 21/n 1 | 14.6979; 10.2199; 15.7068 90; 105.812; 90 | 2270.06 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567005 | CIF | C22 H16 B Cu F6 N4 | P -1 | 10.1272; 10.3873; 12.0427 75.542; 65.639; 76.936 | 1106.56 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567006 | CIF | C13 H18 Ag F6 N4 Sb | P 1 21/n 1 | 11.724; 12.2179; 12.8999 90; 93.091; 90 | 1845.13 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567007 | CIF | C156 H144 Cl6 N12 O6 | P 1 21 1 | 13.9655; 39.9035; 15.4673 90; 100.516; 90 | 8474.7 | Jiang, Jianzhuang; Liu, Chao; Jin, Yucheng; Qi, Dongdong; Ding, Xu; Ren, Huimin; Wang, Hailong Enantioselective Assembly and Recognition of Heterochiral Porous Organic Cages Deduced from Binary Chiral Components Chemical Science, 2022 |
| 1567008 | CIF | C156 H144 Cl6 N12 O6 | P 1 21 1 | 14.1106; 40.2961; 15.5297 90; 101.091; 90 | 8665.3 | Jiang, Jianzhuang; Liu, Chao; Jin, Yucheng; Qi, Dongdong; Ding, Xu; Ren, Huimin; Wang, Hailong Enantioselective Assembly and Recognition of Heterochiral Porous Organic Cages Deduced from Binary Chiral Components Chemical Science, 2022 |
| 1567009 | CIF HKL Paper | C21 H18 Br2 N4 | F d d 2 | 18.0776; 48.2301; 4.5424 90; 90; 90 | 3960.45 | Schuster, Sara A.; Nesterov, Volodymyr V.; Smucker, Bradley W. 1,1'-Methylenebis(4,4'-bipyridin-1-ium) dibromide IUCrData, 2022, 7, x220526 |
| 1567010 | CIF HKL Paper | C25 H26 Br2 N4 O2 | P n m a | 15.4863; 22.2936; 7.21 90; 90; 90 | 2489.22 | Neal, Henry C.; Nesterov, Volodymyr V.; Smucker, Bradley W. 1,1'-Methylenebis{4-[(<i>E</i>)-2-(pyridin-4-yl)ethenyl]pyridinium} dibromide dihydrate IUCrData, 2022, 7, x220525 |
| 1567011 | CIF HKL Paper | C19 H21 I O6 S | P 1 21/c 1 | 6.1823; 24.9509; 12.7606 90; 100.257; 90 | 1936.92 | Smith, Timothy J.; Koser, Gerald; Chen, Yi; Zeller, Matthias; Iacino, Rocco; Selzer, Nichole (Phenyliodosyl)benzene tosylate dihydrate IUCrData, 2022, 7, x220522 |
| 1567012 | CIF | C72 H108 Br2 I2 N36 O36 | P 1 21/n 1 | 14.3431; 16.633; 20.226 90; 97.151; 90 | 4787.8 | Liu, Fengbo; Yang, Hai; Sun, Dongdong; Gao, Fang; Zhang, Xiongzhi; Zhao, Zhiyong; Han, Xie; Liu, Simin Red aqueous room-temperature phosphorescence modulated by anion–π and intermolecular electronic coupling interactions Chemical Science, 2022, 13, 7247-7255 |
| 1567013 | CIF | C24 H40 Br2 Cl2 N4 O10 | P -1 | 6.6366; 6.8219; 19.554 82.484; 87.519; 68.781 | 818.2 | Liu, Fengbo; Yang, Hai; Sun, Dongdong; Gao, Fang; Zhang, Xiongzhi; Zhao, Zhiyong; Han, Xie; Liu, Simin Red aqueous room-temperature phosphorescence modulated by anion–π and intermolecular electronic coupling interactions Chemical Science, 2022, 13, 7247-7255 |
| 1567014 | CIF | C12 H10 Cl2 N6 Zn | P 1 21/n 1 | 7.5599; 13.9242; 13.8315 90; 92.303; 90 | 1454.8 | Zhou, Bo; Yan, Dongpeng Color-tunable persistent luminescence in 1D zinc–organic halide microcrystals for single-component white light and temperature-gating optical waveguides Chemical Science, 2022 |
| 1567015 | CIF | C12 H10 Br2 N6 Zn | P 1 21/n 1 | 7.8171; 14.4787; 13.5772 90; 94.249; 90 | 1532.46 | Zhou, Bo; Yan, Dongpeng Color-tunable persistent luminescence in 1D zinc–organic halide microcrystals for single-component white light and temperature-gating optical waveguides Chemical Science, 2022 |
| 1567016 | CIF | C16 H15 Cl2 N4 Zn | P -1 | 7.5306; 8.4502; 14.2634 106.449; 92.468; 101.093 | 849.64 | Zhou, Bo; Yan, Dongpeng Color-tunable persistent luminescence in 1D zinc–organic halide microcrystals for single-component white light and temperature-gating optical waveguides Chemical Science, 2022 |
| 1567017 | CIF | C17 H22 N4 S | P -1 | 5.6168; 8.175; 39.0525 87.102; 88.922; 73.34 | 1715.7 | Shangguan, Zhichun; Sun, Wenjin; Zhang, Zhao-Yang; Fang, Dong; Wang, Zhihang; Wu, Si; Deng, Chao; Huang, Xianhui; He, Yixin; Wang, Ruzhu; Li, Tingxian; Moth-Poulsen, Kasper; Li, Tao A rechargeable molecular solar thermal system below 0 °C Chemical Science, 2022 |
| 1567018 | CIF | C11 H12 N4 S | P 1 21/c 1 | 10.1876; 9.2946; 12.4426 90; 104.262; 90 | 1141.9 | Shangguan, Zhichun; Sun, Wenjin; Zhang, Zhao-Yang; Fang, Dong; Wang, Zhihang; Wu, Si; Deng, Chao; Huang, Xianhui; He, Yixin; Wang, Ruzhu; Li, Tingxian; Moth-Poulsen, Kasper; Li, Tao A rechargeable molecular solar thermal system below 0 °C Chemical Science, 2022 |
| 1567019 | CIF | C12 H13 F2 N O | P 21 21 21 | 7.32492; 7.77679; 18.6427 90; 90; 90 | 1061.97 | Noten, Efrey A.; McAtee, Rory C.; Stephenson, Corey R. J. Catalytic intramolecular aminoarylation of unactivated alkenes with aryl sulfonamides Chemical Science, 2022 |
| 1567020 | CIF | C36 H22 Br3 N10 | P -1 | 7.2378; 7.7475; 17.8746 83.578; 83.241; 67.104 | 914.53 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567021 | CIF | C31 H10 N9 | P 1 21/c 1 | 13.2712; 12.5807; 7.7388 90; 90.466; 90 | 1292.03 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567022 | CIF | C31 H10 N9 | P 1 21/c 1 | 13.3766; 12.8023; 7.7861 90; 90.396; 90 | 1333.35 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567023 | CIF | C30 H15 I N9 | P 1 | 7.168; 7.6291; 13.6797 78.422; 83.441; 69.68 | 686.44 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567024 | CIF | C31 H16 Br2 N9 | P -1 | 8.0361; 13.0398; 14.2071 92.624; 98.576; 104.767 | 1418 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567025 | CIF | C31 H17 N9 | P 1 21/c 1 | 13.0864; 25.3377; 7.8403 90; 92.651; 90 | 2596.9 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567026 | CIF | C48 H26 N14 | P -1 | 7.8212; 9.7542; 13.2653 78.103; 75.829; 82.246 | 956.32 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567027 | CIF | C36 H22 Br2 I N10 | P -1 | 7.5693; 13.03; 18.5239 105.159; 90.971; 98.382 | 1741.66 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567028 | CIF | C30 H14 Br2 N9 | P -1 | 6.6911; 7.8201; 27.6491 97.673; 90.168; 108.973 | 1354.23 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567029 | CIF | C30 H16 N9 | P -1 | 7.7274; 13.1422; 13.3145 99.902; 106.251; 97.225 | 1256.99 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567030 | CIF | C29 H8 N9 | P -1 | 7.2867; 7.7545; 13.1305 92.616; 103.414; 113.979 | 651.19 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567031 | CIF | C36 H16 N10 | P -1 | 7.1249; 7.6572; 14.4249 89.017; 83.589; 68.34 | 726.6 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567032 | CIF | C36 H16 N10 | P -1 | 7.2179; 7.6887; 14.5445 89.176; 82.57; 69.284 | 748.2 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567033 | CIF | C15 H9 N5 | P -1 | 7.0634; 7.8154; 13.468 73.628; 89.55; 67.258 | 653.56 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567034 | CIF | C15 H9 N5 | P -1 | 7.1924; 7.8489; 13.617 106.174; 90.739; 112.525 | 675.74 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567035 | CIF | C37 H20 N9 O | P -1 | 9.1474; 11.3666; 15.9321 106.234; 91.277; 99.804 | 1562.98 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567036 | CIF | C16 H8 N5 | P -1 | 7.5381; 8.013; 13.3368 103.618; 90.811; 115.727 | 699.07 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567037 | CIF | C30 H15 I N9 | P 1 | 7.0735; 7.8171; 13.8419 74.353; 88.928; 67.934 | 680.1 | Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals IUCrJ, 2022, 9 |
| 1567038 | CIF | C29 H22 Cl N O | P 1 21/n 1 | 16.7731; 7.1332; 19.2367 90; 104.828; 90 | 2224.95 | Sun, Lincong; Zhao, Yuyao; Liu, Bingxian; Chang, Junbiao; Li, Xingwei RhodiumIII-catalyzed remote difunctionalization of arenes assisted by a relay directing group Chemical Science, 2022, 13, 7347-7354 |
| 1567039 | CIF | C25 H29 Cl N O Rh | P 1 21/c 1 | 18.7457; 7.7279; 31.217 90; 93.528; 90 | 4513.68 | Sun, Lincong; Zhao, Yuyao; Liu, Bingxian; Chang, Junbiao; Li, Xingwei RhodiumIII-catalyzed remote difunctionalization of arenes assisted by a relay directing group Chemical Science, 2022, 13, 7347-7354 |
| 1567040 | CIF | C37 H38 N2 O4 S | P 1 21/c 1 | 9.018; 20.697; 17.164 90; 98.38; 90 | 3169 | Jiang, Kun; Li, Shi-Jun; Liu, Qing-Peng; Yu, Ning; Li, Yu-Lin; Zhou, Yu-Qiang; He, Kui-Cheng; Lin, Jing; Zheng, Ting-Yu; Lang, Jian; Lan, Yu; Wei, Ye Iminyl radical-triggered relay annulation for the construction of bridged aza-tetracycles bearing four contiguous stereogenic centers Chemical Science, 2022, 13, 7283-7288 |
| 1567041 | CIF | C19.36 H13.07 Br0.64 N O | P 1 21/n 1 | 11.5265; 10.1543; 12.3229 90; 95.063; 90 | 1436.69 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567042 | CIF | C19.47 H13.41 Br0.53 N O | P 1 21/n 1 | 11.5657; 10.1316; 12.3187 90; 95.031; 90 | 1437.93 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567043 | CIF | C19.44 H13.32 Br0.56 N O | P 1 21/n 1 | 11.568; 10.1429; 12.3305 90; 95.097; 90 | 1441.05 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567044 | CIF | C19.56 H13.67 Br0.44 N O | P 1 21/n 1 | 11.585; 10.11; 12.3005 90; 94.882; 90 | 1435.46 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567045 | CIF | C19.81 H14.44 Br0.19 N O | P 1 21/n 1 | 11.603; 10.0711; 12.3038 90; 94.846; 90 | 1432.62 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567046 | CIF | C19.91 H14.74 Br0.09 N O | P 1 21/n 1 | 11.6141; 10.0515; 12.2961 90; 94.745; 90 | 1430.52 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567047 | CIF | C19.71 H14.14 Br0.29 N O | P 1 21/n 1 | 11.5964; 10.0911; 12.308 90; 94.854; 90 | 1435.1 | Xu, Zhen; Hean, Duane; Yuan, Jennifer; Wolf, Michael O. Control of photoluminescence quantum yield and long-lived triplet emission lifetime in organic alloys Chemical Science, 2022 |
| 1567048 | CIF | C53 H37 N11 O4 | P 1 | 10.1334; 10.2002; 11.4807 93.3946; 99.9779; 107.948 | 1103.79 | Gorai, Tumpa; Lovitt, June I.; Umadevi, Deivasigamani; McManus, Gavin; Gunnlaugsson, Thorfinnur Hierarchical supramolecular co-assembly formation employing multi-component light-harvesting charge transfer interactions giving rise to long-wavelength emitting luminescent microspheres. Chemical science, 2022, 13, 7805-7813 |
| 1567049 | CIF | C37.75 H43.75 Cl5.25 N6 O6 | P 1 | 12.733; 13.433; 14.738 63.059; 71.223; 73.702 | 2100.3 | Al Kelabi, Dana; Dey, Avishek; Alimi, Lukman O.; Piwoński, Hubert; Habuchi, Satoshi; Khashab, Niveen M. Photostable polymorphic organic cages for targeted live cell imaging Chemical Science, 2022, 13, 7341-7346 |
| 1567050 | CIF | C15 H21 B11 | P 1 21 1 | 6.7358; 11.9489; 11.5149 90; 103.165; 90 | 902.42 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567051 | CIF | C21 H30 B11 O | P -1 | 7.8822; 11.7078; 13.388 105.252; 90.534; 92.608 | 1190.45 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567052 | CIF | C25 H25 B Br N | P -1 | 9.2177; 10.2602; 13.2793 107.932; 90.235; 114.595 | 1073.71 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567053 | CIF | C28 H37 B11 N2 | P 1 21/c 1 | 13.6036; 13.3357; 16.4811 90; 96.337; 90 | 2971.63 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567054 | CIF | C23 H28 B11 Br | P 21 21 21 | 8.9395; 9.8238; 29.8355 90; 90; 90 | 2620.15 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567055 | CIF | C24 H36 B11 | P 1 21/n 1 | 12.6143; 21.4357; 13.0722 90; 116.555; 90 | 3161.79 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567056 | CIF | C19 H29 B11 O | P 42/n :2 | 27.0865; 27.0865; 12.6873 90; 90; 90 | 9308.4 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567057 | CIF | C28 H33 B Br N2 | C 1 2/c 1 | 39.182; 9.7414; 13.0827 90; 93.923; 90 | 4981.8 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567058 | CIF | C23 H29 B Br N | P -1 | 9.1163; 9.2445; 14.8961 92.922; 107.409; 114.918 | 1063.39 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567059 | CIF | C28 H37 B11 Br N | P -1 | 9.6639; 9.8598; 17.3492 84.8; 80.733; 68.625 | 1518.39 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567060 | CIF | C23 H29 B11 | P 1 21/c 1 | 15.9256; 12.1813; 24.8883 90; 97.611; 90 | 4785.66 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567061 | CIF | C32 H38 B11 N | P 1 21 1 | 12.3347; 21.712; 13.3034 90; 115.859; 90 | 3206.05 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567062 | CIF | C26 H42 B11 N | P -1 | 15.8288; 16.0876; 21.5724 94.138; 92.684; 106.677 | 5235.45 | Bischof, Tobias; Guo, Xueying; Krummenacher, Ivo; Beßler, Lukas; Lin, Zhenyang; Finze, Maik; Braunschweig, Holger Alkene insertion reactivity of a o-carboranyl-substituted 9-borafluorene Chemical Science, 2022 |
| 1567063 | CIF | C192 H242 Cl2 Cu18 P4 S12 | P 1 21/c 1 | 19.2184; 47.4362; 24.0097 90; 100.521; 90 | 21520.4 | Mandal, Sukhendu; Das, Anish Kumar; Biswas, Sourav; Wani, Vaibhav Shridhar; Nair, Akhil S.; Pathak, Biswarup [Cu18H3(S-Adm)12(PPh3)4Cl2]: Fusion of Platonic and Johnson Solids Through Cu(0) Center and Its Photophysical Properties Chemical Science, 2022 |
| 1567064 | CIF | C70 H89 N O12 | F d d d :2 | 12.556; 26.6378; 45.7727 90; 90; 90 | 15309.3 | Cao, Jiajun; Wu, Yitao; Li, Qi; Zhu, Weijie; Wang, Zeju; Liu, Yang; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Separation of pyrrolidine from tetrahydrofuran by pillar[6]arene-based nonporous adaptive crystals Chemical Science, 2022 |
| 1567065 | CIF | C70 H92 O13 | P 1 2/n 1 | 12.5731; 22.6648; 14.4358 90; 113.995; 90 | 3758.2 | Cao, Jiajun; Wu, Yitao; Li, Qi; Zhu, Weijie; Wang, Zeju; Liu, Yang; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Separation of pyrrolidine from tetrahydrofuran by pillar[6]arene-based nonporous adaptive crystals Chemical Science, 2022 |
| 1567066 | CIF | C61 H83.5 N1.5 O10 | P -1 | 14.9616; 16.3732; 24.4025 109.598; 98.054; 90 | 5568.9 | Cao, Jiajun; Wu, Yitao; Li, Qi; Zhu, Weijie; Wang, Zeju; Liu, Yang; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Separation of pyrrolidine from tetrahydrofuran by pillar[6]arene-based nonporous adaptive crystals Chemical Science, 2022 |
| 1567067 | CIF | C20 H34 Br2 S2 Si6 | C 1 2/c 1 | 22.243; 8.33206; 18.2305 90; 113.89; 90 | 3089.19 | Jiang, Qifeng; Gittens, Alexandra; Wong, Sydnee; Siegler, Maxime A.; Klausen, Rebekka S. Highly Selective Addition of Cyclosilanes to Alkynes Enabling New Conjugated Materials Chemical Science, 2022 |
| 1567068 | CIF | C26 H44 O2 Si6 | P 1 21/c 1 | 10.3662; 11.2796; 14.0764 90; 91.466; 90 | 1645.37 | Jiang, Qifeng; Gittens, Alexandra; Wong, Sydnee; Siegler, Maxime A.; Klausen, Rebekka S. Highly Selective Addition of Cyclosilanes to Alkynes Enabling New Conjugated Materials Chemical Science, 2022 |
| 1567069 | CIF | C24 H40 Si6 | P 1 21/c 1 | 36.335; 6.64881; 18.7594 90; 95.565; 90 | 4510.62 | Jiang, Qifeng; Gittens, Alexandra; Wong, Sydnee; Siegler, Maxime A.; Klausen, Rebekka S. Highly Selective Addition of Cyclosilanes to Alkynes Enabling New Conjugated Materials Chemical Science, 2022 |
| 1567070 | CIF | C30 H58 Si10 | P -1 | 8.8909; 13.8639; 37.001 86.116; 83.625; 81.6 | 4477.9 | Jiang, Qifeng; Gittens, Alexandra; Wong, Sydnee; Siegler, Maxime A.; Klausen, Rebekka S. Highly Selective Addition of Cyclosilanes to Alkynes Enabling New Conjugated Materials Chemical Science, 2022 |
| 1567071 | CIF | C17 H15 N O2 | P 1 21 1 | 9.65133; 11.74209; 25.3227 90; 90.6825; 90 | 2869.54 | Liu, Teng; Ni, Shaofei; Guo, Wusheng Practical asymmetric amine nucleophilic approach for the modular construction of protected α-quaternary amino acids Chemical Science, 2022 |
| 1567072 | CIF | C18 H17 N5 O5 | P 1 21 1 | 7.1241; 34.022; 7.3539 90; 90.288; 90 | 1782.4 | Zhang, Dequan; Wen, Jialin; Zhang, Xumu Construction of a quaternary stereogenic center by asymmetric hydroformylation: a straightforward method to prepare chiral α-quaternary amino acids Chemical Science, 2022, 13, 7215-7223 |
| 1567073 | CIF | C48 H45 Cl N2 Pd | P 21 21 21 | 11.191; 18.5238; 21.495 90; 90; 90 | 4455.9 | Lu, Zhou; Liao, Yudan; Fan, Weigang; Dai, Shengyu Efficient suppression of the chain transfer reaction in ethylene coordination polymerization with dibenzosuberyl substituents Polymer Chemistry, 2022, 13, 4090-4099 |
| 1567074 | CIF | C32 H30 Br2 Cl2 N2 O6 Pd2 | P 1 21/c 1 | 13.9156; 3.92009; 30.0833 90; 102.038; 90 | 1604.97 | Bermúdez-Puente, Brais; Adrio, Luis A.; Lucio-Martínez, Fátima; Reigosa, Francisco; Ortigueira, Juan M.; Vila, José M. Imine Palladacycles: Synthesis, Structural Analysis and Application in Suzuki–Miyaura Cross Coupling in Semi-Aqueous Media Molecules, 2022, 27, 3146 |
| 1567075 | CIF | C24 H21 Cl N4 O2 | P -1 | 8.7215; 10.1275; 12.8202 101.771; 103.693; 90.843 | 1074.68 | Govdi, Anastasia I.; Tokareva, Polina V.; Rumyantsev, Andrey M.; Panov, Maxim S.; Stellmacher, Johannes; Alexiev, Ulrike; Danilkina, Natalia A.; Balova, Irina A. 4,5-Bis(arylethynyl)-1,2,3-triazoles-A New Class of Fluorescent Labels: Synthesis and Applications. Molecules (Basel, Switzerland), 2022, 27, 3191 |
| 1567076 | CIF | C111 H127 N11 O4 | P -1 | 14.7293; 18.9653; 22.0241 66.815; 72.348; 74.252 | 5307.4 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567077 | CIF | C109 H121 B4 F8 N11 O5 | P 21 21 21 | 17.2251; 23.1997; 28.8441 90; 90; 90 | 11526.6 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567078 | CIF | C111 H129 B2 Cl4 F4 N11 O5 | P b c n | 38.9356; 18.8132; 29.4619 90; 90; 90 | 21580.9 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567079 | CIF | C104 H104 B3 F6 N11 | P -1 | 12.9759; 17.3; 23.1532 82.59; 81.602; 76.517 | 4975.7 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567080 | CIF | C38 H60 B2 N4 O4 | P 1 21/n 1 | 8.465; 16.1068; 13.6527 90; 95.327; 90 | 1853.43 | Kuehn, Laura; Zapf, Ludwig; Werner, Luis; Stang, Martin; Würtemberger-Pietsch, Sabrina; Krummenacher, Ivo; Braunschweig, Holger; Lacôte, Emmanuel; Marder, Todd B.; Radius, Udo NHC induced radical formation <i>via</i> homolytic cleavage of B-B bonds and its role in organic reactions. Chemical science, 2022, 13, 8321-8333 |
| 1567081 | CIF | C20 H36 B I N4 O2 | P 1 2/c 1 | 13.3858; 14.2988; 13.1709 90; 109.65; 90 | 2374.11 | Kuehn, Laura; Zapf, Ludwig; Werner, Luis; Stang, Martin; Würtemberger-Pietsch, Sabrina; Krummenacher, Ivo; Braunschweig, Holger; Lacôte, Emmanuel; Marder, Todd B.; Radius, Udo NHC induced radical formation <i>via</i> homolytic cleavage of B-B bonds and its role in organic reactions. Chemical science, 2022, 13, 8321-8333 |
| 1567082 | CIF HKL Paper | C17 H20 N2 O4 | C 1 2/c 1 | 23.0488; 8.1149; 18.3223 90; 104.454; 90 | 3318.5 | Zaoui, Younes; Assila, Hamza; Mague, Joel T.; Alsubari, Abdulsalam; Taoufik, Jamal; Ramli, Youssef; Ansar, Mhammed Ethyl 2-[4-(4-methoxybenzyl)-3-methyl-6-oxopyridazin-1-yl]acetate IUCrData, 2022, 7, x220582 |
| 1567083 | CIF HKL Paper | C7 H7 Br2 N | P 21 21 21 | 4.3773; 13.585; 14.057 90; 90; 90 | 835.9 | Brihi, Ouarda; Medjani, Meriem; Bougueria, Hassiba; Djedouani, Amel; Francois, Michelle; Fleutot, Solenne; Boudjada, Ali 2,6-Dibromo-4-methylaniline IUCrData, 2022, 7, x220577 |
| 1567084 | CIF | C24 H58 Cl10 Cr2 N10 P4 | P 1 21/c 1 | 11.9522; 13.5271; 14.8191 90; 104.592; 90 | 2318.65 | Lo, Quintin; Pye, Dominic; Gesslbauer, Sami; Sim, Ying; García, Felipe; White, Andrew J. P.; Britovsek, George J. P. Single- and double-bridged PNP ligands in chromium-catalysed ethylene oligomerisation Catalysis Science & Technology, 2022, 12, 4544-4551 |
| 1567085 | CIF | C32 H72 Cr2 Li4 O4 | P c c n | 9.9307; 17.6625; 22.0161 90; 90; 90 | 3861.6 | Lo, Quintin; Pye, Dominic; Gesslbauer, Sami; Sim, Ying; García, Felipe; White, Andrew J. P.; Britovsek, George J. P. Single- and double-bridged PNP ligands in chromium-catalysed ethylene oligomerisation Catalysis Science & Technology, 2022, 12, 4544-4551 |
| 1567086 | CIF | C24 H58 Cl10 Cr2 N10 P4 | P 1 21/c 1 | 9.3625; 12.7925; 19.2108 90; 96.406; 90 | 2286.51 | Lo, Quintin; Pye, Dominic; Gesslbauer, Sami; Sim, Ying; García, Felipe; White, Andrew J. P.; Britovsek, George J. P. Single- and double-bridged PNP ligands in chromium-catalysed ethylene oligomerisation Catalysis Science & Technology, 2022, 12, 4544-4551 |
| 1567087 | CIF | C45 H60 Cl2 N2 O4 S2 | P -1 | 13.984; 14.07; 14.277 61.576; 82.569; 62.486 | 2176.2 | Ning, Chao; Rui, Kang-Hua; Wei, Yin; Shi, Min Rh(i)-catalyzed dimerization of ene-vinylidenecyclopropanes for the construction of spiro[4,5]decanes and mechanistic studies Chemical Science, 2022, 13, 7310-7317 |
| 1567088 | CIF | C13 H14 Cl I O2 | P 21 21 21 | 8.9639; 11.1228; 13.259 90; 90; 90 | 1321.97 | Payne, Jenna L.; Deng, Zihang; Flach, Andrew L.; Johnston, Jeffrey N. Enantioselective iodolactonization to prepare ε-lactone rings using hypervalent iodine Chemical Science, 2022, 13, 7318-7324 |
| 1567089 | CIF | C17 H23 B O3 | P c c n | 21.7236; 13.8308; 10.9428 90; 90; 90 | 3287.8 | Cheng, Tairan; Liu, Boxiang; Wu, Rui; Zhu, Shifa Cu-Catalyzed Carboboration of Acetylene with Michael Acceptors Chemical Science, 2022 |
| 1567090 | CIF | C12 H6 Ga O5 | P 42/n m c :2 | 21.57; 21.57; 6.7 90; 90; 90 | 3117.3 | Samperisi, Laura; Zou, Xiaodong; Huang, Zhehao How to get maximum structure information from anisotropic displacement parameters obtained by three-dimensional electron diffraction: an experimental study on metal–organic frameworks IUCrJ, 2022, 9 |
| 1567091 | CIF | C57 H99 Fe K N5 O6 Si2 | P 1 21/c 1 | 11.9424; 24.7899; 22.9964 90; 95.974; 90 | 6771.1 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567092 | CIF | C39 H63 Fe N3 Si2 | P b c a | 19.2646; 16.7587; 24.952 90; 90; 90 | 8055.7 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567093 | CIF | C48 H88 Fe K N4 O6 Si2 | P 1 21/n 1 | 18.281; 14.0555; 22.1239 90; 106.298; 90 | 5456.3 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567094 | CIF | C58 H99 Fe K N5 O6 S2 Si2 | P 1 21/c 1 | 13.8538; 24.6616; 23.5229 90; 90.755; 90 | 8036.1 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567095 | CIF | C35 H24 N2 O9 S4 | P 1 21/c 1 | 12.807; 13.731; 20.965 90; 110.6; 90 | 3451.02 | Liu, Chunyang; Shangguan, Xiaoyan; Li, Yan; Zhang, Qian Copper-catalyzed radical cascade reaction of simple cyclobutanes: synthesis of highly functionalized cyclobutene derivatives. Chemical science, 2022, 13, 7886-7891 |
| 1567096 | CIF | C8 H7.33 Br2 O0.67 | P 1 21/m 1 | 7.6142; 7.1461; 12.6645 90; 106.526; 90 | 660.63 | Liu, Chunyang; Shangguan, Xiaoyan; Li, Yan; Zhang, Qian Copper-catalyzed radical cascade reaction of simple cyclobutanes: synthesis of highly functionalized cyclobutene derivatives. Chemical science, 2022, 13, 7886-7891 |
| 1567097 | CIF | C19 H13 N3 O | P -1 | 6.1025; 8.5817; 14.6868 86.201; 80.086; 76.138 | 735.34 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567098 | CIF | C21 H13 F3 N2 O | P 1 21/c 1 | 12.0851; 7.7428; 19.0267 90; 102.465; 90 | 1738.41 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567099 | CIF | C22 H19 N3 O | I 1 2/a 1 | 21.1606; 7.1694; 25.5604 90; 110.862; 90 | 3623.5 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567100 | CIF | C17 H13 Cl N2 O | C 1 c 1 | 5.7112; 23.177; 10.865 90; 90.891; 90 | 1438 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567101 | CIF | C27 H17 N3 O | P 1 21/n 1 | 11.3712; 9.205; 19.1767 90; 104.402; 90 | 1944.18 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567102 | CIF | C21 H16 N2 O | P 21 21 21 | 7.4535; 11.5915; 18.893 90; 90; 90 | 1632.3 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567103 | CIF | C174 H177.6 Cl24 N24 O4.46 Pd12 | P 1 21 1 | 14.2647; 52.2312; 19.5113 90; 91.295; 90 | 14533.4 | He, Wei; Tashiro, Shohei; Shionoya, Mitsuhiko Highly selective acid-catalyzed olefin isomerization of limonene to terpinolene by kinetic suppression of overreactions in a confined space of porous metal–macrocycle frameworks Chemical Science, 2022 |
| 1567104 | CIF | C88.2 H87.46 Cl12 N13.37 O2.7 Pd6 S0.37 | P 1 21/c 1 | 19.5405; 51.9315; 14.3152 90; 90.587; 90 | 14525.8 | He, Wei; Tashiro, Shohei; Shionoya, Mitsuhiko Highly selective acid-catalyzed olefin isomerization of limonene to terpinolene by kinetic suppression of overreactions in a confined space of porous metal–macrocycle frameworks Chemical Science, 2022 |
| 1567105 | CIF | C89.25 H90.25 Cl21.75 N13 O2 Pd6 | P 1 21/c 1 | 19.4857; 51.838; 14.3167 90; 90.706; 90 | 14460.2 | He, Wei; Tashiro, Shohei; Shionoya, Mitsuhiko Highly selective acid-catalyzed olefin isomerization of limonene to terpinolene by kinetic suppression of overreactions in a confined space of porous metal–macrocycle frameworks Chemical Science, 2022 |
| 1567106 | CIF | C86 H87 Cl12 N13 O Pd6 | P 1 21/c 1 | 19.6017; 52.3627; 14.3397 90; 90.6; 90 | 14717.4 | He, Wei; Tashiro, Shohei; Shionoya, Mitsuhiko Highly selective acid-catalyzed olefin isomerization of limonene to terpinolene by kinetic suppression of overreactions in a confined space of porous metal–macrocycle frameworks Chemical Science, 2022 |
| 1567107 | CIF | C179.1 H185.56 Cl24 N25 O2 Pd12 | P 1 21 1 | 14.3205; 50.1973; 19.4935 90; 91.679; 90 | 14006.9 | He, Wei; Tashiro, Shohei; Shionoya, Mitsuhiko Highly selective acid-catalyzed olefin isomerization of limonene to terpinolene by kinetic suppression of overreactions in a confined space of porous metal–macrocycle frameworks Chemical Science, 2022 |
| 1567108 | CIF | C42 H36 Ag13 F18 N6 O18 S6 | P -1 | 14.0332; 15.3545; 22.418 82.805; 84.35; 88.156 | 4768.2 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567109 | CIF | C14 H14 F6 N2 O6 S2 | P -1 | 6.8729; 8.3071; 8.8774 77.25; 88.991; 75.454 | 478.12 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567110 | CIF | C51 H50 Ag F9 N16 O9 S3 | P 1 21/c 1 | 13.6223; 29.4112; 17.5734 90; 111.122; 90 | 6567.72 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567111 | CIF | C62 H55 Ag5 F9 N17 O9 S3 | C 1 2/c 1 | 38.1353; 21.9159; 25.6721 90; 129.97; 90 | 16443.4 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567112 | CIF | C59 H57 Ag5 F9 N17 O9 S3 | P -1 | 14.8014; 22.3158; 24.83 84.932; 76.949; 73.121 | 7643.2 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567113 | CIF | C57 H53 Ag5 F9 N17 O9 S3 | I 1 2/a 1 | 25.7535; 24.5293; 24.9163 90; 91.174; 90 | 15736.7 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567114 | CIF | C18 H22 F6 N2 O6 S2 | P -1 | 9.0344; 12.927; 15.428 85.714; 87.099; 87.475 | 1792.99 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567115 | CIF | C72 H48 Ag13 F18 N6 O18 S6 | F d d d :2 | 16.1557; 30.2077; 58.888 90; 90; 90 | 28739 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567116 | CIF Paper | C25.5 H26 N2 O9 S | P 41 21 2 | 12.9189; 12.9189; 29.4056 90; 90; 90 | 4907.74 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567117 | CIF Paper | C51 H53 N4 O18 S2 | P 41 21 2 | 12.917; 12.917; 29.3859 90; 90; 90 | 4903 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567118 | CIF Paper | C25.5 H25.5 N2 O8.5 S | P 41 21 2 | 12.9076; 12.9076; 29.467 90; 90; 90 | 4909.38 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567119 | CIF Paper | C25.5 H28 N2 O7.5 S | P 41 21 2 | 12.8885; 12.8885; 29.5227 90; 90; 90 | 4904.12 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567120 | CIF Paper | C25 H26.5 Br0.5 N2 O7 S | P 41 21 2 | 12.8625; 12.8625; 29.5499 90; 90; 90 | 4888.85 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567121 | CIF Paper | C33.33 H35.33 Cl0.67 N2.67 O9.33 S1.33 | P 41 21 2 | 12.8788; 12.8788; 29.3261 90; 90; 90 | 4864.13 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567122 | CIF Paper | C50 H48 F6 N4 O14 S2 | P 41 21 2 | 12.8425; 12.8425; 29.4534 90; 90; 90 | 4857.74 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567123 | CIF Paper | C50 H53 I N4 O14 S2 | P 41 21 2 | 12.9104; 12.9104; 29.4495 90; 90; 90 | 4908.6 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567124 | CIF Paper | C53 H60 N4 O14 S2 | P 41 21 2 | 13.2792; 13.2792; 28.2737 90; 90; 90 | 4985.7 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567125 | CIF Paper | C26 H29 N2 O7 S | P 41 21 2 | 12.9696; 12.9696; 29.2499 90; 90; 90 | 4920.14 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567126 | CIF Paper | C50 H52 N6 O15 S2 | P 41 21 2 | 12.8876; 12.8876; 29.4547 90; 90; 90 | 4892.14 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567127 | CIF Paper | C50 H53 N5 O16 S2 | P 41 21 2 | 12.9268; 12.9268; 29.3204 90; 90; 90 | 4899.5 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567128 | CIF Paper | C26 H30.5 N2 O7 S | P 41 21 2 | 13.185; 13.185; 28.593 90; 90; 90 | 4970.73 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567129 | CIF Paper | C51 H53 N4 O17 S2 | P 41 21 2 | 12.9133; 12.9133; 29.3418 90; 90; 90 | 4892.84 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567130 | CIF Paper | C51 H54 F3 N4 O14 S2 | P 41 21 2 | 12.9492; 12.9492; 29.6806 90; 90; 90 | 4976.9 | Jirát, Jan; Babor, Martin; Ridvan, Luděk; Skořepová, Eliška; Dušek, Michal; Šoóš, Miroslav Structure–property relations of a unique and systematic dataset of 19 isostructural multicomponent apremilast forms IUCrJ, 2022, 9 |
| 1567131 | CIF | C80 H13 N10 Pd7 Sn4 | P 1 21/c 1 | 14.2023; 26.2964; 12.15252 90; 94.3571; 90 | 4525.48 | Kojima, Naoya; Kato, Misaki; Sunada, Yusuke Discrete palladium clusters that consist of two mutually bisecting perpendicular planes Chemical Science, 2022 |
| 1567132 | CIF | C74 H90 Ge6 N10 O2 Pd8 | P -1 | 13.6964; 14.4844; 14.7143 73.065; 62.695; 82.678 | 2481.29 | Kojima, Naoya; Kato, Misaki; Sunada, Yusuke Discrete palladium clusters that consist of two mutually bisecting perpendicular planes Chemical Science, 2022 |
| 1567133 | CIF | C17 H21 N O2 | P -1 | 8.1149; 9.1915; 10.8628 68.232; 78.44; 81.264 | 734.51 | Yu, Wan-Lei; Ren, Zi-Gang; Ma, Ke-Xing; Yang, Hui-Qing; Yang, Jun-Jie; Zheng, Haixue; Wu, Wangsuo; Xu, Peng-Fei Cobalt-catalyzed chemoselective dehydrogenation through radical translocation under visible light. Chemical science, 2022, 13, 7947-7954 |
| 1567134 | CIF | C31 H32 Co N5 O4 Sn | P b c a | 15.0187; 14.1539; 30.0583 90; 90; 90 | 6389.6 | Yu, Wan-Lei; Ren, Zi-Gang; Ma, Ke-Xing; Yang, Hui-Qing; Yang, Jun-Jie; Zheng, Haixue; Wu, Wangsuo; Xu, Peng-Fei Cobalt-catalyzed chemoselective dehydrogenation through radical translocation under visible light. Chemical science, 2022, 13, 7947-7954 |
| 1567135 | CIF | C30 H90 Ge9 P Rh Si12 | P 1 21/c 1 | 14.4411; 25.5519; 18.9046 90; 101.771; 90 | 6829.06 | Townrow, Oliver P. E.; Duckett, Simon B.; Weller, Andrew S.; Goicoechea, Jose M. Zintl cluster supported low coordinate Rh(i) centers for catalytic H/D exchange between H2 and D2 Chemical Science, 2022 |
| 1567136 | CIF | C86 H130 B F24 Ge9 P Rh Si12 | P -1 | 15.0839; 19.3502; 21.6497 106.313; 96.757; 92.771 | 6000.52 | Townrow, Oliver P. E.; Duckett, Simon B.; Weller, Andrew S.; Goicoechea, Jose M. Zintl cluster supported low coordinate Rh(i) centers for catalytic H/D exchange between H2 and D2 Chemical Science, 2022 |
| 1567137 | CIF | C40 H107 Ge9 N2 Rh Si12 | P -1 | 16.3622; 19.8996; 25.9438 68.56; 79.856; 82.113 | 7715.4 | Townrow, Oliver P. E.; Duckett, Simon B.; Weller, Andrew S.; Goicoechea, Jose M. Zintl cluster supported low coordinate Rh(i) centers for catalytic H/D exchange between H2 and D2 Chemical Science, 2022 |
| 1567138 | CIF | C73 H116 B F24 Ge9 O Rh Si12 W | P 1 21/c 1 | 17.9023; 13.8042; 44.4206 90; 96.969; 90 | 10896.4 | Townrow, Oliver P. E.; Duckett, Simon B.; Weller, Andrew S.; Goicoechea, Jose M. Zintl cluster supported low coordinate Rh(i) centers for catalytic H/D exchange between H2 and D2 Chemical Science, 2022 |
| 1567139 | CIF | C37 H93 Ge9 Rh Si12 W | P 1 21/c 1 | 14.2783; 25.643; 19.8461 90; 101.575; 90 | 7118.64 | Townrow, Oliver P. E.; Duckett, Simon B.; Weller, Andrew S.; Goicoechea, Jose M. Zintl cluster supported low coordinate Rh(i) centers for catalytic H/D exchange between H2 and D2 Chemical Science, 2022 |
| 1567140 | CIF | C12 H12 N4 Ni O4 S | C 1 c 1 | 28.3729; 6.5464; 7.3531 90; 97.1; 90 | 1355.29 | González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates New Journal of Chemistry, 2022, 46, 14786-14792 |
| 1567141 | CIF | C12 H16 N4 Ni O4 S | I 1 2/a 1 | 23.012; 6.0848; 10.6386 90; 91.194; 90 | 1489.3 | González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates New Journal of Chemistry, 2022, 46, 14786-14792 |
| 1567142 | CIF | C6 H8 N2 Ni O4 S | C m c m | 6.476; 7.2221; 16.615 90; 90; 90 | 777.09 | González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates New Journal of Chemistry, 2022, 46, 14786-14792 |
| 1567143 | CIF | C24 H18 Br2 O2 | P 1 21/c 1 | 10.087; 24.117; 10.137 90; 119.385; 90 | 2148.7 | Samultceva, Sofia O.; Dvorko, Marina Yu.; Shabalin, Dmitrii A.; Ushakov, Igor’ A.; Vashchenko, Alexander V.; Schmidt, Elena Yu.; Trofimov, Boris A. Regio- and stereoselective base-catalyzed assembly of 6-methylene-5-oxaspiro[2.4]heptanones from alkynyl cyclopropyl ketones Organic & Biomolecular Chemistry, 2022, 20, 5325-5333 |
| 1567144 | CIF HKL Paper | C32 H72 Cl12 I2 Nb6 O12 | P b c a | 19.3389; 18.1968; 34.039 90; 90; 90 | 11978.5 | Schröder, Florian; Köckerling, Martin Tetraaquadodekakis-μ~2~-chlorido-diiodido-<i>octahedro</i>-hexaniobium(12 <i>Nb</i>—<i>Nb</i>) tetrahydrofuran octasolvate IUCrData, 2022, 7, x220618 |
| 1567145 | CIF | C102 H148 Ag16 Cl F15 N4 O16 S9 | P -1 | 17.2901; 17.3047; 29.001 94.002; 97.603; 119.287 | 7410.1 | Das, Anish Kumar; Biswas, Sourav; Manna, Surya Sekhar; Pathak, Biswarup; Mandal, Sukhendu An atomically precise silver nanocluster for artificial light-harvesting system through supramolecular functionalization. Chemical science, 2022, 13, 8355-8364 |
| 1567146 | CIF | C23 H42 Cl Ir N4 O P2 | P 1 21/c 1 | 17.533; 8.1217; 21.3907 90; 111.63; 90 | 2831.5 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567147 | CIF | C23 H42 I Ir N4 O P2 | P 1 21/c 1 | 17.9499; 8.1504; 21.5003 90; 110.968; 90 | 2937.18 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567148 | CIF | C25 H44 Cl3 Ir N4 O P2 | P 1 21/n 1 | 11.9445; 10.1985; 25.8721 90; 94.016; 90 | 3143.9 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567149 | CIF | C48 H89 F2 Ir2 N9 O3 P4 | P -1 | 11.8995; 16.0723; 17.0807 67.203; 75.219; 89.306 | 2898.06 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567150 | CIF | C25 H48 F6 Ir N4 O P3 | P -1 | 13.2443; 16.1281; 16.2491 77.427; 82.219; 84.357 | 3347.95 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567151 | CIF | C23 H42 Br Ir N4 O P2 | P 1 21/c 1 | 17.7005; 8.1175; 21.384 90; 111.189; 90 | 2864.81 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567152 | CIF | C23 H42 F6 Ir N4 O P3 | P 1 21/c 1 | 12.0735; 10.6615; 23.5954 90; 92.963; 90 | 3033.18 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567153 | CIF | C26 H45.5 Ir N5.5 O P2 | P b c a | 26.0183; 23.433; 31.3406 90; 90; 90 | 19107.9 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567154 | CIF | C60 H84 Ag12 F18 N3 O19 S30 | P 1 21/n 1 | 15.6815; 15.1285; 48.3672 90; 98.426; 90 | 11350.7 | Cheng, Xun; Zhong, Rui-Ru; Yuan, Shang-Fu; Guan, Zong-Jie; Liu, Kuan-Guan Compact Accumulation of Superatomic Silver Nanoclusters with Octahedral Ag6 Core Ligated by Trithiane Nanoscale, 2022 |
| 1567155 | CIF | C20 H24 Ag6 F12 O8 S12 | C 1 2/c 1 | 26.1584; 10.0265; 19.8095 90; 128.008; 90 | 4093.7 | Cheng, Xun; Zhong, Rui-Ru; Yuan, Shang-Fu; Guan, Zong-Jie; Liu, Kuan-Guan Compact Accumulation of Superatomic Silver Nanoclusters with Octahedral Ag6 Core Ligated by Trithiane Nanoscale, 2022 |
| 1567156 | CIF | C30 H27 N O5 S | P 21 21 21 | 9.4559; 16.0249; 16.2168 90; 90; 90 | 2457.33 | Yang, Liangkun; Li, Wang-Yuren; Hou, Liuzhen; Zhan, Tangyu; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming NickelII-catalyzed asymmetric photoenolization/Mannich reaction of (2-alkylphenyl) ketones Chemical Science, 2022, 13, 8576-8582 |
| 1567157 | CIF | C30 H25 N O4 S | P 21 21 21 | 9.6145; 18.9746; 26.9615 90; 90; 90 | 4918.62 | Yang, Liangkun; Li, Wang-Yuren; Hou, Liuzhen; Zhan, Tangyu; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming NickelII-catalyzed asymmetric photoenolization/Mannich reaction of (2-alkylphenyl) ketones Chemical Science, 2022, 13, 8576-8582 |
| 1567158 | CIF | C26 H30 N2 O4 | P -1 | 4.85556; 6.47166; 19.94656 92.1464; 95.834; 104.227 | 603.153 | de Oliveira Martins, Inês; Marin, Francesco; Modena, Enrico; Maini, Lucia On the crystal forms of NDI-C6: annealing and deposition procedures to access elusive polymorphs. Faraday discussions, 2022, 235, 490-507 |
| 1567159 | CIF | C56 H37 Co N5 P | P -1 | 9.7214; 12.92; 17.269 77.514; 83.542; 79.876 | 2078.5 | Liu, Zheng-Yan; Lai, Jia-Wei; Yang, Gang; Ren, Bao-Ping; Lv, Zhou-Yan; Si, Li-Ping; Zhang, Hao; Liu, Hai-Yang Electrocatalytic hydrogen production by CN– substituted cobalt triaryl corroles Catalysis Science & Technology, 2022, 12, 5125-5135 |
| 1567160 | CIF | C57 H36 Co N6 P | P -1 | 14.3899; 16.2551; 19.6213 91.265; 108.634; 94.679 | 4328.9 | Liu, Zheng-Yan; Lai, Jia-Wei; Yang, Gang; Ren, Bao-Ping; Lv, Zhou-Yan; Si, Li-Ping; Zhang, Hao; Liu, Hai-Yang Electrocatalytic hydrogen production by CN– substituted cobalt triaryl corroles Catalysis Science & Technology, 2022, 12, 5125-5135 |
| 1567161 | CIF | C29 H29 B2 Cl2 N2 P Ru S3 | P 1 21/n 1 | 9.9824; 23.4742; 13.6413 90; 94.6068; 90 | 3186.2 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567162 | CIF | C32 H45 B2 N2 P Ru S5 | P 1 21/c 1 | 17.2497; 15.0068; 19.7663 90; 115.089; 90 | 4634 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567163 | CIF | C33 H36 B2 Cl2 N2 Ru S4 | P -1 | 8.1421; 9.038; 11.991 91.746; 95.358; 91.618 | 877.7 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567164 | CIF | C40 H47 Cl2 N3 P Ru S6 | C 1 2/c 1 | 43.162; 11.6075; 17.077 90; 94.107; 90 | 8533.7 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567165 | CIF | C16 H14 O2 | P 21 21 21 | 5.247; 8.2089; 28.1307 90; 90; 90 | 1211.65 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567166 | CIF | C12 H12 O3 | P 21 21 21 | 8.796; 10.4133; 10.7857 90; 90; 90 | 987.92 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567167 | CIF | C16 H14 O2 | P 21 21 21 | 5.9107; 13.8035; 15.3174 90; 90; 90 | 1249.72 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567168 | CIF | C14 H12 O2 | P 21 21 21 | 8.6793; 22.7043; 11.0413 90; 90; 90 | 2175.77 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567169 | CIF | C14 H17 Br O5 | P -1 | 7.8803; 9.7157; 10.6212 94.241; 94.434; 111.794 | 748.16 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567170 | CIF | C6 H12 N2 O4 | C 1 2/c 1 | 20.8643; 4.5307; 8.748 90; 102.292; 90 | 807.99 | Jang, Yoon-Jung; Sangroniz, Leire; Hillmyer, Marc A. Ductile gas barrier poly(ester–amide)s derived from glycolide Polymer Chemistry, 2022, 13, 3882-3891 |
| 1567171 | CIF | C8 H16 N2 O4 | P 1 21/c 1 | 8.1288; 7.536; 8.551 90; 113.285; 90 | 481.16 | Jang, Yoon-Jung; Sangroniz, Leire; Hillmyer, Marc A. Ductile gas barrier poly(ester–amide)s derived from glycolide Polymer Chemistry, 2022, 13, 3882-3891 |
| 1567172 | CIF | C10 H20 N2 O4 | C 1 2/c 1 | 25.3633; 5.2161; 8.9982 90; 103.025; 90 | 1159.81 | Jang, Yoon-Jung; Sangroniz, Leire; Hillmyer, Marc A. Ductile gas barrier poly(ester–amide)s derived from glycolide Polymer Chemistry, 2022, 13, 3882-3891 |
| 1567173 | CIF | Fe2 O4 Zn | F d -3 m :2 | 8.44753; 8.44753; 8.44753 90; 90; 90 | 602.822 | Madake, S.B.; Patil, A.R.; Pedanekar, R.S.; Narewadikar, N.A.; Thorat, J.B.; Rajpure, K.Y. The influence of nickel substitution on the structural and gas sensing properties of sprayed ZnFe2O4 thin films Journal of Materials Science: Materials in Electronics, 2022, 33, 6273-6282 |
| 1567174 | CIF | Fe2 Ni0.1 O4 Zn0.9 | F d -3 m :2 | 8.4462; 8.4462; 8.4462 90; 90; 90 | 602.538 | Madake, S.B.; Patil, A.R.; Pedanekar, R.S.; Narewadikar, N.A.; Thorat, J.B.; Rajpure, K.Y. The influence of nickel substitution on the structural and gas sensing properties of sprayed ZnFe2O4 thin films Journal of Materials Science: Materials in Electronics, 2022, 33, 6273-6282 |
| 1567175 | CIF | Fe2 Ni0.2 O4 Zn0.8 | F d -3 m :2 | 8.4447; 8.4447; 8.4447 90; 90; 90 | 602.217 | Madake, S.B.; Patil, A.R.; Pedanekar, R.S.; Narewadikar, N.A.; Thorat, J.B.; Rajpure, K.Y. The influence of nickel substitution on the structural and gas sensing properties of sprayed ZnFe2O4 thin films Journal of Materials Science: Materials in Electronics, 2022, 33, 6273-6282 |
| 1567176 | CIF | Fe2 Ni0.3 O4 Zn0.7 | F d -3 m :2 | 8.4434; 8.4434; 8.4434 90; 90; 90 | 601.938 | Madake, S.B.; Patil, A.R.; Pedanekar, R.S.; Narewadikar, N.A.; Thorat, J.B.; Rajpure, K.Y. The influence of nickel substitution on the structural and gas sensing properties of sprayed ZnFe2O4 thin films Journal of Materials Science: Materials in Electronics, 2022, 33, 6273-6282 |
| 1567177 | CIF | Fe2 Ni0.4 O4 Zn0.6 | F d -3 m :2 | 8.4422; 8.4422; 8.4422 90; 90; 90 | 601.682 | Madake, S.B.; Patil, A.R.; Pedanekar, R.S.; Narewadikar, N.A.; Thorat, J.B.; Rajpure, K.Y. The influence of nickel substitution on the structural and gas sensing properties of sprayed ZnFe2O4 thin films Journal of Materials Science: Materials in Electronics, 2022, 33, 6273-6282 |
| 1567178 | CIF | Fe2 Ni0.5 O4 Zn0.5 | F d -3 m :2 | 8.4413; 8.4413; 8.4413 90; 90; 90 | 601.489 | Madake, S.B.; Patil, A.R.; Pedanekar, R.S.; Narewadikar, N.A.; Thorat, J.B.; Rajpure, K.Y. The influence of nickel substitution on the structural and gas sensing properties of sprayed ZnFe2O4 thin films Journal of Materials Science: Materials in Electronics, 2022, 33, 6273-6282 |
| 1567179 | CIF | C12 H10 O2 Pb S2 | P 1 21/c 1 | 15.1207; 5.2004; 7.6325 90; 95.5358; 90 | 597.372 | Li, Yang; Cheng, Xiuyan; Li, Ze; Jin, Yigang; Sun, Yimeng; Zou, Ye; Liu, Liyao; Duan, Ran; Zhang, Jianling; Xu, Wei Two highly crystalline coordination polymers with two-dimensional PbS networks for photocatalytic synthesis of imines Catalysis Science & Technology, 2022, 12, 4851-4856 |
| 1567180 | CIF | C6 H4 Pb S2 | P 1 21/c 1 | 7.4789; 5.2068; 17.4623 90; 93.3828; 90 | 678.82 | Li, Yang; Cheng, Xiuyan; Li, Ze; Jin, Yigang; Sun, Yimeng; Zou, Ye; Liu, Liyao; Duan, Ran; Zhang, Jianling; Xu, Wei Two highly crystalline coordination polymers with two-dimensional PbS networks for photocatalytic synthesis of imines Catalysis Science & Technology, 2022, 12, 4851-4856 |
| 1567181 | CIF | C11 H14 N2 O5 | P 1 21/a 1 | 26.371; 5.2029; 8.904 90; 99.325; 90 | 1205.5 | Linberg, Kevin; Röder, Bettina; Al-Sabbagh, Dominik; Emmerling, Franziska; Michalchuk, Adam A. L. Controlling polymorphism in molecular cocrystals by variable temperature ball milling. Faraday discussions, 2023, 241, 178-193 |
| 1567182 | CIF HKL Paper | C20 H70 N28 O34 V10 | P -1 | 8.9701; 13.2202; 14.0861 99.609; 103.133; 107.676 | 1499 | Pérez-Benítez, Aarón; Ariza-Ramírez, Jorge Luis; Fortis-Valera, Monserrat; Arroyo-Carmona, Rosa Elena; Martínez de la Luz, María Isabel; Ramírez-Contreras, Diego; Bernès, Sylvain Bis{[amino(iminiumyl)methyl]urea} tetrakis{2-[(dimethylamino)(iminiumyl)methyl]guanidine} di-μ~6~-oxido-tetra-μ~3~-oxido-tetradeca-μ~2~-oxido-octaoxidodecavanadium(V) tetrahydrate IUCrData, 2022, 7, x220627 |
| 1567183 | CIF HKL Paper | C8 H4 N4 Te2 | P -1 | 7.6531; 11.7862; 16.8371 81.35; 85.884; 80.44 | 1478.9 | Franklin, Donna; Lee, Aundrea; Fronczek, Frank R.; Junk, Thomas [1,4]Ditellurino[2,3-<i>b</i>:5,6-<i>b</i>']dipyrazine IUCrData, 2022, 7, x220622 |
| 1567184 | CIF | C22 H56 Al O P Si4 | P -1 | 9.05033; 11.72687; 16.30904 94.4336; 96.4467; 108.884 | 1615.45 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567185 | CIF | C23 H55 Al O3 P Si4 | P 1 21/n 1 | 11.738; 28.6426; 11.8207 90; 119.12; 90 | 3471.9 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567186 | CIF | C30 H78 Al2 O4 Si8 | P 1 21/n 1 | 14.912; 9.33098; 17.8266 90; 104.662; 90 | 2399.68 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567187 | CIF | C23 H58 Al O3 P Si4 | P -1 | 12.51484; 16.89311; 17.04953 84.6973; 76.7333; 75.257 | 3390.6 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567188 | CIF | C28 H25 N3 O3 | P 1 21/c 1 | 12.6477; 12.7165; 19.2801 90; 130.968; 90 | 2341.4 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567189 | CIF | C11 H10 N O P S | P 1 21 1 | 8.8091; 14.2922; 15.6275 90; 97.274; 90 | 1951.69 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567190 | CIF | C28 H26 N3 O3 | P 1 21 1 | 8.647; 20.509; 8.854 90; 101.501; 90 | 1538.7 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567191 | CIF | C29 H27 N3 O3 | P 21 21 21 | 9.75496; 13.6686; 18.7757 90; 90; 90 | 2503.49 | Wang, Yue; Li, Er-Qing; Duan, Zheng Ligand-dependent, palladium-catalyzed stereodivergent synthesis of chiral tetrahydroquinolines. Chemical science, 2022, 13, 8131-8136 |
| 1567192 | CIF | C144 H82 N12 O32 S6 Zr6 | F d -3 m :2 | 39.3006; 39.3006; 39.3006 90; 90; 90 | 60701.2 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567193 | CIF | C84 H44 N6 O16 S3 Zr3 | F d -3 m :2 | 39.2392; 39.2392; 39.2392 90; 90; 90 | 60417.2 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567194 | CIF | C14 H10 N6 S Zn | P 1 21/n 1 | 7.0203; 10.3506; 24.2607 90; 95.442; 90 | 1754.94 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567195 | CIF | C12 H6 N6 S Zn | I 41 | 16.549; 16.549; 12.4563 90; 90; 90 | 3411.4 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567196 | CIF | C112 H64 N16 O17 Se4 Zn4 | P -1 | 10.4136; 15.0054; 15.7481 88.538; 87.931; 81.423 | 2431.19 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567197 | CIF | C112 H64 N16 O17 S4 Zn4 | P -1 | 10.4363; 15.0079; 15.7667 88.157; 88.133; 81.78 | 2441.9 | Xia, Hai-Lun; Zhou, Kang; Wu, Shenjie; Ren, Daming; Xing, Kai; Guo, Jiandong; Wang, Xiaotai; Liu, Xiao-Yuan; Li, Jing Building an emission library of donor-acceptor-donor type linker-based luminescent metal-organic frameworks. Chemical science, 2022, 13, 8036-8044 |
| 1567198 | CIF | C18 H27 F3 N4 O7 | P 1 21 1 | 18.0201; 14.3179; 18.0259 90; 111.026; 90 | 4341.2 | Schnitzer, Tobias; Rackl, Jonas W.; Wennemers, Helma Stereoselective peptide catalysis in complex environments – from river water to cell lysates Chemical Science, 2022 |
| 1567199 | CIF | C38 H84 Br0.6 Cl3.4 N2 Pt | P -1 | 7.5925; 8.1406; 20.0035 88.891; 80.802; 66.229 | 1115.54 | Yamamoto, Eisuke; Suzuki, Akiko; Kobayashi, Makoto; Osada, Minoru Tailored Synthesis of Molecularly-Thin Platinum Nanosheets Using Designed 2D Surfactant Solids Nanoscale, 2022 |
| 1567200 | CIF | C H4 N2 O S Sn | P b c a | 5.817; 16.812; 11.892 90; 90; 90 | 1163 | Kokunov, Yu. V. Tin(II) Fluoride Compounds with Mixed Acidoligands: Synthesis and Crystal Structure of NH4[SnF2(NCS)] Russian Journal of Coordination Chemistry, 2000, 26, 857-860 |
| 1567201 | CIF | C60 H144 Cs N3 O16 Si8 U2 | P -1 | 14.1418; 16.3515; 22.1403 107.364; 92.5382; 108.194 | 4588.44 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567202 | CIF | C67 H152 K3 N5 O16 Si8 U2 | P 1 21/n 1 | 17.5895; 26.3839; 21.325 90; 99.763; 90 | 9753.2 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567203 | CIF | C60 H144 Cs N3 O16 Si8 U2 | P -1 | 13.9128; 16.1167; 21.8294 80.346; 83.8; 71.074 | 4557 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567204 | CIF | C60 H144 Cs2 N3 O16 Si8 U2 | P -1 | 13.707; 13.7678; 29.7454 94.2273; 97.0402; 117.487 | 4887.79 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567205 | CIF | C72 H174 K2 N5 O14 Si10 U2 | P 1 21/c 1 | 20.57855; 19.40862; 26.9671 90; 91.6235; 90 | 10766.4 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567206 | CIF | C49.2 H129 K N5 O8.3 Si10 U2 | P 1 21/n 1 | 12.81649; 23.44652; 27.38157 90; 100.985; 90 | 8077.44 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567207 | CIF | C66 H162 K6 N6 O16 Si10 U2 | P 1 21/n 1 | 15.102; 29.934; 27.0037 90; 99.035; 90 | 12055.9 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567208 | CIF | C84 H198 K2 N9 O20 Si10 U2 | P -1 | 13.8976; 14.741; 18.5692 106.635; 103.811; 95.243 | 3487.04 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567209 | CIF | C60 H144 K N3 O16 Si8 U2 | P -1 | 14.1046; 16.153; 22.2432 108.265; 92.266; 107.449 | 4540.8 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567210 | CIF | C96 H234 K6 N10 O24 Si14 U4 | P -1 | 13.65686; 17.961; 20.0238 93.8055; 91.6994; 112.135 | 4531.67 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567211 | CIF | C36 H90 K N2 O8 Si6 U | P -1 | 13.5839; 20.4057; 22.3874 66.602; 83.686; 85.153 | 5655 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567212 | CIF | C66 H158 K2 N3 O16 Si8 U2 | P 1 21/c 1 | 14.10134; 30.68723; 46.2387 90; 92.8994; 90 | 19983.3 | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Nitrogen activation and cleavage by a multimetallic uranium complex. Chemical science, 2022, 13, 8025-8035 |
| 1567213 | CIF | H3 K3 O12 V2 | P 1 21/c 1 | 6.6993; 9.945; 15.797 90; 93.72; 90 | 1050.3 | Lesnugin, A. V.; Rybakov, V. B.; Aslanov, L. A.; Anisimov, A. V. Synthesis and Structure of Potassium Oxodiperoxovanadate Russian Journal of Coordination Chemistry, 2001, 27, 116-118 |
| 1567214 | CIF | Ba Co0.4 Fe0.4 O2.426 Zr0.2 | P m -3 m | 4.109664; 4.109664; 4.109664 90; 90; 90 | 69.41 | Antonis Vamvakeros, Dorota Matras, Simon D.M. Jacques, Marco di Michiel, Vesna Middelkoop, Peixi Cong, Stephen W.T. Price, Craig L. Bull, Pierre Senecal, Andrew M. Beale Real-time tomographic diffraction imaging of catalytic membrane reactors for the oxidative coupling of methane Catalysis Today, 2021, 364, 242 |
| 1567215 | CIF | Fe O4 W | P 1 2/c 1 | 4.73523; 5.74138; 4.99198 90; 90.0801; 90 | 135.716 | Patil, Amitkumar R.; Dongale, Tukaram D.; Kamat, Rajanish K.; Rajpure, Keshav Y. Spray pyrolysis deposited iron tungstate memristive device for artificial synapse application Materials Today Communications, 2021, 29, 102900 |
| 1567216 | CIF | O4 W Zn | P 1 2/c 1 | 4.69482; 5.72249; 4.92885 90; 90.6325; 90 | 132.411 | Patil, Amitkumar R.; Dongale, Tukaram D.; Kamat, Rajanish K.; Rajpure, Keshav Y. Spray deposited zinc tungstate thin film for non-volatile memory application Materials Letters, 2022, 322, 132494 |
| 1567217 | CIF | C34 H50 | P -1 | 5.35; 9.58; 14.946 99.685; 90.243; 96.275 | 750.4 | Kitamura, Chitoshi; Tsukuda, Hideki; Kawase, Takeshi; Kobayashi, Takashi; Naito, Hiroyoshi Crystal Structure of 1,4,5,8-Tetrapentylanthracene X-ray Structure Analysis Online, 2010, 26, 65-66 |
| 1567218 | CIF | C24 H44 Cl4 Cu2 N4 O2 | P 21 21 21 | 8.694; 12.752; 27.613 90; 90; 90 | 3061.3 | Larionov, S. V.; Myachina, L. I.; Romanenko, G. V.; Tkachev, A. V.; Sheludyakova, L. A.; Ikorskii, V. N.; Boguslavskii, E. G. Synthesis, Crystal and Molecular Structures, and Properties of Optically Active Copper(II) Complexes with 3-N,N-Dimethylaminocaran-4-one-oxime Russian Journal of Coordination Chemistry, 2001, 27, 423-432 |
| 1567219 | CIF | C36 H80 Cl2 Cu3 N6 O12 | P 43 21 2 | 22.423; 22.423; 20.454 90; 90; 90 | 10284 | Larionov, S. V.; Myachina, L. I.; Romanenko, G. V.; Tkachev, A. V.; Sheludyakova, L. A.; Ikorskii, V. N.; Boguslavskii, E. G. Synthesis, Crystal and Molecular Structures, and Properties of Optically Active Copper(II) Complexes with 3-N,N-Dimethylaminocaran-4-one-oxime Russian Journal of Coordination Chemistry, 2001, 27, 423-432 |
| 1567220 | CIF | C24 H20 O8 Re S16 | P -1 | 9.04; 12.744; 16.14 80.22; 88.87; 78.67 | 1796.5 | Gritsenko, V. V.; D'yachenko, O. A.; Kotov, A. I.; Buravov, L. I.; Mizuno, M. Influence of Packing of Radical Cations on the Conductivity of the New Molecular Semiconductor (Doet)2ReO4 Russian Journal of Coordination Chemistry, 2001, 27, 401-406 |
| 1567221 | CIF | C28 H28 N O3 Sb | P 1 21/c 1 | 9.874; 22.905; 12.325 90; 112.03; 90 | 2584 | Sharutin, V. V.; Sharutina, O. K.; Bondar', E. A.; Pakusina, A. P.; Adonin, N. Yu.; Starichenko, V. F.; Fukin, G. K.; Zakharov, L. N. Tetraphenylantimony Pentafluorobenzoate and Tetra-p-Tolylantimony Nitrate: Syntheses and Structures Russian Journal of Coordination Chemistry, 2001, 27, 393-397 |
| 1567222 | CIF | C31 H20 F5 O2 Sb | P 1 21/c 1 | 16.175; 8.765; 20.42 90; 113.03; 90 | 2664.3 | Sharutin, V. V.; Sharutina, O. K.; Bondar', E. A.; Pakusina, A. P.; Adonin, N. Yu.; Starichenko, V. F.; Fukin, G. K.; Zakharov, L. N. Tetraphenylantimony Pentafluorobenzoate and Tetra-p-Tolylantimony Nitrate: Syntheses and Structures Russian Journal of Coordination Chemistry, 2001, 27, 393-397 |
| 1567223 | CIF | C18 H26 O14 Zn | C 1 2/c 1 | 25.254; 6.952; 13.951 90; 116.41; 90 | 2193.7 | Shova, S.; Novitsky, G.; Gdaniec, M.; Simonov, Yu. A.; Shafransky, V.; Turta, C. Synthesis and Structure of Tetraaqua-bis(2-Formylphenoxyacetato)Zinc(II) Dihydrate Russian Journal of Coordination Chemistry, 2001, 27, 387-392 |
| 1567224 | CIF | F15 H12 N3 Sb4 | P -1 | 8.317; 10.419; 10.826 63.71; 73.24; 77.42 | 800.9 | Udovenko, A. A.; Gorbunova, Yu. E.; Zemnukhova, L. A.; Mikhailov, Yu. N.; Davidovich, R. L. Crystal Structures of Ammonium and Cesium Pentadecafluorotetraantimonates(III) Russian Journal of Coordination Chemistry, 2001, 27, 479-482 |
| 1567225 | CIF | Cs3 F15 Sb4 | P 1 21/c 1 | 8.079; 19.116; 8.162 90; 117.08; 90 | 1122.3 | Udovenko, A. A.; Gorbunova, Yu. E.; Zemnukhova, L. A.; Mikhailov, Yu. N.; Davidovich, R. L. Crystal Structures of Ammonium and Cesium Pentadecafluorotetraantimonates(III) Russian Journal of Coordination Chemistry, 2001, 27, 479-482 |
| 1567226 | CIF | H2 O3 P Rb | P 1 21/c 1 | 7.53; 8.634; 12.426 90; 102.46; 90 | 788.8 | Kosterina, E. V.; Troyanov, S. I.; Kemnitz, E.; Aslanov, L. A. Synthesis and Crystal Structure of Acid Phosphites RbH2PO3, CsH2PO3, and TlH2PO3 Russian Journal of Coordination Chemistry, 2001, 27, 458-462 |
| 1567227 | CIF | Cs H2 O3 P | P 1 21/c 1 | 7.93; 8.929; 13.163 90; 104.84; 90 | 900.9 | Kosterina, E. V.; Troyanov, S. I.; Kemnitz, E.; Aslanov, L. A. Synthesis and Crystal Structure of Acid Phosphites RbH2PO3, CsH2PO3, and TlH2PO3 Russian Journal of Coordination Chemistry, 2001, 27, 458-462 |
| 1567228 | CIF | H2 O3 P Tl | P n a 21 | 6.603; 6.785; 8.836 90; 90; 90 | 395.86 | Kosterina, E. V.; Troyanov, S. I.; Kemnitz, E.; Aslanov, L. A. Synthesis and Crystal Structure of Acid Phosphites RbH2PO3, CsH2PO3, and TlH2PO3 Russian Journal of Coordination Chemistry, 2001, 27, 458-462 |
| 1567229 | CIF | C14 H8 F2 O2 | P 21 21 2 | 6.1423; 23.2488; 4.0149 90; 90; 90 | 573.33 | Divya, Indira S.; Saravanan, Kandasamy; Haseba, Shodai; Sasaki, Toshiyuki; Koshima, Hideko; Wozniak, Krzysztof; Varughese, Sunil Flexible organic crystals. Understanding the tractable co-existence of elastic and plastic bending Chemical Science, 2022 |
| 1567230 | CIF | C42 H74 Cl3 F0 N4 O8 S0 Sc | P 21 21 21 | 13.2602; 14.244; 25.4714 90; 90; 90 | 4811 | Li, Yi; Xin, Shuang; Weng, Rui; Liu, Xiaohua; Feng, Xiaoming Asymmetric Synthesis of Chromanone Lactones via Vinylogous Conjugate Addition of Butenolide to 2-Ester Chromones Chemical Science, 2022 |
| 1567231 | CIF | C7 H14 Cl N3 O4 | P 21 21 21 | 5.2258; 8.7007; 22.97 90; 90; 90 | 1044.4 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567232 | CIF | C17 H23 N O10 S | P 21 21 21 | 8.0982; 15.8199; 16.351 90; 90; 90 | 2094.8 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567233 | CIF | C39 H33 Cl6 N P2 Pt | P -1 | 10.7207; 13.8244; 14.532 114.84; 91.402; 96.559 | 1935.42 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567234 | CIF | C17 H18 O4 S | P 1 21 1 | 5.7898; 8.4887; 15.9793 90; 92.849; 90 | 784.38 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567235 | CIF | C52 H40 B2 F8 N4 P2 Pt | P 1 21/m 1 | 11.289; 16.021; 13.684 90; 107.97; 90 | 2354.2 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567236 | CIF | C12 H18 O5 S2 | P 21 21 21 | 9.1347; 9.4741; 18.1026 90; 90; 90 | 1566.65 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567237 | CIF | C74.5 H69 Br2 Cl N8 O2 S2 Zn2 | P -1 | 10.784; 11.371; 29.455 97.326; 97.564; 96.209 | 3522.5 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567238 | CIF | C88 H144 Ag2 N24 O4 Pd4 | C 1 2/m 1 | 22.785; 15.8669; 20.292 90; 108.536; 90 | 6955.5 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567239 | CIF | C88 H148 Ag2 B2 F20 N24 O2 Pd4 Si2 | P -1 | 13.5019; 14.026; 20.0093 72.754; 73.765; 80.009 | 3457.63 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567240 | CIF | C33 H42 N4 O2 | P b c a | 14.8284; 17.9936; 21.3095 90; 90; 90 | 5685.7 | Li, Shao-Chuan; Liu, Caiping; chen, qihui; Jiang, Feilong; Yuan, Daqiang; Sun, Qing-Fu; Hong, Maochun Adaptive coordination assemblies based on a flexible tetraazacyclododecane ligand for promoting carbon dioxide fixation Chemical Science, 2022 |
| 1567241 | CIF | C56 H55 Al N4 O5.5 P | C 1 2/c 1 | 21.806; 21.822; 20.8 90; 101.314; 90 | 9705 | Takahashi, Kazuyuki; Noguchi, Takumi; Ueda, Keiji; Miyawaki, Atsuhiro; Murata, Suguru Molecular Structures and Redox Properties of Homoleptic Aluminum(III) Complexes with Azobisphenolate (azp) Ligands Inorganics, 2022, 10, 84 |
| 1567242 | CIF | C48 H32 Al Cl4 N4 O4 P | P n a 21 | 13.424; 16.38; 41.151 90; 90; 90 | 9048 | Takahashi, Kazuyuki; Noguchi, Takumi; Ueda, Keiji; Miyawaki, Atsuhiro; Murata, Suguru Molecular Structures and Redox Properties of Homoleptic Aluminum(III) Complexes with Azobisphenolate (azp) Ligands Inorganics, 2022, 10, 84 |
| 1567243 | CIF | C53 H48 Al N4 O6 P | P -1 | 11.8738; 13.224; 16.406 81.934; 81.586; 64.23 | 2286.4 | Takahashi, Kazuyuki; Noguchi, Takumi; Ueda, Keiji; Miyawaki, Atsuhiro; Murata, Suguru Molecular Structures and Redox Properties of Homoleptic Aluminum(III) Complexes with Azobisphenolate (azp) Ligands Inorganics, 2022, 10, 84 |
| 1567244 | CIF | C64 H68 Al N4 O4 P | P -1 | 13.374; 14.095; 16.593 96.179; 106.731; 103.041 | 2868 | Takahashi, Kazuyuki; Noguchi, Takumi; Ueda, Keiji; Miyawaki, Atsuhiro; Murata, Suguru Molecular Structures and Redox Properties of Homoleptic Aluminum(III) Complexes with Azobisphenolate (azp) Ligands Inorganics, 2022, 10, 84 |
| 1567245 | CIF | C58 H52 Al N4 O4 P | P -1 | 13.324; 13.763; 14.19 91.243; 104.039; 101.05 | 2471 | Takahashi, Kazuyuki; Noguchi, Takumi; Ueda, Keiji; Miyawaki, Atsuhiro; Murata, Suguru Molecular Structures and Redox Properties of Homoleptic Aluminum(III) Complexes with Azobisphenolate (azp) Ligands Inorganics, 2022, 10, 84 |
| 1567246 | CIF HKL Paper | C8 H5 Cl N2 O2 | P 1 21/c 1 | 7.4296; 7.5187; 14.3206 90; 94.184; 90 | 797.83 | Martins, Bianca Barreto; Gervini, Vanessa Carratu; Pires, Fabricio Carvalho; Bortoluzzi, Adailton João; de Oliveira, Adriano Bof (3Z)-5-Chloro-3-(hydroxyimino)indolin-2-one IUCrData, 2016, 1, x161506 |
| 1567247 | CIF | C12 H11 Br I N O | C 1 2/c 1 | 19.7902; 6.2266; 20.7782 90; 102.111; 90 | 2503.4 | Li, Xinwei; Cheng, Zengrui; Liu, Jianzhong; Zhang, Ziyao; Song, Song; Jiao, Ning Selective Desaturation of Amides: A Direct Approach to Enamides Chemical Science, 2022 |
| 1567248 | CIF HKL Paper | C6 H8 N2 | P 1 21/n 1 | 7.908; 7.441; 9.88 90; 104.91; 90 | 561.8 | Morales-Collazo, Oscar; Lynch, Vincent M.; Brennecke, Joan F. 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole IUCrData, 2020, 5, x200681 |
| 1567249 | CIF | C6 H8 Ag Br N2 | P 1 21/c 1 | 6.316; 7.365; 17.769 90; 81.08; 90 | 816.57 | Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization. Faraday discussions, 2023, 241, 448-465 |
| 1567250 | CIF | C6 H9 Br N2 | P 1 21/c 1 | 7.8259; 13.3434; 7.8729 90; 103.64; 90 | 798.93 | Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization. Faraday discussions, 2023, 241, 448-465 |
| 1567251 | CIF | C6 H8 Ag Br N2 | P 1 21/c 1 | 9.4518; 6.188; 14.3981 90; 105.712; 90 | 810.65 | Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization. Faraday discussions, 2023, 241, 448-465 |
| 1567252 | CIF | C6 H8 Ag I N2 | P 1 21/c 1 | 16.9162; 4.5682; 22.7197 90; 90.447; 90 | 1755.65 | Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization. Faraday discussions, 2023, 241, 448-465 |
| 1567253 | CIF | C6 H8 Ag I N2 | P -1 | 4.579; 10.323; 10.263 112.54; 83.86; 85.59 | 441.808 | Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization. Faraday discussions, 2023, 241, 448-465 |
| 1567254 | CIF | C6 H8 Ag Br N2 | P -1 | 4.3871; 10.1081; 10.251 113.498; 97.081; 93.535 | 410.63 | Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization. Faraday discussions, 2023, 241, 448-465 |
| 1567255 | CIF | C44 H73 N2 O4 Y | P -1 | 9.938; 12.053; 19.598 94.27; 104.5; 90.69 | 2265.3 | Duan, Yu-Lai; Guo, Qian; Liu, Gui-Yang; Yi, Zhong-Zhou; Feng, Shao-Ping; Huang, Yong Highly heteroselective ring-opening polymerization of rac-lactide initiated by rare-earth alkoxides bearing chiral [NNOO]-type amine-bis(phenolate) ligands Polymer Chemistry, 2022, 13, 4249-4259 |
| 1567256 | CIF | C50 H86 N2 O4.25 Y | I 1 2 1 | 21.9272; 11.1967; 41.785 90; 92.244; 90 | 10250.9 | Duan, Yu-Lai; Guo, Qian; Liu, Gui-Yang; Yi, Zhong-Zhou; Feng, Shao-Ping; Huang, Yong Highly heteroselective ring-opening polymerization of rac-lactide initiated by rare-earth alkoxides bearing chiral [NNOO]-type amine-bis(phenolate) ligands Polymer Chemistry, 2022, 13, 4249-4259 |
| 1567257 | CIF | H7 O9 P3 Rb2 | P -1 | 7.713; 8.679; 9.235 79.36; 67.6; 88.13 | 561.2 | Kosterina, E. V.; Troyanov, S. I.; Aslanov, L. A.; Kemnitz, E. Superacid Univalent Metal Phosphites (MH2PO3)2 x H3PO3 (M = Rb, Tl(I)) and MH2PO3 x H3PO3 (M = K, Cs): Synthesis and Structure Russian Journal of Coordination Chemistry, 2001, 27, 527-536 |
| 1567258 | CIF | H7 O9 P3 Tl2 | P -1 | 7.69; 8.494; 9.292 79.48; 66.72; 85.45 | 548.1 | Kosterina, E. V.; Troyanov, S. I.; Aslanov, L. A.; Kemnitz, E. Superacid Univalent Metal Phosphites (MH2PO3)2 · H3PO3 (M = Rb, Tl(I)) and MH2PO3 · H3PO3 (M = K, Cs): Synthesis and Structure Russian Journal of Coordination Chemistry, 2001, 27, 527-536 |
| 1567259 | CIF | H5 K O6 P2 | P 1 21/c 1 | 8.726; 12.182; 6.354 90; 104.14; 90 | 655 | Kosterina, E. V.; Troyanov, S. I.; Aslanov, L. A.; Kemnitz, E. Superacid Univalent Metal Phosphites (MH2PO3)2 · H3PO3 (M = Rb, Tl(I)) and MH2PO3 · H3PO3 (M = K, Cs): Synthesis and Structure Russian Journal of Coordination Chemistry, 2001, 27, 527-536 |
| 1567260 | CIF | Cs H5 O6 P2 | P 21 21 21 | 6.033; 6.444; 18.345 90; 90; 90 | 713.2 | Kosterina, E. V.; Troyanov, S. I.; Aslanov, L. A.; Kemnitz, E. Superacid Univalent Metal Phosphites (MH2PO3)2 · H3PO3 (M = Rb, Tl(I)) and MH2PO3 · H3PO3 (M = K, Cs): Synthesis and Structure Russian Journal of Coordination Chemistry, 2001, 27, 527-536 |
| 1567261 | CIF | Cs H5 O6 P2 | C 1 2/c 1 | 9.99; 12.197; 6.866 90; 118.14; 90 | 737.7 | Kosterina, E. V.; Troyanov, S. I.; Aslanov, L. A.; Kemnitz, E. Superacid Univalent Metal Phosphites (MH2PO3)2 · H3PO3 (M = Rb, Tl(I)) and MH2PO3 · H3PO3 (M = K, Cs): Synthesis and Structure Russian Journal of Coordination Chemistry, 2001, 27, 527-536 |
| 1567262 | CIF | Cs H9 I2 O12 | C 1 c 1 | 18.473; 5.439; 10.481 90; 99.73; 90 | 1037.9 | Shilov, G. V.; Dobrovol'skii, Yu. A.; Chernyak, A. V.; Leonova, L. S.; Zyubina, T. S.; Romanchenko, E. V.; Atovmyan, L. O. Crystal Structure and Properties of Acid Salt of Orthoperiodic Acid CsH9I2O12 Russian Journal of Coordination Chemistry, 2001, 27, 786-790 |
| 1567263 | CIF | F6 H4 N Na Ti | P b c n | 8.034; 12.953; 10.755 90; 90; 90 | 1119.2 | Popov, D. Yu.; Kavun, V. Ya.; Antokhina, T. F.; Gerasimenko, A. V.; Sergienko, V. I. Crystal Structure of NH4NaTiF6 and Internal Mobility of the Complex Anions Russian Journal of Coordination Chemistry, 2001, 27, 831-834 |
| 1567264 | CIF | Cs F6 Li Ti | P b c n | 9.251; 11.92; 10.271 90; 90; 90 | 1132.6 | Popov, D. Yu.; Kavun, V. Ya.; Gerasimenko, A. V.; Sergienko, V. I.; Antokhina, T. F. Crystal Structures of LiCsTiF6 and Cs2TiF6 and Internal Mobility of Complex Anions Russian Journal of Coordination Chemistry, 2002, 28, 19-24 |
| 1567265 | CIF | Cs2 F6 Ti | P -3 m 1 | 6.213; 6.213; 5.004 90; 90; 120 | 167.28 | Popov, D. Yu.; Kavun, V. Ya.; Gerasimenko, A. V.; Sergienko, V. I.; Antokhina, T. F. Crystal Structures of LiCsTiF6 and Cs2TiF6 and Internal Mobility of Complex Anions Russian Journal of Coordination Chemistry, 2002, 28, 19-24 |
| 1567266 | CIF | F11 H8 N2 Sb3 | P -1 | 7.78; 8.37; 10.62 71.06; 89.03; 63.58 | 579.1 | Udovenko, A. A.; Zemnukhova, L. A.; Gorbunova, Yu. E.; Mikhailov, Yu. N.; Davidovich, R. L. Crystal Structure of Ammonium Undecafluorotriantimonate(III) (NH4)2Sb3F11 Russian Journal of Coordination Chemistry, 2002, 28, 12-14 |
| 1567267 | CIF | C12 H36 Mo4 N24 Te4 Zn3 | P -4 3 n | 12.721; 12.721; 12.721 90; 90; 90 | 2058.6 | Kalinina, I. V.; Pervukhina, N. V.; Podberezskaya, N. V.; Fedin, V. P. Cubane Tellurido Clusters [Zn(NH3)4]3[Mo4Te4(CN)12] and [Cd(NH3)4]3[W4Te4(CN)12]: Syntheses and Crystal Structures Russian Journal of Coordination Chemistry, 2002, 28, 389-393 |
| 1567268 | CIF | C12 H36 Cd3 N24 Te4 W4 | P -4 3 n | 12.809; 12.809; 12.809 90; 90; 90 | 2101.6 | Kalinina, I. V.; Pervukhina, N. V.; Podberezskaya, N. V.; Fedin, V. P. Cubane Tellurido Clusters [Zn(NH3)4]3[Mo4Te4(CN)12] and [Cd(NH3)4]3[W4Te4(CN)12]: Syntheses and Crystal Structures Russian Journal of Coordination Chemistry, 2002, 28, 389-393 |
| 1567269 | CIF | Al Co H38 Mo6 O40 | P -1 | 6.796; 11.248; 11.568 101.36; 96.95; 102.23 | 835 | Kaziev, G. Z.; Quinones, Saul O.; Bel'skii, V. K.; Zavodnik, V. I.; Osminkina, I. V.; De Ita, Antonio X-Ray Diffraction Analysis of Aluminum Hexamolybdenocobaltate(III) and Hexamolybdenocromate(III) Russian Journal of Coordination Chemistry, 2002, 28, 384-388 |
| 1567270 | CIF | Al Cr H38 Mo6 O40 | P -1 | 6.838; 11.312; 11.605 101.29; 97.13; 102.15 | 847.7 | Kaziev, G. Z.; Quinones, Saul O.; Bel'skii, V. K.; Zavodnik, V. I.; Osminkina, I. V.; De Ita, Antonio X-Ray Diffraction Analysis of Aluminum Hexamolybdenocobaltate(III) and Hexamolybdenocromate(III) Russian Journal of Coordination Chemistry, 2002, 28, 384-388 |
| 1567271 | CIF | Bi O6 W | P c a 21 | 5.4718; 16.3253; 5.4616 90; 90; 90 | 487.88 | Pedanekar, R S.; Madake, S B.; Narewadikar, N A.; Mohite, S V.; Patil, A R.; Kumbhar, S M.; Rajpure, K Y. Photoelectrocatalytic degradation of rhodamine B by spray deposited Bi2WO6 photoelectrode under solar radiation Materials Research Bulletin, 2022, 147, 111639 |
| 1567272 | CIF | D2 O | A 1 2/a 1 | 9.19256; 7.52147; 10.31017 90; 109.317; 90 | 672.728 | Salzmann, C. G.; Rosu-Finsen, A.; Sharif, Z.; Radaelli, P.G.; Finney, J. L. Detailed crystallographic analysis of the ice V to ice XIII hydrogen-ordering phase transition The Journal of Chemical Physics, 2021, 154, 134504 |
| 1567273 | CIF | D2 O | P 1 21/a 1 | 9.24033; 7.46235; 10.29166 90; 109.768; 90 | 667.839 | Salzmann, C. G.; Rosu-Finsen, A.; Sharif, Z.; Radaelli, P.G.; Finney, J. L. Detailed crystallographic analysis of the ice V to ice XIII hydrogen-ordering phase transition The Journal of Chemical Physics, 2021, 154, 134504 |
| 1567274 | CIF | C19 H15 F2 N O | P 1 | 5.5106; 7.7117; 9.6692 70.09; 86.972; 85.438 | 384.97 | Liu, Zhen; Wei, Yin; Shi, Min A concise method for cyclic gem-difluoroacyl scaffolds via visible-light-mediated redox-neutral cascade radical cyclization of alkenes Catalysis Science & Technology, 2022, 12, 5325-5331 |
| 1567275 | CIF | C17 H17 F2 N O | P 1 21/n 1 | 11.9237; 10.5309; 12.4165 90; 114.482; 90 | 1418.93 | Liu, Zhen; Wei, Yin; Shi, Min A concise method for cyclic gem-difluoroacyl scaffolds via visible-light-mediated redox-neutral cascade radical cyclization of alkenes Catalysis Science & Technology, 2022, 12, 5325-5331 |
| 1567276 | CIF | C232 H122 F16 N20 O48 S5 Y12 | C m m m | 40.568; 41.959; 19.6114 90; 90; 90 | 33382 | Xia, Hai-Lun; Zhou, Kang; Guo, Jiandong; Zhang, Jian; Huang, Xiaoxi; Luo, Dawei; Liu, Xiao-Yuan; Li, Jing Amino group induced structural diversity and near-infrared emission of yttrium-tetracarboxylate frameworks Chemical Science, 2022, 13, 9321-9328 |
| 1567277 | CIF | C47.48 H22.51 F4 N3 O12.97 S Y3 | C m m m | 21.358; 35.038; 20.494 90; 90; 90 | 15337 | Xia, Hai-Lun; Zhou, Kang; Guo, Jiandong; Zhang, Jian; Huang, Xiaoxi; Luo, Dawei; Liu, Xiao-Yuan; Li, Jing Amino group induced structural diversity and near-infrared emission of yttrium-tetracarboxylate frameworks Chemical Science, 2022, 13, 9321-9328 |
| 1567278 | CIF | C35 H52 O10 | P n a 21 | 10.4486; 8.0259; 41.6406 90; 90; 90 | 3491.96 | Ide, Yuki; Manabe, Yumehiro; Inaba, Yuya; Kinoshita, Yusuke; Pirillo, Jenny; Hijikata, Yuh; Yoneda, Tomoki; Shivakumar, Kilingaru I.; Tanaka, Saki; Asakawa, Hitoshi; Inokuma, Yasuhide Determination of the critical chain length for macromolecular crystallization using structurally flexible polyketones Chemical Science, 2022 |
| 1567279 | CIF | C42 H62 O12 | I b a 2 | 48.93; 8.2077; 10.3345 90; 90; 90 | 4150.4 | Ide, Yuki; Manabe, Yumehiro; Inaba, Yuya; Kinoshita, Yusuke; Pirillo, Jenny; Hijikata, Yuh; Yoneda, Tomoki; Shivakumar, Kilingaru I.; Tanaka, Saki; Asakawa, Hitoshi; Inokuma, Yasuhide Determination of the critical chain length for macromolecular crystallization using structurally flexible polyketones Chemical Science, 2022 |
| 1567280 | CIF | C30 H32.5 F1.5 N4 O5 | P 1 21/c 1 | 9.5344; 23.7071; 24.8206 90; 99.04; 90 | 5540.6 | Hazari, Amaruka; Sawaya, Michael R.; Vlahakis, Niko; Johnstone, Timothy C.; Boyer, David; Rodriguez, Jose; Eisenberg, David; Raskatov, Jevgenij A. The rippled β-sheet layer configuration—a novel supramolecular architecture based on predictions by Pauling and Corey Chemical Science, 2022 |
| 1567281 | CIF | C35 H25 N3 O S2 | P 1 21/c 1 | 5.737; 19.159; 24.68 90; 96.66; 90 | 2694 | Barman, Debasish; Annadhasan, Mari; Chandrasekar, Rajadurai; Iyer, Parameswar Krishnan Hot-exciton harvesting via through-space single-molecule based white-light emission and optical waveguides Chemical Science, 2022 |
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