Crystallography Open Database
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Searching year of publication is 2018
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1549538 | CIF | C23 H33 B Br N O6 | P 21 21 21 | 10.0308; 12.6903; 19.943 90; 90; 90 | 2538.6 | Chen, Lili; Shen, Jun-Jian; Gao, Qian; Xu, Senmiao Synthesis of cyclic chiral α-amino boronates by copper-catalyzed asymmetric dearomative borylation of indoles. Chemical science, 2018, 9, 5855-5859 |
| 1549543 | CIF | C60 H48 N4 O4 | P -1 | 12.0014; 13.0411; 17.0476 88.379; 81.381; 74.642 | 2543.6 | Zhang, Hao; Wu, Yongzhen; Zhang, Weiwei; Li, Erpeng; Shen, Chao; Jiang, Huiyun; Tian, He; Zhu, Wei-Hong Low cost and stable quinoxaline-based hole-transporting materials with a D-A-D molecular configuration for efficient perovskite solar cells. Chemical science, 2018, 9, 5919-5928 |
| 1549544 | CIF | C59 H50 Cl2 N4 O4 S2 | P n a 21 | 25.387; 27.537; 21.8595 90; 90; 90 | 15282 | Zhang, Hao; Wu, Yongzhen; Zhang, Weiwei; Li, Erpeng; Shen, Chao; Jiang, Huiyun; Tian, He; Zhu, Wei-Hong Low cost and stable quinoxaline-based hole-transporting materials with a D-A-D molecular configuration for efficient perovskite solar cells. Chemical science, 2018, 9, 5919-5928 |
| 1549545 | CIF | C13 H13 N O5 S | P 21 21 21 | 4.9869; 11.7644; 22.1329 90; 90; 90 | 1298.49 | Aujard-Catot, Julien; Nguyen, Michel; Bijani, Christian; Pratviel, Geneviève; Bonduelle, Colin Cd2+ coordination: an efficient structuring switch for polypeptide polymers Polymer Chemistry, 2018, 9, 4100 |
| 1549553 | CIF | C4 H13 Cu O8 P | P b c a | 10.0717; 9.612; 21.809 90; 90; 90 | 2111.3 | Köferstein, Roberto; Arnold, Michael; Robl, Christian Crystal Structure and Characterization of Two Layered Copper(II) Coordination Polymers with Anions of 3-Phosphonopropionic Acid and (RS )-2-Phosphonobutyric Acid' Zeitschrift für anorganische und allgemeine Chemie, 2018, 644, 205 |
| 1549554 | CIF | C3 H9 Cu O7 P | P b c a | 8.1247; 9.19; 21.023 90; 90; 90 | 1569.7 | Köferstein, Roberto; Arnold, Michael; Robl, Christian Crystal Structure and Characterization of Two Layered Copper(II) Coordination Polymers with Anions of 3-Phosphonopropionic Acid and (RS )-2-Phosphonobutyric Acid' Zeitschrift für anorganische und allgemeine Chemie, 2018, 644, 205 |
| 1549555 | CIF | C19 H22 F3 N O3 S | P 21 21 21 | 9.1363; 13.549; 15.3864 90; 90; 90 | 1904.65 | Pan, Chongqing; Guo, Wenjing; Gu, Zhenhua Unusual biaryl torsional strain promotes reactivity in Cu-catalyzed Sommelet-Hauser rearrangement. Chemical science, 2018, 9, 5850-5854 |
| 1549556 | CIF | C23 H25 N O2 | P -1 | 8.5712; 9.5542; 12.0362 91.908; 103.104; 97.556 | 949.62 | Pan, Chongqing; Guo, Wenjing; Gu, Zhenhua Unusual biaryl torsional strain promotes reactivity in Cu-catalyzed Sommelet-Hauser rearrangement. Chemical science, 2018, 9, 5850-5854 |
| 1549557 | CIF | C17 H18 F3 N O3 S | P 21 21 21 | 8.0524; 10.279; 21.1646 90; 90; 90 | 1751.8 | Pan, Chongqing; Guo, Wenjing; Gu, Zhenhua Unusual biaryl torsional strain promotes reactivity in Cu-catalyzed Sommelet-Hauser rearrangement. Chemical science, 2018, 9, 5850-5854 |
| 1549558 | CIF | C17 H20 I2 In N O6 | P -1 | 8.5335; 8.9158; 15.6189 94.244; 92.845; 113.418 | 1083.39 | Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins. Chemical science, 2018, 9, 6041-6052 |
| 1549559 | CIF | C10 H8 I3 In O2 | P -1 | 7.2953; 10.6797; 10.9105 71.041; 73.634; 78.807 | 766.42 | Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins. Chemical science, 2018, 9, 6041-6052 |
| 1549560 | CIF | C16 H9 Cl O3 | P 21 21 21 | 3.8763; 12.0424; 26.146 90; 90; 90 | 1220.5 | Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins. Chemical science, 2018, 9, 6041-6052 |
| 1549561 | CIF | C9 H4 I N O4 | P -1 | 8.749; 9.0176; 12.167 92.712; 100.266; 92.8365 | 941.85 | Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins. Chemical science, 2018, 9, 6041-6052 |
| 1549562 | CIF HKL Paper | C5 H17 I N Na O5 | P -1 | 5.8131; 7.6682; 26.7168 90.221; 91.168; 91.44 | 1190.29 | Nazarenko, Alexander Y. Betaine (trimethylammonioacetate) binary compound with sodium iodide IUCrData, 2018, 3, x180864 |
| 1549563 | CIF HKL Paper | C19 H16 N4 O3 | P 1 21/c 1 | 37.0489; 13.3154; 6.917 90; 93.771; 90 | 3404.9 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M. (<i>E</i>)-1-[5-Methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-3-(4-nitrophenyl)prop-2-en-1-one IUCrData, 2018, 3, x180841 |
| 1549564 | CIF | C23 H30 N2 | P b c n | 15.5646; 7.8895; 15.9608 90; 90; 90 | 1959.9 | Walther, Patrick; Frey, Wolfgang; Naumann, Stefan Polarized olefins as enabling (co)catalysts for the polymerization of γ-butyrolactone Polymer Chemistry, 2018, 9, 3674 |
| 1549565 | CIF | C49 H46 Cl4 Os P2 Si | P 1 21/c 1 | 11.60758; 16.9798; 22.4892 90; 94.829; 90 | 4416.76 | Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen Facile synthesis of polycyclic metallaarynes. Chemical science, 2018, 9, 5994-5998 |
| 1549566 | CIF | C53 H48 Cl4 Os P2 Si | I 1 2 1 | 13.9889; 16.453; 21.3301 90; 97.273; 90 | 4869.82 | Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen Facile synthesis of polycyclic metallaarynes. Chemical science, 2018, 9, 5994-5998 |
| 1549567 | CIF | C55 H52 Cl8 Os P2 Si | P 1 21/m 1 | 11.4227; 17.2735; 13.9125 90; 102.838; 90 | 2676.46 | Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen Facile synthesis of polycyclic metallaarynes. Chemical science, 2018, 9, 5994-5998 |
| 1549568 | CIF | C36 H36 As Cl F6 N9 O6 S2 | P 1 21/c 1 | 14.2067; 15.9799; 18.6556 90; 94.05; 90 | 4224.6 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549569 | CIF | C37 H39 As F9 N9 O9 S3 | P 1 21/c 1 | 14.0065; 15.9167; 21.8331 90; 107.966; 90 | 4630.08 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549570 | CIF | C25 H19.5 N7.5 P | P 1 21/n 1 | 13.0553; 25.1646; 14.6359 90; 114.619; 90 | 4371.2 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549571 | CIF | C37 H39 F11 N9 O9 P S3 | P -1 | 13.753; 14.06; 14.321 109.504; 98.444; 111.998 | 2300 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549572 | CIF | C36 H39 F7 N9 O6 S2 Sb | P -1 | 13.1877; 13.3482; 13.4824 79.6653; 63.0215; 84.7868 | 2080.63 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549573 | CIF | C39 H42 F9 N10 O9 P S3 | P -1 | 10.8599; 10.9646; 20.3805 81.217; 83.234; 89.295 | 2381.6 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549574 | CIF | C38 H40.5 F9 N9.5 O9 S3 Sb | P -1 | 12.726; 18.899; 20.823 102.659; 97.475; 99.315 | 4750 | Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple. Chemical science, 2018, 9, 5837-5841 |
| 1549575 | CIF | C27 H28 N4 O2 | C 1 2/c 1 | 22.679; 10.176; 21.562 90; 94.879; 90 | 4958 | Zhang, Liang; Liu, Shuya; Zhao, Zhiguo; Su, Hongmei; Hao, Jingcheng; Wang, Yao (Salen)Mn(iii)-catalyzed chemoselective acylazidation of olefins. Chemical science, 2018, 9, 6085-6090 |
| 1549576 | CIF Paper | C14 H12 O3 | P 21 21 21 | 7.4539; 7.8553; 17.2286 90; 90; 90 | 1008.78 | Kotha, Sambasivarao; Cheekatla, Subba Rao; Gunta, Rama Hexacyclo[6.5.1.0^1,5^.0^5,12^.0^7,11^.0^9,13^]tetradecane-4,6,14-trione IUCrData, 2018, 3, x180852 |
| 1549577 | CIF | C23 H20 I4 N2 O | P -1 | 7.3405; 11.1063; 16.76 83.668; 77.493; 78.301 | 1303.08 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549578 | CIF | C23 H20 Br2 I2 N2 O | P -1 | 7.28; 10.9585; 16.0936 89.758; 79.735; 78.541 | 1237.53 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549579 | CIF | C24 H16 F7 I2 N3 O6 S2 | P -1 | 8.0582; 11.0044; 17.7067 99.618; 91.239; 104.624 | 1494.58 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549580 | CIF | C24 H16 F6 I2 N2 O6 S2 | P b c n | 22.337; 12.7364; 10.9081 90; 90; 90 | 3103.3 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549581 | CIF | C22 H16 Br2 F I2 N3 | P 1 21/c 1 | 10.9739; 17.8839; 12.1266 90; 102.951; 90 | 2319.4 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549582 | CIF | C36 H44 F I4 N3 | P 1 21/c 1 | 17.086; 18.092; 13.3174 90; 111.458; 90 | 3831.3 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549583 | CIF | C22 H16 Cl2 I2 N2 | P 1 21/c 1 | 9.1408; 18.1854; 13.7305 90; 100.82; 90 | 2241.83 | Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science, 2018, 9, 5828-5836 |
| 1549584 | CIF HKL Paper | C18 H16 N4 O2 | P 1 21/n 1 | 9.2366; 10.2045; 16.1922 90; 92.144; 90 | 1525.1 | Moussaif, Ahmed; Ramli, Youssef; El Ghayati, Lhoussaine; Essassi, El Mokhtar; Mague, Joel T. Ethyl 5-(4-methylphenyl)-2,4,5,7-tetraazatricyclo[6.4.0.0^2,6^]dodeca-1(8),3,6,9,11-pentaene-3-carboxylate IUCrData, 2018, 3, x180892 |
| 1549585 | CIF HKL Paper | C11 H14 N2 O5 | P 1 21/n 1 | 7.7306; 16.8048; 9.3113 90; 102.001; 90 | 1183.2 | Missioui, Mohcine; El Fal, Mohammed; Taoufik, Jamal; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef 2-(3-Methyl-2-oxo-1,2-dihydroquinoxalin-1-yl)acetic acid dihydrate IUCrData, 2018, 3, x180882 |
| 1549586 | CIF HKL Paper | C17 H13 Cl O3 S | P 1 21/c 1 | 13.1301; 11.9592; 10.3738 90; 112.041; 90 | 1509.9 | Piontek, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz 4-Chloronaphthalen-1-yl 4-methylbenzenesulfonate IUCrData, 2018, 3, x180889 |
| 1549587 | CIF HKL Paper | C24 H20 O6 S2 | P 1 21/n 1 | 12.227; 5.7229; 15.9353 90; 109.869; 90 | 1048.68 | Piontek, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz Naphthalene-2,6-diyl bis(4-methylbenzenesulfonate) IUCrData, 2018, 3, x180890 |
| 1549588 | CIF | C17 H16 O2 Se | P 1 | 6.7562; 7.5182; 8.7692 107.83; 98.976; 113.06 | 370.28 | García-López, Diego; Civit, Marc G.; Vogels, Christopher M.; Ricart, Josep M.; Westcott, Stephen A.; Fernández, Elena; Carbó, Jorge J. Understanding the mechanism of transition metal-free anti addition to alkynes: the selenoboration case Catalysis Science & Technology, 2018, 8, 3617 |
| 1549589 | CIF | C15 H23 Br2 Co N3 O2 | P 1 21/n 1 | 10.2514; 14.6308; 12.6552 90; 92.105; 90 | 1896.82 | Midya, Siba P.; Pitchaimani, Jayaraman; Landge, Vinod G.; Madhu, Vedichi; Balaraman, Ekambaram Direct access toN-alkylated amines and iminesviaacceptorless dehydrogenative coupling catalyzed by a cobalt(ii)-NNN pincer complex Catalysis Science & Technology, 2018, 8, 3469 |
| 1549590 | CIF | C15 H29 B2 Cl2 Co F8 N5 O | P -1 | 6.838; 13.077; 13.377 89.44; 78.44; 82.78 | 1162.5 | Midya, Siba P.; Pitchaimani, Jayaraman; Landge, Vinod G.; Madhu, Vedichi; Balaraman, Ekambaram Direct access toN-alkylated amines and iminesviaacceptorless dehydrogenative coupling catalyzed by a cobalt(ii)-NNN pincer complex Catalysis Science & Technology, 2018, 8, 3469 |
| 1549591 | CIF | C32 H27 Cl3 N2 O7 S | P 1 21 1 | 10.664; 10.372; 14.789 90; 104.778; 90 | 1581.7 | Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts. Chemical science, 2018, 9, 6361-6367 |
| 1549592 | CIF | C15 H16 Br N O5 | P 1 21 1 | 5.8577; 14.389; 9.621 90; 94.654; 90 | 808.2 | Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts. Chemical science, 2018, 9, 6361-6367 |
| 1549593 | CIF | C67 H60 Cl2 N2 O8 P2 | P 21 21 21 | 11.4778; 13.6448; 36.849 90; 90; 90 | 5771 | Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts. Chemical science, 2018, 9, 6361-6367 |
| 1549594 | CIF | C47 H56 O8 P2 | P -1 | 12.7831; 14.6459; 14.8 116.231; 101.896; 102.26 | 2282.2 | Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts. Chemical science, 2018, 9, 6361-6367 |
| 1549595 | CIF | C26 H27 F N2 O4 | P -1 | 7.8572; 10.5461; 14.099 70.648; 88.911; 85.089 | 1098.2 | Mori, Keiji; Umehara, Nobuaki; Akiyama, Takahiko Highly diastereoselective synthesis of tricyclic fused-pyrans by sequential hydride shift mediated double C(sp<sup>3</sup>)-H bond functionalization. Chemical science, 2018, 9, 7327-7331 |
| 1549596 | CIF | C26 H28 N2 O4 | P -1 | 7.945; 10.546; 14.045 70.523; 88.065; 83.805 | 1103 | Mori, Keiji; Umehara, Nobuaki; Akiyama, Takahiko Highly diastereoselective synthesis of tricyclic fused-pyrans by sequential hydride shift mediated double C(sp<sup>3</sup>)-H bond functionalization. Chemical science, 2018, 9, 7327-7331 |
| 1549597 | CIF | C26 H28 N2 O4 | P 1 21/n 1 | 7.6953; 15.2435; 18.799 90; 97.426; 90 | 2186.7 | Mori, Keiji; Umehara, Nobuaki; Akiyama, Takahiko Highly diastereoselective synthesis of tricyclic fused-pyrans by sequential hydride shift mediated double C(sp<sup>3</sup>)-H bond functionalization. Chemical science, 2018, 9, 7327-7331 |
| 1549598 | CIF Paper | Al4.857 O9.571 Si1.143 | P b a m | 7.5787; 7.6707; 2.8836 90; 90; 90 | 167.635 | Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon Exploiting superspace to clarify vacancy and Al/Si ordering in mullite IUCrJ, 2018, 5 |
| 1549599 | CIF Paper | Al4.832 O9.584 Si1.168 | P b a m | 7.577; 7.6727; 2.8804 90; 90; 90 | 167.46 | Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon Exploiting superspace to clarify vacancy and Al/Si ordering in mullite IUCrJ, 2018, 5 |
| 1549600 | CIF Paper | Al4.868 O9.566 Si1.132 | P b a m | 7.5768; 7.676; 2.8833 90; 90; 90 | 167.69 | Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon Exploiting superspace to clarify vacancy and Al/Si ordering in mullite IUCrJ, 2018, 5 |
| 1549601 | CIF Paper | Al4.853 O9.574 Si1.147 | P b a m | 7.577; 7.6738; 2.8823 90; 90; 90 | 167.59 | Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon Exploiting superspace to clarify vacancy and Al/Si ordering in mullite IUCrJ, 2018, 5 |
| 1549602 | CIF | C52 H24 F16 I4 N4 | P 1 21/c 1 | 13.0184; 9.7153; 19.986 90; 104.649; 90 | 2445.6 | Sinnwell, Michael A.; Blad, Jared N.; Thomas, Logan R.; MacGillivray, Leonard R. Structural flexibility of halogen bonds showed in a single-crystal-to-single-crystal [2+2] photodimerization IUCrJ, 2018, 5 |
| 1549603 | CIF | C52 H24 F16 I4 N4 | P 1 21/c 1 | 12.9647; 10.2219; 19.519 90; 109.387; 90 | 2440.1 | Sinnwell, Michael A.; Blad, Jared N.; Thomas, Logan R.; MacGillivray, Leonard R. Structural flexibility of halogen bonds showed in a single-crystal-to-single-crystal [2+2] photodimerization IUCrJ, 2018, 5 |
| 1549604 | CIF HKL Paper | C45 H39 F6 Fe O4 P3 | P 1 21/n 1 | 9.10074; 17.7897; 24.9408 90; 97.7826; 90 | 4000.71 | Ma, Yuzhi; Lindeman, Sergey; Donaldson, William A. Dicarbonyl{[(<i>E</i>,<i>E</i>)-(2,3,4,5-η)-6-methoxy-6-oxo-2,4-hexadienyl]triphenylphosphonium}(triphenylphosphane-κ<i>P</i>)iron(1+) hexafluoridophosphate IUCrData, 2018, 3, x180902 |
| 1549605 | CIF HKL Paper | C12 H21 N O3 S | P 1 21/c 1 | 11.737; 8.8719; 14.3722 90; 106.616; 90 | 1434.1 | Seye, Dame; Diop, Cheikh Abdoul Khadir; Diop, Libasse; Geiger, David K. Diisopropylammonium benzenesulfonate IUCrData, 2018, 3, x180876 |
| 1549606 | CIF HKL Paper | C28 H30 Mo N2 O4 P2 | P b c a | 15.634; 17.716; 21.661 90; 90; 90 | 5999 | Höhne, Martha; Gongoll, Marc; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe Tetracarbonyl[<i>N</i>-(diphenylphosphanyl-κ<i>P</i>)-<i>N</i>,<i>N</i>'-diisopropyl-<i>P</i>-phenylphosphorus diamide-κ<i>P</i>]molybdenum(0) with an unknown solvent IUCrData, 2018, 3, x180846 |
| 1549607 | CIF HKL Paper | C19 H13 F3 N4 | P 1 21/c 1 | 15.0553; 15.7338; 6.9701 90; 99.54; 90 | 1628.2 | El Hafi, Mohamed; Boulhaoua, Mohammed; Lahmidi, Sanae; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-Methyl-4-phenyl-3-[4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine IUCrData, 2018, 3, x180875 |
| 1549608 | CIF HKL Paper | C12 H15 N O4 S | P 1 21/c 1 | 8.834; 18.6849; 7.6927 90; 91.478; 90 | 1269.35 | Baryala, Yamna; El Bakri, Youness; Anouar, El Hassane; Zerzouf, Abdelfettahb; Essassi, El Mokhtar; Mague, Joel T. Ethyl 3-methyl-1-oxo-4<i>H</i>-1,4-benzothiazine-2-carboxylate monohydrate IUCrData, 2018, 3, x180887 |
| 1549609 | CIF | C28 H18 Cu3 N10 O15 | C 1 2/c 1 | 31.977; 18.3536; 14.7633 90; 91.413; 90 | 8661.8 | Ahmad, Nazir; Younus, Hussein A.; Chughtai, Adeel H.; Van Hecke, Kristof; Khattak, Zafar A. K.; Gaoke, Zhang; Danish, Muhammad; Verpoort, Francis Synthesis of 2D MOF having potential for efficient dye adsorption and catalytic applications Catalysis Science & Technology, 2018, 8, 4010 |
| 1549610 | CIF | C51 H59 N2 Ni S | P 1 21/c 1 | 13.0333; 16.6343; 19.8726 90; 96.392; 90 | 4281.6 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction. Chemical science, 2018, 9, 6580-6588 |
| 1549611 | CIF | C55.66667 H72 N2 Ni S | P -1 | 12.686; 19.394; 30.321 88.294; 80.235; 81.137 | 7264 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction. Chemical science, 2018, 9, 6580-6588 |
| 1549612 | CIF | C102 H172 K2 N4 Ni2 O12 S2 | P 1 21/n 1 | 18.558; 16.822; 19.0552 90; 96.441; 90 | 5911.2 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction. Chemical science, 2018, 9, 6580-6588 |
| 1549613 | CIF | C53 H89 K N4 Ni O6 S | P 1 21/n 1 | 12.7125; 22.4934; 20.0532 90; 102.126; 90 | 5606.2 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction. Chemical science, 2018, 9, 6580-6588 |
| 1549614 | CIF | C56 H80 K N2 Ni O6 S | P -1 | 13.1937; 13.2978; 16.6951 88.621; 74.52; 88.213 | 2821.1 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction. Chemical science, 2018, 9, 6580-6588 |
| 1549615 | CIF | C108.5 H175 K2 N8 Ni2 O14 S2 | P -1 | 11.847; 13.438; 19.455 94.052; 95.344; 91.766 | 3073.9 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction. Chemical science, 2018, 9, 6580-6588 |
| 1549616 | CIF | C37 H23 N O | P 1 21/n 1 | 12.115; 11.1281; 19.686 90; 106.472; 90 | 2545.1 | Wang, Sha-Sha; Rong, Rong; Jin, Ling-Zhi; Yang, Shan-Shan; Li, Yin-Xiang; Zhang, He; Xiong, Yu-Wei; Sun, Li-Tao; Cao, Hong-Tao; Xie, Ling-Hai; Huang, Wei Variable segment roles: modulation of the packing modes, nanocrystal morphologies and optical emissions. Nanoscale, 2018, 10, 13310-13314 |
| 1549617 | CIF | C37 H23 N O | P 1 21/c 1 | 9.4322; 16.5755; 16.9196 90; 90.836; 90 | 2645 | Wang, Sha-Sha; Rong, Rong; Jin, Ling-Zhi; Yang, Shan-Shan; Li, Yin-Xiang; Zhang, He; Xiong, Yu-Wei; Sun, Li-Tao; Cao, Hong-Tao; Xie, Ling-Hai; Huang, Wei Variable segment roles: modulation of the packing modes, nanocrystal morphologies and optical emissions. Nanoscale, 2018, 10, 13310-13314 |
| 1549618 | CIF | C37 H23 N O | P -1 | 8.581; 9.167; 17.575 89.893; 79.223; 70.216 | 1275.1 | Wang, Sha-Sha; Rong, Rong; Jin, Ling-Zhi; Yang, Shan-Shan; Li, Yin-Xiang; Zhang, He; Xiong, Yu-Wei; Sun, Li-Tao; Cao, Hong-Tao; Xie, Ling-Hai; Huang, Wei Variable segment roles: modulation of the packing modes, nanocrystal morphologies and optical emissions. Nanoscale, 2018, 10, 13310-13314 |
| 1549619 | CIF | C24 H23 I N2 O3 | P 21 21 21 | 6.8489; 15.7645; 19.4642 90; 90; 90 | 2101.54 | Meazza, Marta; Kamlar, Martin; Jašíková, Lucie; Formánek, Bedřich; Mazzanti, Andrea; Roithová, Jana; Veselý, Jan; Rios, Ramon Synergistic formal ring contraction for the enantioselective synthesis of spiropyrazolones. Chemical science, 2018, 9, 6368-6373 |
| 1549620 | CIF | C18 H19 N O5 S | P 21 21 21 | 19.1685; 5.7871; 14.8903 90; 90; 90 | 1651.78 | Li, Wei; Wollenburg, Marco; Glorius, Frank Enantioselective synthesis of 2-oxazolidinones by ruthenium(ii)-NHC-catalysed asymmetric hydrogenation of 2-oxazolones. Chemical science, 2018, 9, 6260-6263 |
| 1549621 | CIF | C33 H22 N4 O | P 1 21/c 1 | 9.3334; 19.56; 13.636 90; 94.259; 90 | 2482.5 | Ni, Fan; Zhu, Zece; Tong, Xiao; Xie, Mingjuan; Zhao, Qiang; Zhong, Cheng; Zou, Yang; Yang, Chuluo Organic emitter integrating aggregation-induced delayed fluorescence and room-temperature phosphorescence characteristics, and its application in time-resolved luminescence imaging. Chemical science, 2018, 9, 6150-6155 |
| 1549622 | CIF | C66 H44 N10 O8 Zn | P 1 21/c 1 | 13.3069; 18.6034; 27.4104 90; 102.321; 90 | 6629.3 | Ni, Fan; Zhu, Zece; Tong, Xiao; Xie, Mingjuan; Zhao, Qiang; Zhong, Cheng; Zou, Yang; Yang, Chuluo Organic emitter integrating aggregation-induced delayed fluorescence and room-temperature phosphorescence characteristics, and its application in time-resolved luminescence imaging. Chemical science, 2018, 9, 6150-6155 |
| 1549623 | CIF | C33 H22 N6 O7 Zn | P -1 | 10.4399; 11.3331; 13.2139 100.001; 99.774; 99.056 | 1488.9 | Ni, Fan; Zhu, Zece; Tong, Xiao; Xie, Mingjuan; Zhao, Qiang; Zhong, Cheng; Zou, Yang; Yang, Chuluo Organic emitter integrating aggregation-induced delayed fluorescence and room-temperature phosphorescence characteristics, and its application in time-resolved luminescence imaging. Chemical science, 2018, 9, 6150-6155 |
| 1549624 | CIF | C30 H30 Cl0 N8 O0 S2 Zn | P 1 21/c 1 | 16.408; 8.6188; 21.365 90; 97.571; 90 | 2995 | Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action. Toxicology research, 2018, 7, 987-993 |
| 1549625 | CIF | C30 H30 Ga N9 O3 S2 | P 1 21/n 1 | 18.441; 8.936; 21.809 90; 94.29; 90 | 3583.81 | Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action. Toxicology research, 2018, 7, 987-993 |
| 1549626 | CIF | C30 H30 Cd Cl0 N8 O0 S2 | C 1 2/c 1 | 16.9715; 23.6235; 15.9881 90; 102.867; 90 | 6249.1 | Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action. Toxicology research, 2018, 7, 987-993 |
| 1549627 | CIF | C29 H28 N4 O2 S Sn | P 1 21/c 1 | 17.15; 10.549; 16.45 90; 101.78; 90 | 2913 | Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action. Toxicology research, 2018, 7, 987-993 |
| 1549628 | CIF HKL Paper | C14 H16 N2 Na O10 Rb S2 | P n m a | 14.2754; 6.5831; 21.5365 90; 90; 90 | 2023.9 | Nazarenko, Alexander Y. Sodium rubidium disaccharinate tetrahydrate IUCrData, 2018, 3, x180867 |
| 1549629 | CIF | C48 H86 B Fe K2 N2 O6 P3 | P 1 n 1 | 12.8973; 12.5342; 17.2106 90; 98.668; 90 | 2750.4 | Deegan, Meaghan M.; Peters, Jonas C. Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes. Chemical science, 2018, 9, 6264-6270 |
| 1549630 | CIF | C64 H95 B Fe K N2 O10 P3 | P 1 21/c 1 | 11.3464; 35.5398; 15.8541 90; 90.839; 90 | 6392.5 | Deegan, Meaghan M.; Peters, Jonas C. Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes. Chemical science, 2018, 9, 6264-6270 |
| 1549631 | CIF | C47 H81 B Fe N3 P3 Si2 | P b c a | 11.3085; 24.2407; 37.5101 90; 90; 90 | 10282.5 | Deegan, Meaghan M.; Peters, Jonas C. Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes. Chemical science, 2018, 9, 6264-6270 |
| 1549632 | CIF | C49 H85 B Fe K N2 O P3 Si | P -1 | 12.4653; 13.091; 21.997 97.411; 95.734; 117.826 | 3095 | Deegan, Meaghan M.; Peters, Jonas C. Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes. Chemical science, 2018, 9, 6264-6270 |
| 1549633 | CIF | C79.22 H90.92 B2 F24 Fe N P3 | P 1 21/c 1 | 27.577; 15.5573; 38.526 90; 100.863; 90 | 16232 | Deegan, Meaghan M.; Peters, Jonas C. Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes. Chemical science, 2018, 9, 6264-6270 |
| 1549634 | CIF | C14 H21 B10 N | P 1 21/c 1 | 7.8295; 25.776; 11.1821 90; 128.014; 90 | 1778 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles. Chemical science, 2018, 9, 6390-6394 |
| 1549635 | CIF | C14 H24 B10 Cl N O | P 1 21/n 1 | 11.4617; 7.484; 23.7344 90; 96.0865; 90 | 2024.45 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles. Chemical science, 2018, 9, 6390-6394 |
| 1549636 | CIF | C18 H22 B10 N | A m a 2 | 7.224; 24.584; 11.2382 90; 90; 90 | 1995.85 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles. Chemical science, 2018, 9, 6390-6394 |
| 1549637 | CIF | C30 H21.45 Cl O0.22 Si | R -3 | 17.2923; 17.2923; 13.9863 90; 90; 120 | 3621.9 | Zipse, Hendrik; Marin-Luna, Marta; Poelloth, Benjamin; Zott, Fabian L. Size-Dependent Rate Acceleration in the Silylation of Secondary Alcohols: the Bigger the Faster Chemical Science, 2018 |
| 1549638 | CIF | C34 H34 O Si | P 1 21/c 1 | 10.8826; 34.7232; 7.28 90; 104.291; 90 | 2665.83 | Zipse, Hendrik; Marin-Luna, Marta; Poelloth, Benjamin; Zott, Fabian L. Size-Dependent Rate Acceleration in the Silylation of Secondary Alcohols: the Bigger the Faster Chemical Science, 2018 |
| 1549640 | CIF | C49 H48 Br N O3 | P 21 21 21 | 10.118; 14.0353; 28.194 90; 90; 90 | 4003.8 | Santra, Surojit; Porey, Arka; Jana, Barun; Guin, Joyram N-Heterocyclic carbenes as chiral Brønsted base catalysts: a highly diastereo- and enantioselective 1,6-addition reaction. Chemical science, 2018, 9, 6446-6450 |
| 1549641 | CIF | C35 H40 N2 O4 | P 1 21 1 | 14.151; 14.717; 16.184 90; 111.316; 90 | 3139.9 | Santra, Surojit; Porey, Arka; Jana, Barun; Guin, Joyram N-Heterocyclic carbenes as chiral Brønsted base catalysts: a highly diastereo- and enantioselective 1,6-addition reaction. Chemical science, 2018, 9, 6446-6450 |
| 1549642 | CIF | C36 H43 N2 O6 S | P 1 21 1 | 11.571; 25.09; 11.915 90; 90; 90 | 3459.1 | Santra, Surojit; Porey, Arka; Jana, Barun; Guin, Joyram N-Heterocyclic carbenes as chiral Brønsted base catalysts: a highly diastereo- and enantioselective 1,6-addition reaction. Chemical science, 2018, 9, 6446-6450 |
| 1549643 | CIF | C138 H132 Dy10 N32 O54 P4 | P 1 21/c 1 | 24.731; 14.057; 25.496 90; 112.797; 90 | 8171 | Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate. Chemical science, 2018, 9, 6424-6433 |
| 1549644 | CIF | C134 H148 Dy10 N32 O66 P4 | P 1 21/c 1 | 24.653; 14.5645; 26.067 90; 112.969; 90 | 8617.5 | Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate. Chemical science, 2018, 9, 6424-6433 |
| 1549645 | CIF | C134 H148 Dy10 N32 O66 P4 | P 1 21/c 1 | 24.6145; 14.5657; 26.0805 90; 112.968; 90 | 8609.3 | Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate. Chemical science, 2018, 9, 6424-6433 |
| 1549646 | CIF | C134 H112 Dy10 N32 O50 P4 | P 1 21/c 1 | 25.525; 14.312; 25.318 90; 111.413; 90 | 8611 | Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate. Chemical science, 2018, 9, 6424-6433 |
| 1549647 | CIF | C140 H132 Cl6 Dy10 N32 O52 P4 | R 3 2 :H | 26.7135; 26.7135; 71.325 90; 90; 120 | 44079 | Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate. Chemical science, 2018, 9, 6424-6433 |
| 1549648 | CIF | C70 H120 Cu13 F6 N6 O8 P S12 | C 1 2/c 1 | 33.833; 18.7022; 36.604 90; 111.908; 90 | 21489 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549649 | CIF | C70 H120 Cu12 N6 O8 S13 | P 21 21 21 | 18.2449; 23.218; 23.3841 90; 90; 90 | 9905.7 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549650 | CIF | C85 H102 Cl0.7 Cu12.3 F30 N6 O P S12 | P n n a | 21.8103; 22.977; 22.0395 90; 90; 90 | 11044.8 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549651 | CIF | C87.5 H131 Cl Cu12 F6 N6 O0.5 P S12 | P -1 | 17.6501; 19.8146; 32.8484 86.5157; 89.7691; 75.775 | 11114.5 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549652 | CIF | C86 H128 Br Cu12 F6 N6 P S12 | P -1 | 17.7551; 19.6625; 32.767 85.8425; 85.698; 76.1094 | 11055.9 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549653 | CIF | C132 H234 Cl5 Cu24 F6 N12 O12 P S24 | C 1 2/c 1 | 31.396; 19.8294; 33.181 90; 97.8261; 90 | 20465 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549654 | CIF | C74 H128 Cu12 N6 O8 S13 | P 21 21 21 | 19.1023; 23.8001; 24.5421 90; 90; 90 | 11157.7 | Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster. Chemical science, 2018, 9, 6785-6795 |
| 1549655 | CIF | C52 H62 Fe N5 O4 S2 | P -1 | 10.175; 16.218; 16.588 84.402; 81.108; 76.3 | 2622.2 | Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S. Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity. Chemical science, 2018, 9, 6540-6547 |
| 1549656 | CIF | C62 H87 Co N6 O4.5 S2 | P 1 21/n 1 | 17.4061; 10.7648; 31.052 90; 91.3044; 90 | 5816.8 | Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S. Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity. Chemical science, 2018, 9, 6540-6547 |
| 1549657 | CIF | C50 H72 Ga N5 O6 S2 | P 1 21/c 1 | 16.1329; 27.6083; 13.2048 90; 105.613; 90 | 5664.4 | Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S. Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity. Chemical science, 2018, 9, 6540-6547 |
| 1549658 | CIF | C56 H70 Co N5 O5 S2 | P -1 | 18.006; 18.271; 18.568 110.972; 109.602; 95.477 | 5209.6 | Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S. Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity. Chemical science, 2018, 9, 6540-6547 |
| 1549659 | CIF | C59 H93 Fe N5 O6 S2 | P -1 | 9.4615; 18.3994; 18.765 107.605; 100.024; 93.8094 | 3041.4 | Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S. Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity. Chemical science, 2018, 9, 6540-6547 |
| 1549660 | CIF | C60 H82 Fe N6 O4 S2 | P -1 | 10.6709; 17.4933; 17.8715 113.478; 98.8759; 91.3574 | 3009.9 | Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S. Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity. Chemical science, 2018, 9, 6540-6547 |
| 1549663 | CIF | C22 H21 N O3 S | P -1 | 9.3819; 10.3076; 10.6318 90.7648; 114.212; 100.138 | 918.87 | Leitch, Jamie A.; Fuentes de Arriba, Angel L.; Tan, Joanne; Hoff, Oskar; Martínez, Carlos M; Dixon, Darren J. Photocatalytic reverse polarity Povarov reaction. Chemical science, 2018, 9, 6653-6658 |
| 1549664 | CIF HKL Paper | C21 H24 N2 O S | P 1 21/c 1 | 14.898; 14.878; 8.4007 90; 96.78; 90 | 1849 | Akrad, Rachida; Guerrab, Walid; Lazrak, Fatima; Ansar, Mhammed; Taoufik, Jamal; Mague, Joel T.; Ramli, Youssef 4,4-Diphenyl-1-propyl-2-propylsulfanyl-4,5-dihydro-1<i>H</i>-imidazol-5-one IUCrData, 2018, 3, x180934 |
| 1549665 | CIF HKL Paper | C15 H13 N3 | P 1 21/n 1 | 5.9642; 17.7004; 11.3963 90; 100.695; 90 | 1182.2 | El Ghayati, Lhoussaine; Ramli, Youssef; Moussaif, Ahmed; Koubachi, Jamal; Taha, Mohamed Labd; Essassi, El Mokhtar; Mague, Joel T. 2-Methyl-4-(pyridin-2-yl)-3<i>H</i>-1,5-benzodiazepine IUCrData, 2018, 3, x180953 |
| 1549666 | CIF HKL Paper | C17 H12 O4 | P 1 c 1 | 5.7029; 4.0346; 28.9081 90; 90.751; 90 | 665.09 | Djandé, Abdoulaye; Abou, Akoun; Kini, Félix; Kambo, Konan René; Giorgi, Michel 2-Oxo-2<i>H</i>-chromen-7-yl 4-methylbenzoate IUCrData, 2018, 3, x180927 |
| 1549667 | CIF HKL Paper | C16 H16 Cd2 O8 | P 1 21/n 1 | 9.8377; 7.07; 24.268 90; 100.12; 90 | 1661.6 | LaDuca, Andrew R.; LaDuca, Robert L. Poly[(μ5-cis-cyclohex-4-ene-1,2-dicarboxylato)(μ3-cis-cyclohex-4-ene-1,2-dicarboxylato)dicadmium(II)] IUCrData, 2018, 3 |
| 1549668 | CIF | C64 H48 Br2 N2 Ni | R 3 c :H | 33.739; 33.739; 26.116 90; 90; 120 | 25746 | Fang, Jun; Sui, Xuelin; Li, Yougui; Chen, Changle Synthesis of polyolefin elastomers from unsymmetrical α-diimine nickel catalyzed olefin polymerization Polymer Chemistry, 2018, 9, 4143 |
| 1549669 | CIF | C67 H54 Br2 Cl2 N2 Ni | P 1 21/c 1 | 17.9769; 12.1378; 29.0552 90; 116.588; 90 | 5669.4 | Fang, Jun; Sui, Xuelin; Li, Yougui; Chen, Changle Synthesis of polyolefin elastomers from unsymmetrical α-diimine nickel catalyzed olefin polymerization Polymer Chemistry, 2018, 9, 4143 |
| 1549670 | CIF | C16 H16 N2 O4 | P 1 21/n 1 | 10.3695; 6.0922; 11.4055 90; 98.355; 90 | 712.87 | Dolai, Malay; Saha, Urmila; Das, Avijit Kumar; Suresh Kumar, Gopinatha Single sensors for multiple analytes employing fluorometric differentiation for Cr3+ and Al3+ in semi-aqueous medium with bio-activity and theoretical aspects Analytical Methods, 2018, 10, 4063 |
| 1549671 | CIF | C110 H82 Cu4 N2 O24 | P -1 | 15.9653; 17.691; 18.2258 61.811; 88.11; 64.125 | 3983.8 | Craig, Gavin A.; Larpent, Patrick; Kusaka, Shinpei; Matsuda, Ryotaro; Kitagawa, Susumu; Furukawa, Shuhei Switchable gate-opening effect in metal-organic polyhedra assemblies through solution processing. Chemical science, 2018, 9, 6463-6469 |
| 1549672 | CIF | C152 H164 Cu4 O34 | P 1 21/n 1 | 18.5382; 25.36; 19.6509 90; 116.08; 90 | 8297.8 | Craig, Gavin A.; Larpent, Patrick; Kusaka, Shinpei; Matsuda, Ryotaro; Kitagawa, Susumu; Furukawa, Shuhei Switchable gate-opening effect in metal-organic polyhedra assemblies through solution processing. Chemical science, 2018, 9, 6463-6469 |
| 1549673 | CIF | C108.67 H59 N O24 Rh4 | P -1 | 17.9146; 18.0902; 27.6891 77.345; 83.125; 61.947 | 7725.35 | Craig, Gavin A.; Larpent, Patrick; Kusaka, Shinpei; Matsuda, Ryotaro; Kitagawa, Susumu; Furukawa, Shuhei Switchable gate-opening effect in metal-organic polyhedra assemblies through solution processing. Chemical science, 2018, 9, 6463-6469 |
| 1549674 | CIF HKL Paper | C25 H20 N2 O5 | P -1 | 11.5219; 14.2321; 14.7033 72.201; 73.469; 73.647 | 2150.18 | Mahfoud, Asmae; Al Houari, Ghali; El Yazidi, Mohamed; Saadi, Mohamed; El Ammari, Lahcen 2-Methyl-3'-(4-methylphenyl)-4'-(2-nitrophenyl)-4'<i>H</i>-spiro[chroman-3,5'-isoxazol]-4-one IUCrData, 2018, 3, x180962 |
| 1549675 | CIF HKL Paper | C17 H13 N5 O | P c a 21 | 23.5234; 10.5928; 23.4895 90; 90; 90 | 5853.1 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M. 2-(5-Methyl-1-phenyl-1<i>H</i>-1,2,3-triazol-4-yl)-5-phenyl-1,3,4-oxadiazole IUCrData, 2018, 3, x180966 |
| 1549676 | CIF | C10 H24 N7 Ni O9 | C 1 2/c 1 | 12.8157; 8.8179; 15.3168 90; 106.818; 90 | 1656.88 | Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P. Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes. Chemical science, 2018, 9, 6564-6571 |
| 1549677 | CIF | C10 H26 Co0.9 N9 Ni0.1 O15 | P -1 | 7.371; 8.496; 9.08 89.163; 76.951; 81.894 | 548.3 | Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P. Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes. Chemical science, 2018, 9, 6564-6571 |
| 1549678 | CIF | C10 H26 N9 Ni O15 | P -1 | 7.4549; 9.0814; 16.935 88.505; 81.132; 76.008 | 1099.1 | Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P. Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes. Chemical science, 2018, 9, 6564-6571 |
| 1549679 | CIF | C12 H24 Cl N6 Ni O4 S2 | P -1 | 7.59; 8.72; 15.75 83.72; 81.37; 80.39 | 1012 | Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P. Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes. Chemical science, 2018, 9, 6564-6571 |
| 1549680 | CIF | C288 H378 Cd24 Cl8 N16 O82 P6 S24 | R -3 :H | 22.4712; 22.4712; 62.0494 90; 90; 120 | 27134.4 | Shi, Cheng; Zhang, Min; Hang, Xinxin; Bi, Yanfeng; Huang, Liangliang; Zhou, Kun; Xu, Zhenhe; Zheng, Zhiping Assembly of thiacalix[4]arene-supported high-nuclearity Cd24 cluster with enhanced photocatalytic activity. Nanoscale, 2018, 10, 14448-14454 |
| 1549681 | CIF | C88 H108 Cd4 N2 O11 S8 | C 1 2/c 1 | 32.799; 19.0653; 31.1251 90; 114.228; 90 | 17748.9 | Shi, Cheng; Zhang, Min; Hang, Xinxin; Bi, Yanfeng; Huang, Liangliang; Zhou, Kun; Xu, Zhenhe; Zheng, Zhiping Assembly of thiacalix[4]arene-supported high-nuclearity Cd24 cluster with enhanced photocatalytic activity. Nanoscale, 2018, 10, 14448-14454 |
| 1549682 | CIF | C72 H72 Cl9 N7 O8 | P 21 21 21 | 13.2969; 22.3943; 25.1034 90; 90; 90 | 7475.2 | Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers. Chemical science, 2018, 9, 6860-6870 |
| 1549683 | CIF | C53 H53 Cl3 N8 O5 | P 1 21 1 | 9.7198; 18.6592; 14.0802 90; 90.161; 90 | 2553.6 | Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers. Chemical science, 2018, 9, 6860-6870 |
| 1549684 | CIF | C72 H87.5 N8 O11.75 | P 1 21 1 | 15.5782; 18.4753; 24.4315 90; 91.976; 90 | 7027.5 | Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers. Chemical science, 2018, 9, 6860-6870 |
| 1549685 | CIF | C70.79 H77.17 N7 O10.4 | P 21 21 21 | 22.0413; 23.2593; 25.4959 90; 90; 90 | 13070.9 | Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers. Chemical science, 2018, 9, 6860-6870 |
| 1549686 | CIF | C70.57 H83.27 N7 O9.57 | P 21 21 21 | 10.5967; 21.5835; 28.6986 90; 90; 90 | 6563.8 | Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers. Chemical science, 2018, 9, 6860-6870 |
| 1549687 | CIF | C26 H17 Br2 N3 | P c a 21 | 25.043; 10.3564; 8.256 90; 90; 90 | 2141.2 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549688 | CIF | C81 H67 Cl3 N10 O4 | P -1 | 14.7058; 15.449; 16.6352 90.453; 101.803; 113.116 | 3386 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549689 | CIF | C40 H33 N5 | P 1 21/n 1 | 10.1411; 25.4006; 12.1107 90; 94.978; 90 | 3107.8 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549690 | CIF | C47.5 H49 Cl N5 | C 1 2/c 1 | 21.584; 14.4183; 25.314 90; 94.247; 90 | 7856.2 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549691 | CIF | C52 H45 N5 O2 | P -1 | 11.495; 11.813; 16.576 90.499; 110.07; 105.303 | 2026.9 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549692 | CIF | C85 H52 Cl2 F24 N10 | P -1 | 12.9577; 14.3835; 20.7824 88.275; 83.194; 84.955 | 3830.41 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549693 | CIF | C43 H34 F6 N5 | P 1 21/c 1 | 20.794; 13.875; 25.322 90; 102.958; 90 | 7120 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549694 | CIF | C40 H37 N5 O2 | P 1 21/c 1 | 18.523; 9.319; 19.109 90; 95.74; 90 | 3282 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549695 | CIF | C44 H41 N5 | P -1 | 12.176; 12.713; 13.64 99.304; 104.311; 115.26 | 1762 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549696 | CIF | C33.5 H26 Br N4 O0.5 | C 1 2/c 1 | 13.751; 15.095; 26.536 90; 100.513; 90 | 5416 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549697 | CIF | C40 H27 F6 N5 | P -1 | 13.025; 14.1499; 18.8806 87.297; 73.304; 82.748 | 3306.2 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549698 | CIF | C79.98 H59 Cl3 N10 | R -3 | 50.519; 50.519; 13.4259 90; 90; 120 | 29675 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549699 | CIF | C46 H33 N5 | P -1 | 6.5341; 12.836; 20.895 106.223; 90.002; 91.44 | 1682.1 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549700 | CIF | C252 H300 N20 | P b c a | 30.1086; 31.9945; 46.8128 90; 90; 90 | 45095.2 | Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins Chemical Science, 2018 |
| 1549701 | CIF | C34 H30 Cl N O | P 1 21/a 1 | 9.6998; 20.0864; 13.8561 90; 107.551; 90 | 2574 | Kuramoto, Yutaro; Nakagiri, Takanobu; Matsui, Yasunori; Ohta, Eisuke; Ogaki, Takuya; Ikeda, Hiroshi A leaning amine-ketone dyad with a nonconjugated linker: solvatofluorochromism and dual fluorescence associated with intramolecular charge transfer. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1157-1168 |
| 1549702 | CIF HKL Paper | C17 H18 N2 O2 S2 | P 1 21/n 1 | 7.3167; 15.5894; 15.5627 90; 101.82; 90 | 1737.49 | Aziz, Hamid; Saeed, Aamer; Simpson, Jim 5,5-Diphenyl-2-thioxoimidazolidin-4-one dimethyl sulfoxide monosolvate IUCrData, 2018, 3, x181010 |
| 1549703 | CIF HKL Paper | C15 H18 N2 O | P 1 21/c 1 | 11.4283; 9.2294; 12.3632 90; 96.89; 90 | 1294.6 | Al Garadi, Wedad; Ramli, Youssef; El Ghayati, Lhoussaine; Moussaif, Ahmed; Essassi, El Mokhtar; Mague, Joel T. 4-Phenyl-5a,6,7,8,9,9a-hexahydro-1<i>H</i>-1,5-benzodiazepin-2(5<i>H</i>)-one IUCrData, 2018, 3, x181011 |
| 1549704 | CIF | C14 H26 N O4 Sb | P b c a | 8.0941; 43.971; 8.3622 90; 90; 90 | 2976.2 | Moaven, Shiva; Yu, Jingze; Vega, Maythe; Unruh, Daniel K.; Cozzolino, Anthony F. Self-assembled reversed bilayers directed by pnictogen bonding to form vesicles in solution. Chemical communications (Cambridge, England), 2018, 54, 8849-8852 |
| 1549705 | CIF | C52 H60 B F24 Fe P4 | I -4 | 13.2989; 13.2989; 17.4417 90; 90; 90 | 3084.75 | Doyle, Laurence R.; Scott, Daniel J.; Hill, Peter J.; Fraser, Duncan A. X.; Myers, William K.; White, Andrew J. P.; Green, Jennifer C.; Ashley, Andrew E. Reversible coordination of N<sub>2</sub> and H<sub>2</sub> to a homoleptic <i>S</i> = 1/2 Fe(i) diphosphine complex in solution and the solid state. Chemical science, 2018, 9, 7362-7369 |
| 1549706 | CIF | C19 H18 N2 O | P 1 21/c 1 | 11.268; 16.335; 9.5163 90; 114.91; 90 | 1588.6 | Lv, Honggui; Xiao, Li-Jun; Zhao, Dongbing; Zhou, Qi-Lin Nickel(0)-catalyzed linear-selective hydroarylation of unactivated alkenes and styrenes with aryl boronic acids. Chemical science, 2018, 9, 6839-6843 |
| 1549707 | CIF | C47 H52 Fe N5 O6 P | P -1 | 12.7848; 13.0223; 13.1304 93.792; 92.468; 90.347 | 2179.2 | Hong, Seungwoo; Yan, James J.; Karmalkar, Deepika G.; Sutherlin, Kyle D.; Kim, Jin; Lee, Yong-Min; Goo, Yire; Mascharak, Pradip K.; Hedman, Britt; Hodgson, Keith O.; Karlin, Kenneth D.; Solomon, Edward I.; Nam, Wonwoo A mononuclear nonheme {FeNO}<sup>6</sup> complex: synthesis and structural and spectroscopic characterization. Chemical science, 2018, 9, 6952-6960 |
| 1549708 | CIF | C51 H94 Fe N7 O6 | P 1 21/c 1 | 18.404; 18.521; 17.725 90; 102.745; 90 | 5893 | Hong, Seungwoo; Yan, James J.; Karmalkar, Deepika G.; Sutherlin, Kyle D.; Kim, Jin; Lee, Yong-Min; Goo, Yire; Mascharak, Pradip K.; Hedman, Britt; Hodgson, Keith O.; Karlin, Kenneth D.; Solomon, Edward I.; Nam, Wonwoo A mononuclear nonheme {FeNO}<sup>6</sup> complex: synthesis and structural and spectroscopic characterization. Chemical science, 2018, 9, 6952-6960 |
| 1549709 | CIF | C39 H33 F12 N7 P2 Ru | P -1 | 11.0216; 14.4762; 14.5765 83.804; 85.851; 69.748 | 2167.64 | Al-Afyouni, Malik H; Rohrabaugh, Jr, Thomas N; Al-Afyouni, Kathlyn F; Turro, Claudia New Ru(ii) photocages operative with near-IR light: new platform for drug delivery in the PDT window. Chemical science, 2018, 9, 6711-6720 |
| 1549710 | CIF | C39 H29 F12 N7 P2 Ru | P -1 | 11.9502; 13.3979; 13.5014 82.904; 83.437; 79.213 | 2097.98 | Al-Afyouni, Malik H; Rohrabaugh, Jr, Thomas N; Al-Afyouni, Kathlyn F; Turro, Claudia New Ru(ii) photocages operative with near-IR light: new platform for drug delivery in the PDT window. Chemical science, 2018, 9, 6711-6720 |
| 1549711 | CIF | C30 H25 F3 N4 O2 P0.5 Ru | C 1 2/m 1 | 18.547; 23.5958; 17.833 90; 119.975; 90 | 6760.4 | Al-Afyouni, Malik H; Rohrabaugh, Jr, Thomas N; Al-Afyouni, Kathlyn F; Turro, Claudia New Ru(ii) photocages operative with near-IR light: new platform for drug delivery in the PDT window. Chemical science, 2018, 9, 6711-6720 |
| 1549712 | CIF | C40 H58 Cl N8 O8 | P -1 | 9.2108; 9.4525; 29.308 87.928; 83.132; 71.201 | 2398.2 | Chen, Xiao-Xiao; Liu, Qi; Guo, Yan; Yan, Hui; Li, Jing; Lv, Dong-Mei; Zhang, Jun-Hong; Liu, Min; Yao, Chun-Hong; Wei, Xi-Lian Effects of additives on the viscoelastic responses of cationic gemini surfactant solutions. Soft matter, 2018, 14, 6696-6707 |
| 1549713 | CIF | C42 H46 Mn0.5 N6 O14 S2 | P -1 | 9.7187; 11.2496; 21.8708 88.401; 83.848; 64.446 | 2144.39 | Fidalgo-Marijuan, Arkaitz; Amayuelas, Eder; Barandika, Gotzone; Larrea, Edurne S.; Bazán, Begoña; Urtiaga, Miren Karmele; Iglesias, Marta; Arriortua, María Isabel Double role of metalloporphyrins in catalytic bioinspired supramolecular metal‒organic frameworks (SMOFs) IUCrJ, 2018, 5 |
| 1549714 | CIF HKL Paper | C22 H15 N O2 S | P b c a | 9.265; 10.3523; 36.0698 90; 90; 90 | 3459.6 | Bakhouch, Mohamed; El Yazidi, Mohamed; Al Houari, Ghali; Saadi, Mohamed; El Ammari, Lahcen 3',4'-Diphenyl-3<i>H</i>,4'<i>H</i>-spiro[benzo[<i>b</i>]thiophene-2,5'-isoxazol]-3-one IUCrData, 2018, 3, x181019 |
| 1549715 | CIF | C86 H157 K2 Mn8 N O42 | P 1 21/n 1 | 18.998; 15.678; 20.236 90; 100.84; 90 | 5920 | Mousazade, Younes; Mohammadi, Mohammad Reza; Chernev, Petko; Bikas, Rahman; Bagheri, Robabeh; Song, Zhenlun; Lis, Tadeusz; Dau, Holger; Najafpour, Mohammad Mahdi Water oxidation by a manganese‒potassium cluster: Mn oxide as a kinetically dominant “true” catalyst for water oxidation Catalysis Science & Technology, 2018, 8, 4390 |
| 1549716 | CIF | C13 H18 N2 S | P 21 21 2 | 20.7206; 9.8606; 6.3486 90; 90; 90 | 1297.13 | Formica, Michele; Sorin, Geoffroy; Farley, Alistair J. M.; Díaz, Jesús; Paton, Robert S.; Dixon, Darren J. Bifunctional iminophosphorane catalysed enantioselective sulfa-Michael addition of alkyl thiols to alkenyl benzimidazoles. Chemical science, 2018, 9, 6969-6974 |
| 1549717 | CIF | C39.5 H48.9 N6.5 O16.2 Zn2 | C 1 2/c 1 | 25.386; 25.15; 17.6282 90; 114.178; 90 | 10268 | Zhang, Yiwen; Su, Kongzhao; Hao, Miao; Liu, Lin; Han, Zheng-Bo; Yuan, Daqiang Two metal‒organic frameworks based on pyridyl‒tricarboxylate ligands as size-selective catalysts for solvent-free cyanosilylation reaction CrystEngComm, 2018, 20, 6070 |
| 1549718 | CIF | C42.15 H54.35 Cd2 N6.05 O16.05 | C 1 2/c 1 | 26.4534; 24.3372; 17.6488 90; 109.622; 90 | 10702.5 | Zhang, Yiwen; Su, Kongzhao; Hao, Miao; Liu, Lin; Han, Zheng-Bo; Yuan, Daqiang Two metal‒organic frameworks based on pyridyl‒tricarboxylate ligands as size-selective catalysts for solvent-free cyanosilylation reaction CrystEngComm, 2018, 20, 6070 |
| 1549719 | CIF | C24 H19 N O9 | P 1 21/c 1 | 9.662; 15.701; 14.746 90; 94.165; 90 | 2231.1 | Mal, Kajal; Naskar, Barnali; Mondal, Animesh; Goswami, Sanchita; Prodhan, Chandraday; Chaudhuri, Keya; Mukhopadhyay, Chhanda Dihydroindeno[1,2-b]pyrroles: new Al<sup>3+</sup> selective off-on chemosensors for bio-imaging in living HepG2 cells. Organic & biomolecular chemistry, 2018, 16, 5920-5931 |
| 1549720 | CIF HKL Paper | C14 H18 N2 O3 | P n a 21 | 12.2836; 14.5343; 7.8596 90; 90; 90 | 1403.2 | Rasheeda, Kedila; Samshuddin, Seranthimata; Swathi, Phadke N.; Alva, Vijaya D. P.; Mague, Joel T.; Ramli, Youssef 2-(4-Hydroxyphenyl)-4,6-dimethyl-2,3-dihydropyrimidin-1-ium acetate IUCrData, 2018, 3, x181046 |
| 1549721 | CIF HKL Paper | C19 H16 O5 | P 21 21 21 | 4.6852; 17.5786; 18.8573 90; 90; 90 | 1553.07 | Goyal, Navneet; Do, Camilla; Donahue, James P.; Mague, Joel T.; Foroozesh, Maryam Ethyl 2-[2-(4-oxo-4<i>H</i>-chromen-2-yl)phenoxy]acetate IUCrData, 2018, 3, x180993 |
| 1549723 | CIF | C24 H19 Cl4 Rh | P 1 21/c 1 | 14.3151; 6.8774; 23.4347 90; 106.959; 90 | 2206.84 | Yang, Junfeng; Shen, Yixiao; Lim, Yang Jie; Yoshikai, Naohiko Divergent ring-opening coupling between cyclopropanols and alkynes under cobalt catalysis. Chemical science, 2018, 9, 6928-6934 |
| 1549724 | CIF | C15 H9 F7.05 | P b c m | 12.069; 30.5791; 36.076 90; 90; 90 | 13314.2 | Font, Marc; Spencer, Andrew R. A.; Larrosa, Igor <i>meta</i>-C-H arylation of fluoroarenes <i>via</i> traceless directing group relay strategy. Chemical science, 2018, 9, 7133-7137 |
| 1549725 | CIF | C15 H12 F2 O2 | P 1 21/c 1 | 13.442; 13.4424; 7.0546 90; 93.892; 90 | 1271.8 | Font, Marc; Spencer, Andrew R. A.; Larrosa, Igor <i>meta</i>-C-H arylation of fluoroarenes <i>via</i> traceless directing group relay strategy. Chemical science, 2018, 9, 7133-7137 |
| 1549726 | CIF | C29 H39 Cl5 Cu N2 O6 S2 | P 1 21/c 1 | 8.4746; 9.5148; 45.506 90; 91.765; 90 | 3667.6 | Olavarría-Contreras, Ignacio José; Etcheverry-Berríos, Alvaro; Qian, Wenjie; Gutiérrez-Cerón, Cristian; Campos-Olguín, Aldo; Sañudo, E Carolina; Dulić, Diana; Ruiz, Eliseo; Aliaga-Alcalde, Núria; Soler, Monica; van der Zant, Herre S. J. Electric-field induced bistability in single-molecule conductance measurements for boron coordinated curcuminoid compounds. Chemical science, 2018, 9, 6988-6996 |
| 1549727 | CIF | C21 H20 O2 S2 | P 1 21/n 1 | 13.7982; 5.5253; 24.9052 90; 103.39; 90 | 1847.14 | Olavarría-Contreras, Ignacio José; Etcheverry-Berríos, Alvaro; Qian, Wenjie; Gutiérrez-Cerón, Cristian; Campos-Olguín, Aldo; Sañudo, E Carolina; Dulić, Diana; Ruiz, Eliseo; Aliaga-Alcalde, Núria; Soler, Monica; van der Zant, Herre S. J. Electric-field induced bistability in single-molecule conductance measurements for boron coordinated curcuminoid compounds. Chemical science, 2018, 9, 6988-6996 |
| 1549728 | CIF | C17 H13 N2 O3 | P 1 21/c 1 | 13.2523; 8.0408; 12.7339 90; 91.04; 90 | 1356.69 | Qin, Qi-Pin; Wang, Shulong; Tan, Mingxiong; Wang, Zhen-Feng; Huang, Xiao-Ling; Wei, Qingmin; Shi, Bei-Bei; Zou, Bi-Qun; Liang, Hong Synthesis and antitumor mechanisms of two novel platinum(II) complexes with 3-(2′-benzimidazolyl)-7-methoxycoumarin Metallomics, 2018 |
| 1549729 | CIF | C21 H23 Cl3 N2 O5 Pt2 S2 | P -1 | 9.4211; 12.9359; 13.8521 66.332; 88.609; 71.401 | 1454.91 | Qin, Qi-Pin; Wang, Shulong; Tan, Mingxiong; Wang, Zhen-Feng; Huang, Xiao-Ling; Wei, Qingmin; Shi, Bei-Bei; Zou, Bi-Qun; Liang, Hong Synthesis and antitumor mechanisms of two novel platinum(II) complexes with 3-(2′-benzimidazolyl)-7-methoxycoumarin Metallomics, 2018 |
| 1549730 | CIF | C98 H60 Cu9 N36 O6 S | C 1 2/c 1 | 32.7; 10.89; 30.813 90; 114.97; 90 | 9947 | Yu, Fei; Kurmoo, Mohamedally; Zhuang, Gui-Lin; Zuo, Jing-Lin Hierarchical tandem assembly of planar [3×3] building units into {3×[3×3]} oligomers: mixed-valency, electrical conductivity and magnetism. Chemical science, 2018, 9, 7498-7504 |
| 1549731 | CIF | C294 H180 Cu27 N114 O4 S | P 1 21/n 1 | 14.7327; 47.3434; 51.2702 90; 97.581; 90 | 35448.2 | Yu, Fei; Kurmoo, Mohamedally; Zhuang, Gui-Lin; Zuo, Jing-Lin Hierarchical tandem assembly of planar [3×3] building units into {3×[3×3]} oligomers: mixed-valency, electrical conductivity and magnetism. Chemical science, 2018, 9, 7498-7504 |
| 1549732 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 27.997; 4.918; 28.971 90; 108.987; 90 | 3772 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549733 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 35.652; 5.206; 22.743 90; 117.418; 90 | 3747 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549734 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 27.844; 4.867; 28.892 90; 108.98; 90 | 3702 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549735 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 28.502; 5.051; 29.231 90; 109.51; 90 | 3967 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549736 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 28.301; 4.998; 29.154 90; 109.217; 90 | 3894 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549737 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 28.201; 4.972; 29.106 90; 109.077; 90 | 3857 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549738 | CIF | C22 H23 Cl N2 O2 | C 1 2/c 1 | 27.906; 4.886; 28.927 90; 109.016; 90 | 3728.9 | Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions, 2018, 211, 209-234 |
| 1549739 | CIF | C8 H4.19 Al I0.82 O5 | I m m a | 16.501; 6.6194; 13.21 90; 90; 90 | 1442.9 | Tahmouresilerd, Babak; Larson, Patrick J.; Unruh, Daniel K.; Cozzolino, Anthony F. Make room for iodine: systematic pore tuning of multivariate metal‒organic frameworks for the catalytic oxidation of hydroquinones using hypervalent iodine Catalysis Science & Technology, 2018, 8, 4349 |
| 1549740 | CIF | C8 H4.3 Al I0.7 O5.25 | I m m a | 17.107; 6.622; 12.229 90; 90; 90 | 1385.3 | Tahmouresilerd, Babak; Larson, Patrick J.; Unruh, Daniel K.; Cozzolino, Anthony F. Make room for iodine: systematic pore tuning of multivariate metal‒organic frameworks for the catalytic oxidation of hydroquinones using hypervalent iodine Catalysis Science & Technology, 2018, 8, 4349 |
| 1549741 | CIF | C12 H14 Er I N2 | P 21 21 21 | 10.7394; 10.7693; 12.2067 90; 90; 90 | 1411.8 | Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D. Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes. Chemical science, 2018, 9, 7204-7209 |
| 1549742 | CIF | C16 H24 Er I O2 | P 1 21/n 1 | 8.4793; 9.3962; 22.2154 90; 97.496; 90 | 1754.8 | Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D. Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes. Chemical science, 2018, 9, 7204-7209 |
| 1549743 | CIF | C18 H18 Er I N2 | P 1 21/n 1 | 10.818; 8.8916; 18.3519 90; 96.53; 90 | 1753.8 | Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D. Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes. Chemical science, 2018, 9, 7204-7209 |
| 1549744 | CIF | C27 H38 B Er N6 O | P 1 21/c 1 | 8.2903; 31.84; 10.584 90; 102.02; 90 | 2732.5 | Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D. Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes. Chemical science, 2018, 9, 7204-7209 |
| 1549745 | CIF | C16 H21 F3 N2 O2 | P 1 21/c 1 | 13.0203; 10.3915; 12.893 90; 103.151; 90 | 1698.68 | Png, Zhuang Mao; Cabrera-Pardo, Jaime R; Peiró Cadahía, Jorge; Gaunt, Matthew J. Diastereoselective C-H carbonylative annulation of aliphatic amines: a rapid route to functionalized γ-lactams. Chemical science, 2018, 9, 7628-7633 |
| 1549746 | CIF | C36.25 H64.5 Cl4.5 F4 N2 O8 Pd3 | P -1 | 11.8915; 14.4371; 15.9414 84.9399; 77.9747; 68.7283 | 2494.14 | Png, Zhuang Mao; Cabrera-Pardo, Jaime R; Peiró Cadahía, Jorge; Gaunt, Matthew J. Diastereoselective C-H carbonylative annulation of aliphatic amines: a rapid route to functionalized γ-lactams. Chemical science, 2018, 9, 7628-7633 |
| 1549747 | CIF | C38 H35 Cl3 F20 N P Pd | P -1 | 13.2478; 19.4015; 20.3563 115.227; 91.1995; 105.389 | 4509.24 | Png, Zhuang Mao; Cabrera-Pardo, Jaime R; Peiró Cadahía, Jorge; Gaunt, Matthew J. Diastereoselective C-H carbonylative annulation of aliphatic amines: a rapid route to functionalized γ-lactams. Chemical science, 2018, 9, 7628-7633 |
| 1549748 | CIF | C48 H35 N3 O2 | P 1 21/c 1 | 7.9859; 19.6476; 23.8539 90; 106.74; 90 | 3584.15 | Xiong, Jingwen; Li, Zongzhi; Tan, Jihua; Ji, Shaomin; Sun, Jianwei; Li, Xianwei; Huo, Yanping Two new quinoline-based regenerable fluorescent probes with AIE characteristics for selective recognition of Cu<sup>2+</sup> in aqueous solution and test strips. The Analyst, 2018, 143, 4870-4886 |
| 1549749 | CIF | C31 H53 Rh2 S2 | P 1 21/n 1 | 10.855; 28.6007; 10.8441 90; 119.239; 90 | 2937.7 | Serrano-Maldonado, A.; Rozenel, S. S.; Jimenez-Santiago, J. L.; Guerrero-Ríos, I.; Martin, E. Rh nanoparticles from thiolate dimers: selective and reusable hydrogenation catalysts in ionic liquids Catalysis Science & Technology, 2018, 8, 4373 |
| 1549750 | CIF | C40 H74 Rh2 S2 | P 1 21/m 1 | 8.734; 26.987; 8.39 90; 90; 90 | 1977.6 | Serrano-Maldonado, A.; Rozenel, S. S.; Jimenez-Santiago, J. L.; Guerrero-Ríos, I.; Martin, E. Rh nanoparticles from thiolate dimers: selective and reusable hydrogenation catalysts in ionic liquids Catalysis Science & Technology, 2018, 8, 4373 |
| 1549751 | CIF | C28 Al2 Cl6 F56 Li2 N2 O6 | C 1 2/c 1 | 30.4136; 11.7318; 20.6258 90; 129.575; 90 | 5672.6 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549752 | CIF | C24 Al2 F55 N O7 | P 1 21/n 1 | 10.6841; 18.2966; 22.3798 90; 94.822; 90 | 4359.38 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549753 | CIF | C36 H8 Ag Al2 F59 O6 | C 1 c 1 | 13.1028; 29.39; 14.129 90; 99.674; 90 | 5363.6 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549754 | CIF | C42 H12 Ag Al2 F61 O6 | P -1 | 15.4856; 17.6866; 22.5679 76.093; 84.023; 81.617 | 5920.4 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549755 | CIF | C15 H6 Al F27 O6 | P 1 21/c 1 | 10.8066; 13.958; 17.2977 90; 90.19; 90 | 2609.15 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549756 | CIF | C28 H8 Ag Al F40 O4 | P 1 21/n 1 | 14.1565; 18.4564; 14.651 90; 91.2; 90 | 3827.1 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549757 | CIF | C30 H12 Ag Al F34 O3 | P 1 21/n 1 | 10.2659; 17.4605; 20.9905 90; 99.098; 90 | 3715.17 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549758 | CIF | C50 H58 Ag Al2 Br2 Cl4 F55 O6 Si2 | P -1 | 15.476; 16.615; 18.2967 89.488; 67.742; 70.537 | 4068.1 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549759 | CIF | C21 H18 Al F28 Li O12 | P 1 21/c 1 | 35.9221; 10.7468; 19.3985 90; 102.381; 90 | 7314.6 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549760 | CIF | C20 H10 Ag B F22 O2 | P 1 21/c 1 | 34.3712; 10.6465; 13.7845 90; 100.452; 90 | 4960.5 | Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>). Chemical science, 2018, 9, 7058-7068 |
| 1549761 | CIF | C48.25 H44.5 Cl0.5 N2 O9 | P -1 | 14.0049; 23.6564; 26.0431 71.035; 82.975; 82.271 | 8057.2 | Homberg, Alexandre; Brun, Elodie; Zinna, Francesco; Pascal, Simon; Górecki, Marcin; Monnier, Luc; Besnard, Céline; Pescitelli, Gennaro; Di Bari, Lorenzo; Lacour, Jérôme Combined reversible switching of ECD and quenching of CPL with chiral fluorescent macrocycles. Chemical science, 2018, 9, 7043-7052 |
| 1549762 | CIF | C48 H42 N2 O6 | P -1 | 11.8363; 12.6884; 14.8869 108.968; 104.837; 104.872 | 1897.35 | Homberg, Alexandre; Brun, Elodie; Zinna, Francesco; Pascal, Simon; Górecki, Marcin; Monnier, Luc; Besnard, Céline; Pescitelli, Gennaro; Di Bari, Lorenzo; Lacour, Jérôme Combined reversible switching of ECD and quenching of CPL with chiral fluorescent macrocycles. Chemical science, 2018, 9, 7043-7052 |
| 1549763 | CIF | Ca4.83 F Mn0.15 O12 P3 Sr0.02 | P 63/m | 9.384; 9.384; 6.8842 90; 90; 120 | 525 | Arima, H.; Kida, Y.; Mikouchi, T.; Sugiyama, K. The location of Mn (MnO: 2.0 wt%) in fluorapatit from Lavra da Golconda, near Governador Valadares, Minas Gerais, Brazil Journal of Mineralogical and Petrological Sciences, 2018, 113, 119-125 |
| 1549764 | CIF | Al2 Ca0.96 F4.28 H3.72 O3.72 Sr0.04 | C 1 2/c 1 | 6.7103; 11.1619; 7.3741 90; 94.919; 90 | 550.28 | Hongu, H.; Yoshiasa, A.; Teshima, A.; Isobe, H.; Sugiyama, K.; Arima, H.; Nakatsuka, A.; Momma, K.; Miyawaki, R. Crystal structure refinement and chemical formula of prosopite, CaAl2F4[(OH)4-xFx] x = 0.0-1.0 Journal of Mineralogical and Petrological Sciences, 2018, 113, 152-158 |
| 1549765 | CIF | C10 H10 Br2 Co N2 | P 1 21/c 1 | 8.6842; 18.1757; 8.5209 90; 100.878; 90 | 1320.8 | Majcher, Anna M.; Dąbczyński, Paweł; Marzec, Mateusz M.; Ceglarska, Magdalena; Rysz, Jakub; Bernasik, Andrzej; Ohkoshi, Shin-Ichi; Stefańczyk, Olaf Between single ion magnets and macromolecules: a polymer/transition metal-based semi-solid solution. Chemical science, 2018, 9, 7277-7286 |
| 1549766 | CIF | C14 H14 Br2 Co N2 | C 1 2/c 1 | 9.1275; 12.1835; 14.8264 90; 95.764; 90 | 1640.4 | Majcher, Anna M.; Dąbczyński, Paweł; Marzec, Mateusz M.; Ceglarska, Magdalena; Rysz, Jakub; Bernasik, Andrzej; Ohkoshi, Shin-Ichi; Stefańczyk, Olaf Between single ion magnets and macromolecules: a polymer/transition metal-based semi-solid solution. Chemical science, 2018, 9, 7277-7286 |
| 1549767 | CIF | C20 H32 P Si2 Tb | P n m a | 12.8319; 18.8787; 9.3269 90; 90; 90 | 2259.4 | Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet. Chemical science, 2018, 9, 7540-7545 |
| 1549768 | CIF | C20 H32 Er P Si2 | P 1 21/c 1 | 15.1266; 10.815; 14.256 90; 95.164; 90 | 2322.73 | Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet. Chemical science, 2018, 9, 7540-7545 |
| 1549769 | CIF | C20 H32 Dy P Si2 | P n m a | 12.8248; 18.9114; 9.3047 90; 90; 90 | 2256.7 | Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet. Chemical science, 2018, 9, 7540-7545 |
| 1549770 | CIF | C20 H32 P Si2 Tm | P 1 21/c 1 | 15.0719; 10.8053; 14.3183 90; 95.125; 90 | 2322.5 | Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet. Chemical science, 2018, 9, 7540-7545 |
| 1549771 | CIF | C20 H32 P Si2 Y | P 1 21/c 1 | 15.2388; 10.8568; 14.217 90; 95.18; 90 | 2342.5 | Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet. Chemical science, 2018, 9, 7540-7545 |
| 1549775 | CIF | C25 H15 N S2 | P b c a | 18.7793; 7.4521; 50.3987 90; 90; 90 | 7053.06 | Kitano, Hiroyuki; Matsuoka, Wataru; Ito, Hideto; Itami, Kenichiro Annulative π-extension of indoles and pyrroles with diiodobiaryls by Pd catalysis: rapid synthesis of nitrogen-containing polycyclic aromatic compounds. Chemical science, 2018, 9, 7556-7561 |
| 1549776 | CIF | C29 H19 N | P 1 21/n 1 | 10.6434; 9.1028; 20.109 90; 102.565; 90 | 1901.6 | Kitano, Hiroyuki; Matsuoka, Wataru; Ito, Hideto; Itami, Kenichiro Annulative π-extension of indoles and pyrroles with diiodobiaryls by Pd catalysis: rapid synthesis of nitrogen-containing polycyclic aromatic compounds. Chemical science, 2018, 9, 7556-7561 |
| 1549777 | CIF | C41 H27 N O S4 | P 1 21/c 1 | 16.1846; 27.2713; 7.6092 90; 97.89; 90 | 3326.7 | Kitano, Hiroyuki; Matsuoka, Wataru; Ito, Hideto; Itami, Kenichiro Annulative π-extension of indoles and pyrroles with diiodobiaryls by Pd catalysis: rapid synthesis of nitrogen-containing polycyclic aromatic compounds. Chemical science, 2018, 9, 7556-7561 |
| 1549778 | CIF | C220 H194.5 Au24.01 Cl3 P10 Pd0.99 S5 | P -1 | 20.474; 31.755; 36.216 75.393; 74.91; 84.029 | 21981 | Nair, Lakshmi V.; Hossain, Sakiat; Takagi, Shunjiro; Imai, Yukari; Hu, Guoxiang; Wakayama, Shota; Kumar, Bharat; Kurashige, Wataru; Jiang, De-En; Negishi, Yuichi Hetero-biicosahedral [Au<sub>24</sub>Pd(PPh<sub>3</sub>)<sub>10</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>5</sub>Cl<sub>2</sub>]<sup>+</sup> nanocluster: selective synthesis and optical and electrochemical properties. Nanoscale, 2018, 10, 18969-18979 |
| 1549779 | CIF HKL Paper | C25 H24 N4 O3 S | P 1 2/c 1 | 8.3287; 13.8956; 20.3124 90; 90.635; 90 | 2350.7 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. Ethyl 2-anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole-4-carbonyl]thiophene-3-carboxylate IUCrData, 2018, 3, x181106 |
| 1549780 | CIF HKL Paper | H4 N O3 V | P b c m | 4.9045; 11.7945; 5.8231 90; 90; 90 | 336.84 | Pérez-Benítez, Aarón; Bernès, Sylvain Redetermination of ammonium metavanadate IUCrData, 2018, 3 |
| 1549781 | CIF HKL Paper | C19 H14 O2 | P b c n | 19.7403; 9.3294; 15.0595 90; 90; 90 | 2773.4 | Devassia, Tomson; Mathew, Eason M.; Sithambaresan, M.; Unnikrishnan, P. A.; Kurup, M. R. Prathapachandra 10-Methyl-9,11-annulated dibenzobarrelene IUCrData, 2018, 3, x181102 |
| 1549782 | CIF | C23 H19 B N2 | P -1 | 9.5765; 10.1909; 10.8774 115.915; 106.476; 90.377 | 905.1 | Yang, Kai; Zhang, Guan; Song, Qiuling Four-coordinate triarylborane synthesis <i>via</i> cascade B-Cl/C-B cross-metathesis and C-H bond borylation. Chemical science, 2018, 9, 7666-7672 |
| 1549783 | CIF | C17 H14 B F N2 | P 1 21/n 1 | 9.1839; 11.282; 14.148 90; 101.51; 90 | 1436.4 | Yang, Kai; Zhang, Guan; Song, Qiuling Four-coordinate triarylborane synthesis <i>via</i> cascade B-Cl/C-B cross-metathesis and C-H bond borylation. Chemical science, 2018, 9, 7666-7672 |
| 1549784 | CIF | C59.5 H22 Cl7 F20 N5 S3 | P -1 | 13.89; 14.796; 16.218 96.6694; 96.2744; 112.822 | 3007.7 | Higashino, Tomohiro; Kumagai, Atsushi; Sakaki, Shigeyoshi; Imahori, Hiroshi Reversible π-system switching of thiophene-fused thiahexaphyrins by solvent and oxidation/reduction. Chemical science, 2018, 9, 7528-7539 |
| 1549785 | CIF | C65 H20.5 Cl1.5 F20 N5 S3 | P -1 | 13.765; 17.271; 24.19 94.738; 102.606; 93.061 | 5577.9 | Higashino, Tomohiro; Kumagai, Atsushi; Sakaki, Shigeyoshi; Imahori, Hiroshi Reversible π-system switching of thiophene-fused thiahexaphyrins by solvent and oxidation/reduction. Chemical science, 2018, 9, 7528-7539 |
| 1549786 | CIF | C32 H33 N5 O5 U | P -1 | 10.3182; 12.47104; 12.8143 82.2874; 68.197; 79.3609 | 1500.76 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549787 | CIF | C64 H64 Fe N10 O10 U2 | C 1 2/c 1 | 46.746; 13.2744; 24.296 90; 145.84; 90 | 8465 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549788 | CIF | C69 H69 I2 N11 O6 U2 | P 1 21/n 1 | 14.3842; 14.1543; 16.8027 90; 93.045; 90 | 3416.2 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549789 | CIF | C63 H99 K2 N8 O17 U | P -1 | 12.542; 13.779; 23.86 81.55; 78.59; 86.58 | 3996 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549790 | CIF | C99 H99 Fe3 I2 N17 O10 U2 | P -1 | 13.7743; 21.1783; 24.452 99.7615; 95.7326; 98.8026 | 6888.7 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549791 | CIF | C50 H54 Fe N8 O5 U | P 1 21/c 1 | 19.5691; 13.9341; 19.6431 90; 118.26; 90 | 4717.8 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549792 | CIF | C69 H69 Fe I N11 O8 U2 | P 1 21/n 1 | 15.964; 23.884; 20.0642 90; 105.849; 90 | 7359.3 | Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella The effect of iron binding on uranyl(v) stability. Chemical science, 2018, 9, 7520-7527 |
| 1549793 | CIF HKL Paper | C10 H7 Cl N3 Na O2 | P 1 21/c 1 | 11.6462; 6.3754; 14.7003 90; 92.711; 90 | 1090.26 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. Sodium 1-(4-chlorophenyl)-5-methyl-1<i>H</i>-1,2,3-triazole-4-carboxylate IUCrData, 2018, 3, x181127 |
| 1549794 | CIF HKL Paper | C37 H31 B Cl3 F4 N P2 | P -1 | 9.6306; 10.813; 17.0381 91.826; 95.619; 90.734 | 1764.6 | Manandhar, Rachana; Rath, Nigam P.; Jones, Myron W. Bis(triphenylphosphine)iminium tetrafluoroborate chloroform monosolvate IUCrData, 2018, 3, x181108 |
| 1549795 | CIF HKL Paper | C15 H22 I N | P b c a | 15.631; 11.614; 16.976 90; 90; 90 | 3082 | da Costa Duarte, Rodrigo; Kommers Reimann, Louise; Severo Rodembusch, Fabiano; Gustavo Teixeira Alves Duarte, Luís 1-Butyl-2,3,3-trimethylindol-1-ium iodide IUCrData, 2018, 3, x181130 |
| 1549796 | CIF | C58 H84 Mn2 N4 | P 1 21/n 1 | 14.1097; 14.319; 14.2262 90; 111.886; 90 | 2667.1 | Mukhopadhyay, Tufan K.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J. A β-diketiminate manganese catalyst for alkene hydrosilylation: substrate scope, silicone preparation, and mechanistic insight. Chemical science, 2018, 9, 7673-7680 |
| 1549797 | CIF | C41 H58 Mn N2 | P 1 21/c 1 | 12.443; 13.455; 22.132 90; 102.382; 90 | 3619 | Mukhopadhyay, Tufan K.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J. A β-diketiminate manganese catalyst for alkene hydrosilylation: substrate scope, silicone preparation, and mechanistic insight. Chemical science, 2018, 9, 7673-7680 |
| 1549798 | CIF | C40 H33 F6 Fe N5 O6 S2 | C 1 2/c 1 | 42.348; 11.696; 18.645 90; 92.882; 90 | 9223 | Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo. Chemical science, 2018, 9, 7843-7858 |
| 1549799 | CIF | C64 H53 Cl6 Fe3 N11 | P b c a | 18.9606; 18.7387; 34.1557 90; 90; 90 | 12135.4 | Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo. Chemical science, 2018, 9, 7843-7858 |
| 1549800 | CIF | C33 H27 Br Cl7 Fe N5 O4 | P -1 | 9.9553; 13.1814; 16.2767 92.662; 96.422; 105.743 | 2036.29 | Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo. Chemical science, 2018, 9, 7843-7858 |
| 1549801 | CIF | C33 H27 Cl8 Fe N5 O4 | P -1 | 9.68503; 9.74597; 20.3011 92.2266; 101.563; 98.3455 | 1852.88 | Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo. Chemical science, 2018, 9, 7843-7858 |
| 1549802 | CIF | C64 H53 Br6 Fe3 N11 | P b c a | 19.0269; 18.8487; 35.2474 90; 90; 90 | 12640.9 | Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo. Chemical science, 2018, 9, 7843-7858 |
| 1549803 | CIF HKL Paper | C16 H12 O3 | P 1 21/n 1 | 13.2958; 5.1981; 18.8162 90; 109.212; 90 | 1228.02 | Padgett, Clifford W.; Lynch, Will E.; Sheriff, Kirkland; Dean, Raven; Zingales, Sarah 3-Hydroxy-2-(4-methylphenyl)-4<i>H</i>-chromen-4-one IUCrData, 2018, 3, x181138 |
| 1549804 | CIF HKL Paper | C18 H18 Cl N3 O | P 65 | 9.9013; 9.9013; 28.981 90; 90; 120 | 2460.5 | Lee, Ji Hye; Koh, Dongsoo 2-Amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-1-ium chloride IUCrData, 2018, 3, x181152 |
| 1549805 | CIF | C32 H40 F2 Sn | P 1 21/c 1 | 17.1715; 17.8894; 9.4518 90; 101.309; 90 | 2847.1 | Ming, Jialin; Shi, Qi; Hayashi, Tamio Addition of arylstannanes to alkynes giving <i>ortho</i>-alkenylarylstannanes catalysed cooperatively by a rhodium complex and zinc chloride. Chemical science, 2018, 9, 7700-7704 |
| 1549806 | CIF | C90 H68 B2 F30 Fe2 O2 | P 1 21/c 1 | 14.0463; 17.6303; 16.8395 90; 100.648; 90 | 4098.34 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549807 | CIF | C51 H22 B2 F30 N O3 | P -1 | 13.8373; 14.8923; 15.4147 63.462; 80.689; 88.721 | 2799.88 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549808 | CIF | C69 H25 B2 Cl4 F30 O2 | P -1 | 13.3556; 14.9486; 17.5414 95.477; 111.222; 102.632 | 3126.3 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549809 | CIF | C72 H29 B2 Cl6 F30 O2 | P -1 | 12.3256; 16.7558; 17.1303 90.82; 97.535; 103.218 | 3410.8 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549810 | CIF | C71 H40 B2 Cl2 F30 Fe O2 | P 1 21 1 | 12.6071; 13.6253; 20.3659 90; 100.362; 90 | 3441.31 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549811 | CIF | C72 H42 B2 Cl4 F30 Fe O2 | P -1 | 11.863; 13.004; 13.207 106.631; 116.366; 92.518 | 1714 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549812 | CIF | C68 H36 B2 F30 Fe O2 | P -1 | 13.3457; 14.575; 17.8933 91.771; 97.044; 102.641 | 3364.49 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549813 | CIF | C90 H68 B2 F30 Fe2 O2 | P 1 21/n 1 | 26.8002; 12.9058; 27.8292 90; 116.473; 90 | 8616.2 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549814 | CIF | C51 H22 B2 F30 N O3 | P -1 | 11.8064; 14.9813; 15.3306 91.992; 103.172; 108.496 | 2487 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549815 | CIF | C61 H19 B2 F30 O2 | P -1 | 13.791; 14.0959; 18.1102 109.569; 109.658; 90.652 | 3093.2 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549816 | CIF | C62 H34 B2 F30 Fe O2 | P -1 | 9.5809; 10.9166; 14.2783 74.722; 79.532; 85.172 | 1415.59 | Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals. Chemical science, 2018, 9, 8011-8018 |
| 1549817 | CIF | C10 H8 N4 O | P 1 21/c 1 | 3.7576; 14.428; 9.4611 90; 100.599; 90 | 504.18 | Chen, Ming; Hu, Xianglong; Liu, Junkai; Li, Baixue; Leung, Nelson L. C.; Viglianti, Lucia; Cheung, Tsz Shing; Sung, Herman H. Y.; Kwok, Ryan T. K.; Williams, Ian D.; Qin, Anjun; Lam, Jacky W. Y.; Tang, Ben Zhong Rational design of red AIEgens with a new core structure from non-emissive heteroaromatics. Chemical science, 2018, 9, 7829-7834 |
| 1549818 | CIF | C34 H22 N4 | P -1 | 5.772; 9.9613; 10.8529 87.644; 77.477; 89.901 | 608.63 | Chen, Ming; Hu, Xianglong; Liu, Junkai; Li, Baixue; Leung, Nelson L. C.; Viglianti, Lucia; Cheung, Tsz Shing; Sung, Herman H. Y.; Kwok, Ryan T. K.; Williams, Ian D.; Qin, Anjun; Lam, Jacky W. Y.; Tang, Ben Zhong Rational design of red AIEgens with a new core structure from non-emissive heteroaromatics. Chemical science, 2018, 9, 7829-7834 |
| 1549819 | CIF HKL | C17 H20 N6 O2 | P -1 | 7.3968; 10.6475; 12.7769 106.577; 100.809; 108.208 | 872.83 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 5-Methyl-1-(4-methylphenyl)-<i>N</i>'-[1-(1<i>H</i>-pyrrol-2-yl)ethylidene]-1<i>H</i>-1,2,3-triazole-4-carbohydrazide monohydrate IUCrData, 2018, 3, x181162 |
| 1549820 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.2503; 10.1169; 11.3784 81.03; 88.843; 82.58 | 479.24 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549821 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.0958; 9.372; 10.9859 85.224; 88.977; 84.909 | 418.56 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549822 | CIF | C7 H8 Cu I N2 O2 | P -1 | 3.9623; 8.824; 10.6104 87.89; 88.524; 87.3 | 370.2 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549823 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.0071; 9.009; 10.7254 87.042; 88.693; 86.485 | 385.87 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549824 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.1474; 9.5705; 11.1208 84.163; 88.992; 84.152 | 436.83 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549825 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.0175; 9.064; 10.7655 86.743; 88.765; 86.231 | 390.48 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549826 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.0406; 9.151; 10.8365 86.375; 88.849; 85.829 | 398.78 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549827 | CIF | C7 H8 Cu I N2 O2 | P -1 | 3.9759; 8.862; 10.6257 87.71; 88.616; 87.1 | 373.52 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549828 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.1864; 9.741; 11.2181 83.217; 88.956; 83.522 | 451.36 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549829 | CIF | C7 H8 Cu I N2 O2 | P -1 | 3.989; 8.933; 10.667 87.474; 88.623; 86.839 | 379.07 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549830 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.068; 9.26; 10.911 85.828; 88.899; 85.395 | 408.56 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549831 | CIF | C7 H8 Cu I N2 O2 | P -1 | 3.997; 8.9646; 10.6952 87.267; 88.673; 86.652 | 382.06 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549832 | CIF | C7 H8 Cu I N2 O2 | P -1 | 4.0313; 9.11; 10.8051 86.619; 88.825; 86.015 | 395.12 | Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors. Chemical science, 2018, 9, 8000-8010 |
| 1549833 | CIF | C71 H102 Fe4 O6 | P 1 21/n 1 | 12.2994; 22.698; 23.587 90; 99.188; 90 | 6500.3 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549834 | CIF | C76 H114 Br2 F4 Fe2 Mg2 O14.5 | P -1 | 12.3417; 15.4069; 21.5668 100.062; 99.279; 94.4973 | 3960.9 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549835 | CIF | C94 H140 Fe2 Mg2 O16 | P -1 | 12.4649; 12.9212; 15.2879 69.5966; 81.444; 88.91 | 2280.7 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549836 | CIF | C18 H30 Fe0.58 Mg0.42 O6 | P 1 21/c 1 | 15.2106; 11.1429; 12.9636 90; 114.031; 90 | 2006.76 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549837 | CIF | C60 H78 Fe4 O6 | F d d d | 20.134; 24.672; 43.274 90; 90; 90 | 21496 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549838 | CIF | C58 H74 Fe4 O4 | P 1 21/c 1 | 16.159; 17.191; 18.694 90; 98.545; 90 | 5135.3 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549839 | CIF | C52 H56 F6 Fe4 O4 | I 41/a m d | 15.5897; 15.5897; 45.3118 90; 90; 90 | 11012.5 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549840 | CIF | C86 H118 F6 Fe2 Mg2 O14 | P -1 | 12.7545; 12.82; 14.971 96.604; 108.178; 113.494 | 2050.9 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549841 | CIF | C80 H112 Fe2 Mg N6 O9.5 | P 42/n | 20.048; 20.048; 19.32 90; 90; 90 | 7765.1 | Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science, 2018 |
| 1549842 | CIF | C69 H59 Br2 Co N9 O9 S2 | P 1 | 8.8042; 13.872; 15.012 113.273; 91.702; 108.265 | 1574.4 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
| 1549843 | CIF | C69 H59 Br2 Co N9 O9 S2 | P 1 | 8.933; 14.009; 15.07 113.024; 91.175; 108.218 | 1627 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
| 1549844 | CIF | C69 H55 Br2 Co N9 O7 S2 | P 1 | 8.7198; 13.8688; 15.15 112.076; 90.143; 106.456 | 1615.99 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
| 1549845 | CIF | C69 H55 Br2 Co N9 O7 S2 | P 1 | 8.6715; 13.689; 15.1994 112.725; 90.764; 106.662 | 1578.49 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
| 1549846 | CIF | C69 H59 Br2 Co N9 O9 S2 | P 1 | 8.8606; 13.9125; 14.9455 65.422; 87.897; 71.56 | 1579.8 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
| 1549847 | CIF | C69 H55 Br2 Co N9 O7 S2 | P 1 | 8.6306; 13.5529; 15.2106 113.16; 91.252; 106.863 | 1546.66 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
| 1549848 | CIF | C23 H22 Br N O4 | P 21 21 21 | 8.3737; 10.0127; 24.658 90; 90; 90 | 2067.41 | Liu, Yang; Liu, Xiangyuan; Li, Jiangtao; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong Catalytic enantioselective radical coupling of activated ketones with <i>N</i>-aryl glycines. Chemical science, 2018, 9, 8094-8098 |
| 1549849 | CIF | C26 H32 N2 O8 S | P 1 | 6.25857; 10.36; 11.9013 64.561; 87.812; 84.16 | 693.22 | Liu, Yang; Liu, Xiangyuan; Li, Jiangtao; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong Catalytic enantioselective radical coupling of activated ketones with <i>N</i>-aryl glycines. Chemical science, 2018, 9, 8094-8098 |
| 1549850 | CIF | C144 Dy12 O64 | F m -3 m | 24.8328; 24.8328; 24.8328 90; 90; 90 | 15313.6 | Liu, Chong; Eliseeva, Svetlana V.; Luo, Tian-Yi; Muldoon, Patrick F.; Petoud, Stéphane; Rosi, Nathaniel L. Near infrared excitation and emission in rare earth MOFs <i>via</i> encapsulation of organic dyes. Chemical science, 2018, 9, 8099-8102 |
| 1549851 | CIF | C42 H24 Dy3 N6 O16 | F m -3 m | 29.9107; 29.9107; 29.9107 90; 90; 90 | 26759.6 | Liu, Chong; Eliseeva, Svetlana V.; Luo, Tian-Yi; Muldoon, Patrick F.; Petoud, Stéphane; Rosi, Nathaniel L. Near infrared excitation and emission in rare earth MOFs <i>via</i> encapsulation of organic dyes. Chemical science, 2018, 9, 8099-8102 |
| 1549852 | CIF | C42 H24 Dy3 O20 | F m -3 m | 27.5659; 27.5659; 27.5659 90; 90; 90 | 20946.7 | Liu, Chong; Eliseeva, Svetlana V.; Luo, Tian-Yi; Muldoon, Patrick F.; Petoud, Stéphane; Rosi, Nathaniel L. Near infrared excitation and emission in rare earth MOFs <i>via</i> encapsulation of organic dyes. Chemical science, 2018, 9, 8099-8102 |
| 1549853 | CIF | C19 H15 Br N2 O3 | P 1 21/c 1 | 10.499; 20.581; 8.367 90; 108.054; 90 | 1718.9 | Lovato, Kaitlyn; Guo, Lirong; Xu, Qing-Long; Liu, Fengting; Yousufuddin, Muhammed; Ess, Daniel H.; Kürti, László; Gao, Hongyin Transition metal-free direct dehydrogenative arylation of activated C(sp<sup>3</sup>)-H bonds: synthetic ambit and DFT reactivity predictions. Chemical science, 2018, 9, 7992-7999 |
| 1549854 | CIF | C18 H13 F3 N2 O4 | P 1 21/c 1 | 18.29; 10.7507; 9.233 90; 98.659; 90 | 1794.8 | Lovato, Kaitlyn; Guo, Lirong; Xu, Qing-Long; Liu, Fengting; Yousufuddin, Muhammed; Ess, Daniel H.; Kürti, László; Gao, Hongyin Transition metal-free direct dehydrogenative arylation of activated C(sp<sup>3</sup>)-H bonds: synthetic ambit and DFT reactivity predictions. Chemical science, 2018, 9, 7992-7999 |
| 1549855 | CIF | C21 H33 Cl2 N Si Ti | P -1 | 8.268; 11.8794; 12.9943 71.395; 78.04; 70.734 | 1134.41 | Williams, Thomas J.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl constrained geometry complexes for ethylene polymerisation catalysis Catalysis Science & Technology, 2018, 8, 5454 |
| 1549856 | CIF | C32 H49 Cl2 N Si Ti | P -1 | 9.966; 12.4507; 15.2615 112.445; 108.902; 90.786 | 1635.29 | Williams, Thomas J.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl constrained geometry complexes for ethylene polymerisation catalysis Catalysis Science & Technology, 2018, 8, 5454 |
| 1549857 | CIF | C20 H31 Cl2 N Si Ti | P 1 21/c 1 | 11.5225; 12.9843; 15.2891 90; 104.979; 90 | 2209.7 | Williams, Thomas J.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl constrained geometry complexes for ethylene polymerisation catalysis Catalysis Science & Technology, 2018, 8, 5454 |
| 1549858 | CIF | C23 H26 Ir N O3 | P b c a | 16.13031; 14.54437; 17.33703 90; 90; 90 | 4067.36 | Pèrez-Miqueo, Jorge; San Nacianceno, Virginia; Urquiola, F. Borja; Freixa, Zoraida Revisiting the iridacycle-catalyzed hydrosilylation of enolizable imines Catalysis Science & Technology, 2018, 8, 6316 |
| 1549859 | CIF | C21 H15 N3 O3 | P 1 21/c 1 | 10.2072; 22.8173; 7.0823 90; 90.009; 90 | 1649.47 | Das, Deb Kumar; Kumar Pampana, V. Kishore; Hwang, Kuo Chu Copper catalyzed photoredox synthesis of α-keto esters, quinoxaline, and naphthoquinone: controlled oxidation of terminal alkynes to glyoxals. Chemical science, 2018, 9, 7318-7326 |
| 1549860 | CIF | C9 H7 N O5 | P -1 | 7.2306; 7.3257; 8.8664 106.573; 100.859; 94.501 | 437.69 | Das, Deb Kumar; Kumar Pampana, V. Kishore; Hwang, Kuo Chu Copper catalyzed photoredox synthesis of α-keto esters, quinoxaline, and naphthoquinone: controlled oxidation of terminal alkynes to glyoxals. Chemical science, 2018, 9, 7318-7326 |
| 1549861 | CIF | C12 H12 Cu N2 O6 | P -1 | 5.0866; 7.5068; 9.0684 76.038; 85.125; 72.229 | 319.98 | Das, Deb Kumar; Kumar Pampana, V. Kishore; Hwang, Kuo Chu Copper catalyzed photoredox synthesis of α-keto esters, quinoxaline, and naphthoquinone: controlled oxidation of terminal alkynes to glyoxals. Chemical science, 2018, 9, 7318-7326 |
| 1549862 | CIF | C800.5 H916 Cl20.5 Cu8 N43 O114 | P -1 | 30.0973; 30.8663; 31.9583 91.509; 102.049; 94.109 | 28934 | Le Poul, Nicolas; Colasson, Benoit; Thiabaud, Grégory; Dit Fouque, Dany Jeanne; Iacobucci, Claudio; Memboeuf, Antony; Douziech, Bénédicte; Řezáč, Jan; Prangé, Thierry; de la Lande, Aurélien; Reinaud, Olivia; Le Mest, Yves Gating the electron transfer at a monocopper centre through the supramolecular coordination of water molecules within a protein chamber mimic. Chemical science, 2018, 9, 8282-8290 |
| 1549863 | CIF | C42 H28 Br2 | P -1 | 9.928; 11.964; 13.33 91.365; 90.705; 93.476 | 1579.8 | Kasun, Zachary A.; Sato, Hiroki; Nie, Jing; Mori, Yasuyuki; Bender, Jon A.; Roberts, Sean T.; Krische, Michael J. Alternating oligo(<i>o</i>,<i>p</i>-phenylenes) <i>via</i> ruthenium catalyzed diol-diene benzannulation: orthogonality to cross-coupling enables <i>de novo</i> nanographene and PAH construction. Chemical science, 2018, 9, 7866-7873 |
| 1549864 | CIF | C60 H38 | P -1 | 9.859; 13.666; 14.502 91.78; 96.21; 110.33 | 1816.5 | Kasun, Zachary A.; Sato, Hiroki; Nie, Jing; Mori, Yasuyuki; Bender, Jon A.; Roberts, Sean T.; Krische, Michael J. Alternating oligo(<i>o</i>,<i>p</i>-phenylenes) <i>via</i> ruthenium catalyzed diol-diene benzannulation: orthogonality to cross-coupling enables <i>de novo</i> nanographene and PAH construction. Chemical science, 2018, 9, 7866-7873 |
| 1549865 | CIF | C34.33333 H18.66667 Cl0.66667 S2 | P 1 21/n 1 | 9.2129; 21.272; 36.423 90; 91.73; 90 | 7135 | Kasun, Zachary A.; Sato, Hiroki; Nie, Jing; Mori, Yasuyuki; Bender, Jon A.; Roberts, Sean T.; Krische, Michael J. Alternating oligo(<i>o</i>,<i>p</i>-phenylenes) <i>via</i> ruthenium catalyzed diol-diene benzannulation: orthogonality to cross-coupling enables <i>de novo</i> nanographene and PAH construction. Chemical science, 2018, 9, 7866-7873 |
| 1549866 | CIF | C25 H35 N O3 | P -1 | 6.74; 11.686; 15.408 80.71; 80.08; 74.51 | 1143.5 | Gude, Venkatesh; Rout, Duttanjali; Panigrahi, Mruganka Kumar; Biradha, Kumar Origin of green photoluminescence in four-ring bent-core molecules with ESIPT, selective sensing of zinc ions by turn-on emission and their liquid crystal properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1386-1395 |
| 1549867 | CIF | C35 H36 N2 O6 | P 1 21/c 1 | 6.5854; 61.276; 7.3258 90; 90.629; 90 | 2956 | Gude, Venkatesh; Rout, Duttanjali; Panigrahi, Mruganka Kumar; Biradha, Kumar Origin of green photoluminescence in four-ring bent-core molecules with ESIPT, selective sensing of zinc ions by turn-on emission and their liquid crystal properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1386-1395 |
| 1549868 | CIF | C20 H20 Cl N3 O2 Pd | P 1 21 1 | 10.7684; 9.0383; 10.859 90; 118.567; 90 | 928.22 | Wu, Xiaolu; Yang, Zhi; Yan, Xinwen; Zhang, Pengfei; Wang, Lin; Guo, Ge; Dong, Yuping; Li, Xiaofang Polymerization of 1-chloro-2-phenylacetylene by cationic monoanionic tridentate (S,S)-bis(oxazolinylphenyl)amido-ligated palladium catalysts: is it a coordination‒insertion mechanism? Polymer Chemistry, 2018, 9, 4856 |
| 1549869 | CIF HKL Paper | C25 H47 N O7 | P 21 21 21 | 7.9093; 13.3712; 25.3669 90; 90; 90 | 2682.72 | Eitel, Michael; Schollmeyer, Dieter; Gross, Harald; Koch, Pierre (2<i>S</i>,3<i>S</i>)-2-Azaniumyl-4-[(1<i>S</i>,4a<i>S</i>,4b<i>S</i>,6<i>S</i>,7<i>S</i>,8a<i>S</i>,10a<i>S</i>)-6,7-dihydroxy-2,4b,8,8,10a-pentamethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]-3-methoxybutanoate‒methanol‒water (1/1/1) IUCrData, 2018, 3, x181194 |
| 1549870 | CIF HKL Paper | C9 H14 Br4 Co N4 | C 1 2/c 1 | 15.7782; 7.4076; 28.567 90; 95.7271; 90 | 3322.2 | Peppel, Tim; Spannenberg, Anke 3,3'-Dimethyl-1,1'-methylenediimidazolium tetrabromidocobaltate(II) IUCrData, 2018, 3, x181212 |
| 1549871 | CIF HKL Paper | C18 H13 Cl2 N O2 | P -1 | 7.4005; 10.4272; 10.5704 86.076; 72.382; 81.325 | 768.3 | Grinev, Vyacheslav S.; Osipov, Alexander K.; Yegorova, Alevtina Yu. (<i>Z</i>)-3-[(3,5-Dichloroanilino)methylidene]-5-(4-methylphenyl)furan-2(3<i>H</i>)-one IUCrData, 2018, 3, x181224 |
| 1549872 | CIF HKL Paper | C13 H13 N2 O7 | P -1 | 7.2618; 8.9419; 11.0001 85.545; 86.177; 75.248 | 687.84 | Dziuk, Błażej; Jezuita, Anna 2,2'-Bipyridin-1-ium hemioxalate oxalic acid monohydrate IUCrData, 2018, 3, x181219 |
| 1549873 | CIF | C28 H34 Cl Ir N2 | P -1 | 9.7423; 11.066; 12.1673 100.717; 104.685; 96.543 | 1228.72 | Wong, Chin Min; Fekete, Marianna; Nelson-Forde, Rhianna; Gatus, Mark R. D.; Rayner, Peter J.; Whitwood, Adrian C.; Duckett, Simon B.; Messerle, Barbara A. Harnessing asymmetric N-heterocyclic carbene ligands to optimise SABRE hyperpolarisation. Catalysis science & technology, 2018, 8, 4925-4933 |
| 1549874 | CIF | C13 H13 N O3 | P -1 | 5.8314; 9.95; 10.2599 71.126; 76.243; 77.203 | 540.33 | Glassner, Mathias; Verbraeken, Bart; Jerca, Valentin Victor; Van Hecke, Kristof; Tsanaktsidis, John; Hoogenboom, Richard Poly(2-oxazoline)s with pendant cubane groups Polymer Chemistry, 2018, 9, 4840 |
| 1549875 | CIF | C24 H22 Cl N O6 | P 1 21/c 1 | 5.33701; 17.9259; 21.5579 90; 92.9404; 90 | 2059.74 | Glassner, Mathias; Verbraeken, Bart; Jerca, Valentin Victor; Van Hecke, Kristof; Tsanaktsidis, John; Hoogenboom, Richard Poly(2-oxazoline)s with pendant cubane groups Polymer Chemistry, 2018, 9, 4840 |
| 1549876 | CIF | C13 H14 Cl N O3 | P b c a | 9.1082; 10.2539; 25.5319 90; 90; 90 | 2384.5 | Glassner, Mathias; Verbraeken, Bart; Jerca, Valentin Victor; Van Hecke, Kristof; Tsanaktsidis, John; Hoogenboom, Richard Poly(2-oxazoline)s with pendant cubane groups Polymer Chemistry, 2018, 9, 4840 |
| 1549877 | CIF | C44 H37 Cl4 N6 O1.5 | R -3 c :H | 16.521; 16.521; 49.1998 90; 90; 120 | 11629.6 | Tashiro, Shohei; Umeki, Tsutomu; Kubota, Ryou; Shionoya, Mitsuhiko Rational synthesis of benzimidazole[3]arenes by Cu<sup>II</sup>-catalyzed post-macrocyclization transformation. Chemical science, 2018, 9, 7614-7619 |
| 1549878 | CIF | C44 H32 Cl6 N6 | C 1 c 1 | 5.7565; 25.735; 26.34 90; 91.02; 90 | 3901.5 | Tashiro, Shohei; Umeki, Tsutomu; Kubota, Ryou; Shionoya, Mitsuhiko Rational synthesis of benzimidazole[3]arenes by Cu<sup>II</sup>-catalyzed post-macrocyclization transformation. Chemical science, 2018, 9, 7614-7619 |
| 1549879 | CIF | C63 H60 N6 O12 S3 | P -1 | 9.9758; 14.1235; 21.6617 98.632; 94.107; 107.17 | 2861.15 | Tashiro, Shohei; Umeki, Tsutomu; Kubota, Ryou; Shionoya, Mitsuhiko Rational synthesis of benzimidazole[3]arenes by Cu<sup>II</sup>-catalyzed post-macrocyclization transformation. Chemical science, 2018, 9, 7614-7619 |
| 1549880 | CIF | C17 H16 B Cd N8 O5 | P 1 21/c 1 | 9.2198; 14.0236; 15.7941 90; 105.723; 90 | 1965.69 | Wen, Tian; Zheng, Yao; Xu, Chaochen; Zhang, Jian; Jaroniec, Mietek; Qiao, Shi-Zhang A boron imidazolate framework with mechanochromic and electrocatalytic properties Materials Horizons, 2018, 5, 1151 |
| 1549881 | CIF | C13 H8 Br N O Se | P 1 21/n 1 | 7.6043; 13.4161; 11.8847 90; 103.676; 90 | 1178.1 | Shukla, Rahul; Claiser, Nicolas; Souhassou, Mohamed; Lecomte, Claude; Balkrishna, Shah Jaimin; Kumar, Sangit; Chopra, Deepak Exploring the simultaneous σ-hole/π-hole bonding characteristics of a Br···π interaction in an ebselen derivative <i>via</i> experimental and theoretical electron-density analysis IUCrJ, 2018, 5, 647-653 |
| 1549882 | CIF | C19 H18 N2 O2 | P 1 21/c 1 | 11.2477; 15.3784; 9.6298 90; 114.204; 90 | 1519.25 | Matsuura, Rei; Jankins, Tanner C.; Hill, David E.; Yang, Kin S.; Gallego, Gary M.; Yang, Shouliang; He, Mingying; Wang, Fen; Marsters, Rohan P.; McAlpine, Indrawan; Engle, Keary M. Palladium(ii)-catalyzed γ-selective hydroarylation of alkenyl carbonyl compounds with arylboronic acids. Chemical science, 2018, 9, 8363-8368 |
| 1549883 | CIF | C12 H18 N3 Na O7 | P 1 21/n 1 | 6.5197; 35.222; 7.231 90; 102.838; 90 | 1619 | Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J. Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers. Chemical science, 2018, 9, 8150-8159 |
| 1549884 | CIF | C65 H63 N11 O13 | I 1 2/a 1 | 35.5103; 9.6091; 37.3391 90; 103.589; 90 | 12384.3 | Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J. Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers. Chemical science, 2018, 9, 8150-8159 |
| 1549885 | CIF | C12 H16 N3 Na O6 | P -1 | 6.1765; 7.0883; 17.5927 88.175; 83.629; 69.716 | 717.98 | Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J. Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers. Chemical science, 2018, 9, 8150-8159 |
| 1549886 | CIF | C60 H30 N9 O9 | P -1 | 9.6864; 29.786; 34.468 71.898; 88.532; 89.954 | 9449.1 | Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J. Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers. Chemical science, 2018, 9, 8150-8159 |
| 1549887 | CIF | C75 H58 B Br Co F24 P4 | P 1 21/c 1 | 13.2806; 27.575; 20.326 90; 99.632; 90 | 7338.7 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549888 | CIF | C84 H67 B Co F24 P4 | P -1 | 13.0252; 17.6478; 18.721 103.179; 108.177; 99.43 | 3850.3 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549889 | CIF | C79 H60 B Co F24.5 P4 S | P -1 | 15.234; 17.698; 18.812 107.508; 101.067; 114.08 | 4117.5 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549890 | CIF | C79 H54 B Co F24 O P3 | P 1 21/n 1 | 14.313; 28.967; 18.3198 90; 104.992; 90 | 7336.9 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549891 | CIF | C86 H70 B Co F24 P3 | P -1 | 15.392; 16.404; 17.511 72.538; 72.836; 86.072 | 4028.8 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549892 | CIF | C80.5 H65 B Co F24 N P3 | P -1 | 12.6883; 18.4229; 18.5758 115.784; 99.469; 97.331 | 3758.4 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549893 | CIF | C77.75 H61.5 B Co F24.12 N P4 | P 1 21/n 1 | 18.5988; 21.2082; 18.9102 90; 90.121; 90 | 7459.1 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549894 | CIF | C75 H58 B Co F24 O P4 | P -1 | 13.183; 16.54; 16.808 82.81; 83.316; 84.81 | 3600.7 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549895 | CIF | C75 H59 B Co F24 P4 | P 1 21/c 1 | 11.8224; 19.1322; 33.4483 90; 97.5642; 90 | 7499.8 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549896 | CIF | C81 H64 B Co F25 O P4 | P -1 | 14.706; 15.1357; 19.031 71.3492; 83.8715; 80.5636 | 3952.6 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549897 | CIF | C83 H64 B Co F24 P4 | P 1 21/n 1 | 16.2021; 25.658; 18.5436 90; 90.185; 90 | 7708.8 | Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D. Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N). Chemical science, 2018, 9, 8234-8241 |
| 1549898 | CIF HKL Paper | C22 H36 N2 | P 1 21/n 1 | 5.6271; 21.1764; 8.2787 90; 105.86; 90 | 948.95 | Grace, P. Selvarathy; Nirmalram, Jeyaraman Selvaraj; Nayagam, B. Ravindran Durai; Schollmeyer, Dieter 1,1'-[(2,3,5,6-Tetramethyl-1,4-phenylene)bis(methylene)]dipiperidine IUCrData, 2018, 3, x181237 |
| 1549899 | CIF HKL Paper | C15 H14 N4 O3 | P 1 | 5.859; 7.479; 16.329 93.818; 91.29; 94.252 | 711.7 | Wang, Zhaodong; Ni, Haitao Methyl 4-{<i>N</i>'-[(1<i>E</i>)-1-(pyrazin-2-yl)ethylidene]hydrazinecarbonyl}benzoate IUCrData, 2018, 3, x181230 |
| 1549900 | CIF | O2 Ta0.5 Ti0.25 Zn0.25 | P 42/m n m | 4.6987; 4.6987; 9.1296 90; 90; 90 | 201.56 | Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y. Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta) Journal of Asian Ceramic Societies, 2018, 6, 247-253 |
| 1549901 | CIF | Nb0.5 O2 Ti0.25 Zn0.25 | P b c n | 4.67138; 5.65916; 5.00745 90; 90; 90 | 132.377 | Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y. Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta) Journal of Asian Ceramic Societies, 2018, 6, 247-253 |
| 1549902 | CIF | Mg0.25 Nb0.5 O2 Ti0.25 | P 42/m n m | 4.69585; 4.69585; 3.0426 90; 90; 90 | 67.092 | Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y. Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta) Journal of Asian Ceramic Societies, 2018, 6, 247-253 |
| 1549903 | CIF | Mg0.25 O2 Ta0.5 Ti0.25 | P 42/m n m | 4.6876; 4.6876; 9.1385 90; 90; 90 | 200.806 | Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y. Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta) Journal of Asian Ceramic Societies, 2018, 6, 247-253 |
| 1549904 | CIF | C17 H21 N O2 S | P -1 | 7.4134; 8.4142; 12.1239 84.72; 88.99; 84.549 | 749.62 | Llorente, Nuria; Fernández-Pérez, Héctor; Bauzá, Antonio; Frontera, Antonio; Vidal-Ferran, Anton Ni-Catalysed Intramolecular [4+4]-cycloadditions of bis-dienes towards eight-membered fused bicyclic systems: a combined experimental and computational study Catalysis Science & Technology, 2018, 8, 5251 |
| 1549905 | CIF | C16 H22 O4 | P -1 | 6.2605; 9.8392; 12.7844 67.7938; 88.4599; 84.1325 | 725.21 | Llorente, Nuria; Fernández-Pérez, Héctor; Bauzá, Antonio; Frontera, Antonio; Vidal-Ferran, Anton Ni-Catalysed Intramolecular [4+4]-cycloadditions of bis-dienes towards eight-membered fused bicyclic systems: a combined experimental and computational study Catalysis Science & Technology, 2018, 8, 5251 |
| 1549906 | CIF | C22 H18 N2 | P 21 21 21 | 7.652; 14.111; 15.379 90; 90; 90 | 1661 | Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes. Chemical science, 2018, 9, 8416-8425 |
| 1549907 | CIF | C26 H20 N2 | P -1 | 15.147; 15.449; 16.488 82.861; 80.898; 78.48 | 3716 | Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes. Chemical science, 2018, 9, 8416-8425 |
| 1549908 | CIF | C22 H18 N2 | P n a 21 | 13.252; 5.704; 42.601 90; 90; 90 | 3220 | Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes. Chemical science, 2018, 9, 8416-8425 |
| 1549909 | CIF | C33 H50.5 Ce0.5 N3 O1.5 | P 1 21/c 1 | 18.8567; 20.0714; 19.2011 90; 102.741; 90 | 7088.3 | Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D. Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes. Chemical science, 2018, 9, 8035-8045 |
| 1549910 | CIF | C62 H100 Br4 Ce2 Li2 N6 O4 | P 1 21/n 1 | 14.083; 17.4883; 15.0209 90; 99.155; 90 | 3652.34 | Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D. Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes. Chemical science, 2018, 9, 8035-8045 |
| 1549911 | CIF | C70 H105 Ce N8 O3 S2 | P 1 21/c 1 | 16.491; 25.6698; 18.9736 90; 100.574; 90 | 7895.5 | Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D. Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes. Chemical science, 2018, 9, 8035-8045 |
| 1549912 | CIF | C77 H93 Ce N6 O9 | P -1 | 17.1931; 18.0941; 18.142 60.078; 63.808; 83.013 | 4353.9 | Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D. Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes. Chemical science, 2018, 9, 8035-8045 |
| 1549913 | CIF | C76 H99 Ce N6 O9 | P -1 | 15.9574; 17.7857; 17.8098 62.686; 69.389; 77.518 | 4194.6 | Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D. Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes. Chemical science, 2018, 9, 8035-8045 |
| 1549914 | CIF | C84 H105 Ce N6 O3 | P 1 21/c 1 | 12.6458; 24.6116; 24.4523 90; 93.8; 90 | 7593.6 | Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D. Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes. Chemical science, 2018, 9, 8035-8045 |
| 1549915 | CIF | C72 H44 Au4 Fe2 N12 | C 1 c 1 | 33.2202; 13.2404; 15.202 90; 113.392; 90 | 6137 | Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer. Chemical science, 2018, 9, 8446-8452 |
| 1549916 | CIF | C72 H44 Au4 N12 Zn2 | C 1 c 1 | 33.4492; 13.0989; 16.2467 90; 112.538; 90 | 6574.8 | Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer. Chemical science, 2018, 9, 8446-8452 |
| 1549917 | CIF | C72 H44 Au4 Fe2 N12 | C 1 c 1 | 33.557; 13.117; 16.174 90; 112.407; 90 | 6581.8 | Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer. Chemical science, 2018, 9, 8446-8452 |
| 1549918 | CIF | C72 H44 Au4 N12 Zn2 | C 1 c 1 | 33.219; 12.9438; 16.3125 90; 111.934; 90 | 6506.3 | Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer. Chemical science, 2018, 9, 8446-8452 |
| 1549919 | CIF | C23 H16 N4 O S | P 21 21 21 | 7.8612; 9.8518; 27.1605 90; 90; 90 | 2103.5 | Wang, Chunfei; Cheng, Xiaoxiang; Tan, Jingyun; Ding, Zhaoyang; Wang, Wenjing; Yuan, Daqiang; Li, Gang; Zhang, Hongjie; Zhang, Xuanjun Reductive cleavage of C[double bond, length as m-dash]C bonds as a new strategy for turn-on dual fluorescence in effective sensing of H<sub>2</sub>S. Chemical science, 2018, 9, 8369-8374 |
| 1549920 | CIF | C17 H10 N3 S2 | P 1 21 1 | 8.7916; 5.6255; 14.7562 90; 95.407; 90 | 726.55 | Wang, Chunfei; Cheng, Xiaoxiang; Tan, Jingyun; Ding, Zhaoyang; Wang, Wenjing; Yuan, Daqiang; Li, Gang; Zhang, Hongjie; Zhang, Xuanjun Reductive cleavage of C[double bond, length as m-dash]C bonds as a new strategy for turn-on dual fluorescence in effective sensing of H<sub>2</sub>S. Chemical science, 2018, 9, 8369-8374 |
| 1549921 | CIF | C13 H17 N3 O4 | P -1 | 8.098; 10.0379; 10.4154 116.381; 111.697; 92.496 | 682.41 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549922 | CIF | C19 H21 N3 O5 | P -1 | 6.695; 10.327; 13.555 107.4; 92.61; 102.79 | 865.8 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549923 | CIF | C15 H19 N3 O4 | P 1 21/c 1 | 9.999; 17.469; 8.521 90; 98.76; 90 | 1471 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549924 | CIF | C14 H23 N3 O6 | P 1 21/n 1 | 8.789; 10.706; 17.342 90; 99.97; 90 | 1607.2 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549925 | CIF | C11 H10 N2 O4 | P 1 21/n 1 | 12.8188; 6.1493; 13.1714 90; 99.328; 90 | 1024.53 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549926 | CIF | C24 H31 N3 O5 | P 1 21/c 1 | 11.8801; 9.9317; 20.246 90; 104.31; 90 | 2314.7 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549927 | CIF | C20 H21 Cl3 D N3 O5 | P 1 21/n 1 | 6.747; 22.937; 13.927 90; 90.66; 90 | 2155.1 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549928 | CIF | C19 H28 N3 O7.5 | P 1 21/c 1 | 11.253; 15.863; 22.909 90; 99.957; 90 | 4027.8 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549929 | CIF | C15.5 H20.27 Cl N3 O4.64 | P -1 | 10.42; 13.2; 13.9 89.03; 85.92; 75.68 | 1847.8 | Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E. Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches. Chemical science, 2018, 9, 8242-8252 |
| 1549930 | CIF | C642 H612 Cl12 Co48 N72 O126 S48 | R -3 :H | 37.232; 37.232; 80.093 90; 90; 120 | 96152 | Geng, Dantong; Han, Xu; Bi, Yanfeng; Qin, Yucai; Li, Qiang; Huang, Liangliang; Zhou, Kun; Song, Lijuan; Zheng, Zhiping Merohedral icosahedral M<sub>48</sub> (M = Co<sup>II</sup>, Ni<sup>II</sup>) cage clusters supported by thiacalix[4]arene. Chemical science, 2018, 9, 8535-8541 |
| 1549931 | CIF | C642 H612 Cl12 N72 Ni48 O126 S48 | R -3 :H | 37.799; 37.799; 86.192 90; 90; 120 | 106649 | Geng, Dantong; Han, Xu; Bi, Yanfeng; Qin, Yucai; Li, Qiang; Huang, Liangliang; Zhou, Kun; Song, Lijuan; Zheng, Zhiping Merohedral icosahedral M<sub>48</sub> (M = Co<sup>II</sup>, Ni<sup>II</sup>) cage clusters supported by thiacalix[4]arene. Chemical science, 2018, 9, 8535-8541 |
| 1549932 | CIF | C18 H17 N O3 | P -1 | 8.596; 9.3242; 9.5215 101.132; 103.244; 96.071 | 719.84 | Li, Shuai-Shuai; Lv, Xintong; Ren, Didi; Shao, Chang-Lun; Liu, Qing; Xiao, Jian Redox-triggered cascade dearomative cyclizations enabled by hexafluoroisopropanol. Chemical science, 2018, 9, 8253-8259 |
| 1549933 | CIF | C49 H50 N6 O Y | P 1 2/n 1 | 22.637; 9.781; 23.089 90; 118.062; 90 | 4511 | Zhang, Dexing; Liu, Ruiting; Zhou, Xigeng Intramolecular alkene hydroamination and degradation of amidines: divergent behavior of rare earth metal amidinate intermediates Catalysis Science & Technology, 2018, 8, 5573 |
| 1549934 | CIF | C114 H108 N16 O12 | P 1 2/c 1 | 26.0567; 14.2086; 28.6868 90; 94.091; 90 | 10593.6 | Qu, Hang; Tang, Xiao; Wang, Xinchang; Li, Zhihao; Huang, Zheyu; Zhang, Hui; Tian, Zhongqun; Cao, Xiaoyu Chiral molecular face-rotating sandwich structures constructed through restricting the phenyl flipping of tetraphenylethylene. Chemical science, 2018, 9, 8814-8818 |
| 1549935 | CIF | C114 H108 N16 O12 | P c c n | 19.0205; 20.3813; 30.1755 90; 90; 90 | 11697.9 | Qu, Hang; Tang, Xiao; Wang, Xinchang; Li, Zhihao; Huang, Zheyu; Zhang, Hui; Tian, Zhongqun; Cao, Xiaoyu Chiral molecular face-rotating sandwich structures constructed through restricting the phenyl flipping of tetraphenylethylene. Chemical science, 2018, 9, 8814-8818 |
| 1549936 | CIF | C20 H26 Cu F18 N8 O P3 | C 1 2/m 1 | 22.923; 11.8528; 15.482 90; 127.476; 90 | 3338.3 | Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate. Chemical science, 2018, 9, 8307-8314 |
| 1549937 | CIF | C42 H59 Cu4 F24 N17 O4 P4 S4 | C 1 c 1 | 26.95; 11.628; 21.3978 90; 90.293; 90 | 6705.4 | Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate. Chemical science, 2018, 9, 8307-8314 |
| 1549938 | CIF | C22 H28 F18 N11 O P3 | P -1 | 10.1257; 12.8486; 14.7435 110.335; 96.001; 97.292 | 1761.1 | Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate. Chemical science, 2018, 9, 8307-8314 |
| 1549939 | CIF | C37 H36 Cl4 Cu3 F9 N16 O11 S3 | P 1 21/n 1 | 13.8276; 17.576; 22.488 90; 97.359; 90 | 5420.3 | Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate. Chemical science, 2018, 9, 8307-8314 |
| 1549940 | CIF | C15 H11 F O2 | I 1 2/a 1 | 13.2572; 5.1221; 16.7741 90; 97.5575; 90 | 1129.15 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549941 | CIF | C17 H15 F O2 | C 1 2/c 1 | 11.1604; 11.7655; 10.819 90; 114.318; 90 | 1294.57 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549942 | CIF | C17 H15 F O2 | P 1 21/c 1 | 8.5592; 12.9739; 12.3376 90; 102.407; 90 | 1338.05 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549943 | CIF | C15 H9 F3 O2 | P 1 21 1 | 4.3647; 11.5018; 12.3118 90; 94.065; 90 | 616.52 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549944 | CIF | C15 H9 Cl2 F O2 | P n m a | 6.0944; 30.676; 6.881 90; 90; 90 | 1286.4 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549945 | CIF | C17 H15 F O4 | C m c 21 | 31.944; 7.0229; 6.1827 90; 90; 90 | 1387.02 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549946 | CIF | C15 H9 F3 O2 | C 1 2/c 1 | 28.403; 6.1029; 6.9953 90; 102.753; 90 | 1182.66 | Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W. A quantitative reactivity scale for electrophilic fluorinating reagents. Chemical science, 2018, 9, 8692-8702 |
| 1549947 | CIF | C10 H12 N2 | P c a m | 8.99566; 21.5226; 9.8982 90; 90; 90 | 1916.39 | Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole IUCrJ, 2018, 5 |
| 1549948 | CIF | C10 H12 N2 | P c a 21 | 9.0006; 20.7778; 9.7487 90; 90; 90 | 1823.13 | Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole IUCrJ, 2018, 5 |
| 1549949 | CIF | C10 H12 N2 | P n a 21 | 8.6825; 42.095; 9.7523 90; 90; 90 | 3564.4 | Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole IUCrJ, 2018, 5 |
| 1549950 | CIF HKL Paper | C20 H19 N O2 | P 1 21/c 1 | 9.362; 11.6073; 15.0732 90; 98.859; 90 | 1618.43 | Biruntha, K.; Reuben Jonathan, D.; Mohamooda Sumaya, U.; Dravida Thendral, E. R. A.; Usha, G. Crystal structure of (3<i>E</i>)-3-{(2<i>E</i>)-3-[4-(dimethylamino)phenyl]prop-2-enylidene}-3,4-dihydro-2<i>H</i>-chromen-4-one IUCrData, 2018, 3, x181273 |
| 1549951 | CIF HKL Paper | C17 H24 N2 O S | P 1 21/n 1 | 12.0255; 8.9303; 15.8822 90; 95.813; 90 | 1696.84 | Al Garadi, Wedad; Ramli, Youssef; El Ghayati, Lhoussaine; El Hafi, Mohamed; Moussaif, Ahmed; Essassi, El Mokhtar; Mague, Joel T. 4-Phenyl-2,5,5a,6,7,8,9,9a-hexahydro-1<i>H</i>-1,5-benzodiazepine-2-thione ethanol monosolvate IUCrData, 2018, 3, x181276 |
| 1549952 | CIF HKL Paper | C21 H16 O4 | P -1 | 7.9937; 9.3819; 12.2131 72.552; 86.895; 67.288 | 804.06 | Sung, Jiha 6-Methoxy-2-(2-methoxynaphthalen-1-yl)-4<i>H</i>-chromen-4-one IUCrData, 2018, 3, x181277 |
| 1549953 | CIF | C18 H15 Au Cl Sb | P 21 21 21 | 10.9035; 11.9862; 12.6785 90; 90; 90 | 1656.97 | Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster. Chemical science, 2018, 9, 8723-8730 |
| 1549954 | CIF | C45.6 H51 Au2 Cl2 O0.9 Sb2 | P 1 21 1 | 12.1481; 29.298; 12.605 90; 94.0574; 90 | 4475.1 | Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster. Chemical science, 2018, 9, 8723-8730 |
| 1549955 | CIF | C85.25 H73.25 Au Cl6 Sb5 | P 1 21/c 1 | 18.6854; 14.9411; 28.657 90; 97.503; 90 | 7932 | Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster. Chemical science, 2018, 9, 8723-8730 |
| 1549956 | CIF | C169 H142 Au13 B Cl6 Sb8 | P 1 21/c 1 | 16.7528; 46.762; 22.2312 90; 96.6202; 90 | 17299.7 | Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster. Chemical science, 2018, 9, 8723-8730 |
| 1549957 | CIF | C77 H77 Au Cl2 Sb4 | P 1 2/c 1 | 24.5859; 11.8194; 26.9019 90; 116.277; 90 | 7009.6 | Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster. Chemical science, 2018, 9, 8723-8730 |
| 1549958 | CIF | C30 H46 F6 N8 Ni2 O4 S2 | C 1 2/c 1 | 23.2608; 10.7528; 17.423 90; 117.976; 90 | 3848.6 | Truong, Phan T.; Broering, Ellen P.; Dzul, Stephen P.; Chakraborty, Indranil; Stemmler, Timothy L.; Harrop, Todd C. Simultaneous nitrosylation and N-nitrosation of a Ni-thiolate model complex of Ni-containing SOD. Chemical science, 2018, 9, 8567-8574 |
| 1549959 | CIF | C63 H88 F12 N12 Ni2 O5 S4 | P -1 | 13.3985; 16.8518; 18.0347 112.816; 92.719; 91.167 | 3745.9 | Truong, Phan T.; Broering, Ellen P.; Dzul, Stephen P.; Chakraborty, Indranil; Stemmler, Timothy L.; Harrop, Todd C. Simultaneous nitrosylation and N-nitrosation of a Ni-thiolate model complex of Ni-containing SOD. Chemical science, 2018, 9, 8567-8574 |
| 1549960 | CIF | C54 H74 Fe2 N4 P3 | C 1 2/c 1 | 22.1222; 15.3352; 15.7519 90; 92.864; 90 | 5337.1 | Yao, Shenglai; Forstner, Viktoria; Menezes, Prashanth W.; Panda, Chakadola; Mebs, Stefan; Zolnhofer, Eva M.; Miehlich, Matthias E.; Szilvási, Tibor; Ashok Kumar, Nanjundan; Haumann, Michael; Meyer, Karsten; Grützmacher, Hansjörg; Driess, Matthias From an Fe<sub>2</sub>P<sub>3</sub> complex to FeP nanoparticles as efficient electrocatalysts for water-splitting. Chemical science, 2018, 9, 8590-8597 |
| 1549961 | CIF | C164 H244 Fe4 K2 N8 O14 P6 | C 1 2/m 1 | 18.0839; 18.8962; 13.6307 90; 115.729; 90 | 4196.05 | Yao, Shenglai; Forstner, Viktoria; Menezes, Prashanth W.; Panda, Chakadola; Mebs, Stefan; Zolnhofer, Eva M.; Miehlich, Matthias E.; Szilvási, Tibor; Ashok Kumar, Nanjundan; Haumann, Michael; Meyer, Karsten; Grützmacher, Hansjörg; Driess, Matthias From an Fe<sub>2</sub>P<sub>3</sub> complex to FeP nanoparticles as efficient electrocatalysts for water-splitting. Chemical science, 2018, 9, 8590-8597 |
| 1549962 | CIF | C34 H24 N4 O8 | C 1 c 1 | 24.7983; 10.6757; 12.3066 90; 101.737; 90 | 3189.92 | Schierl, Christoph; Niazov-Elkan, Angelica; Shimon, Linda J. W.; Feldman, Yishay; Rybtchinski, Boris; Guldi, Dirk M. Singlet fission in self-assembled PDI nanocrystals. Nanoscale, 2018, 10, 20147-20154 |
| 1549963 | CIF | C23 H16 Cl N3 O3 | P 21 21 21 | 11.0105; 11.0264; 15.8268 90; 90; 90 | 1921.47 | Chen, Qiao; Zhu, Tingshun; Majhi, Pankaj Kumar; Mou, Chengli; Chai, Huifang; Zhang, Jingjie; Zhuo, Shitian; Chi, Yonggui Robin Carbene-catalyzed enantioselective oxidative coupling of enals and di(hetero)arylmethanes. Chemical science, 2018, 9, 8711-8715 |
| 1549964 | CIF | C23 H16 Br N3 O3 | P 1 21 1 | 5.7355; 16.4707; 10.5767 90; 105.481; 90 | 962.91 | Chen, Qiao; Zhu, Tingshun; Majhi, Pankaj Kumar; Mou, Chengli; Chai, Huifang; Zhang, Jingjie; Zhuo, Shitian; Chi, Yonggui Robin Carbene-catalyzed enantioselective oxidative coupling of enals and di(hetero)arylmethanes. Chemical science, 2018, 9, 8711-8715 |
| 1549965 | CIF | C21 H27.5 Au F6 N2.5 P S2 | P 1 21/c 1 | 11.9382; 26.6092; 16.1416 90; 93.06; 90 | 5120.33 | Williams, Morwen; Bertrand, Benoît; Hughes, David L.; Waller, Zoe Ann Ella; Schmidt, Claudia; Ott, Ingo; O'Connell, Maria Anne; Searcey, Mark; Bochmann, Manfred Cyclometallated Au(III) dithiocarbamate complexes: synthesis, anticancer evaluation and mechanistic studies. Metallomics, 2018 |
| 1549966 | CIF HKL Paper | C30 H24 N4 O2 S | C 1 2/c 1 | 18.6131; 18.2243; 15.8867 90; 110.757; 90 | 5039.2 | Muthuselvi, C.; Athimoolam, S.; Srinivasan, N.; Ravikumar, B.; Pandiarajan, S.; Krishnakumar, R. V. Ethyl 6'-cyano-7'-phenyl-1',6',7',7a'-tetrahydro-3'<i>H</i>-spiro[indeno[1,2-<i>b</i>]quinoxaline-11,5'-pyrrolo[1,2-<i>c</i>]thiazole-6'-carboxylate IUCrData, 2018, 3, x181286 |
| 1549967 | CIF | C22 H19 N5 | P 1 21/n 1 | 6.8768; 15.854; 16.6138 90; 91.265; 90 | 1810.87 | Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging. Chemical science, 2018, 9, 8969-8974 |
| 1549968 | CIF | C23 H18 N5 O | P 1 21/c 1 | 11.7851; 19.9797; 8.1892 90; 97.235; 90 | 1912.9 | Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging. Chemical science, 2018, 9, 8969-8974 |
| 1549969 | CIF | C23 H18 N6 | P -1 | 8.038; 10.3402; 11.9954 73.536; 81.046; 84.939 | 943.44 | Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging. Chemical science, 2018, 9, 8969-8974 |
| 1549970 | CIF | C23 H18 F3 N5 | P 1 21/c 1 | 13.8657; 8.21008; 18.9838 90; 111.052; 90 | 2016.85 | Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging. Chemical science, 2018, 9, 8969-8974 |
| 1549971 | CIF | C38 H63 Cl2 Co N5 O8 S3 | P -1 | 8.8767; 14.5893; 19.0022 107.139; 97.232; 101.356 | 2260.7 | Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R. Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules. Chemical science, 2018, 9, 9018-9026 |
| 1549972 | CIF | C37 H57 Co N5 O6 S3 | P 1 21/n 1 | 21.1512; 9.0244; 21.2686 90; 95.072; 90 | 4043.8 | Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R. Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules. Chemical science, 2018, 9, 9018-9026 |
| 1549973 | CIF | C37 H57 N5 Ni O6 S3 | P 1 21/n 1 | 21.0944; 8.9422; 21.3506 90; 94.977; 90 | 4012.2 | Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R. Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules. Chemical science, 2018, 9, 9018-9026 |
| 1549974 | CIF | C39 H66 N5 Ni O8.5 S3 | P -1 | 8.9571; 14.5969; 18.6587 107.64; 99.252; 103.157 | 2193.3 | Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R. Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules. Chemical science, 2018, 9, 9018-9026 |
| 1549975 | CIF | C37 H57 Fe N5 O6 S3 | P 1 21/n 1 | 21.195; 9.0313; 21.2797 90; 94.91; 90 | 4058.4 | Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R. Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules. Chemical science, 2018, 9, 9018-9026 |
| 1549976 | CIF | C37 H59 Fe N5 O7 S3 | C 1 2/c 1 | 26.656; 9.6645; 31.5226 90; 90.44; 90 | 8120.5 | Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R. Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules. Chemical science, 2018, 9, 9018-9026 |
| 1549977 | CIF | C192 H288 Ag51.08 O0 | P -1 | 19.4375; 19.5121; 19.5367 100.446; 113.716; 102.272 | 6327.2 | Duan, Guang-Xiong; Tian, Lin; Wen, Jun-Bo; Li, Lan-Yun; Xie, Yun-Peng; Lu, Xing An atomically precise all-tert-butylethynide-protected Ag<sub>51</sub> superatom nanocluster with color tunability. Nanoscale, 2018, 10, 18915-18919 |
| 1549978 | CIF HKL Paper | C15 H9 F O3 | P 1 21/c 1 | 22.3701; 6.8836; 15.7987 90; 106.058; 90 | 2337.88 | Koh, Dongsoo 2-(2-Fluorophenyl)-3-hydroxy-4<i>H</i>-chromen-4-one IUCrData, 2018, 3, x181332 |
| 1549979 | CIF HKL Paper | C8 H12 N2 O8 | C 1 2/c 1 | 16.805; 8.3008; 15.7976 90; 100.259; 90 | 2168.5 | Seidel, Rüdiger W. Revision of the crystal structure of `bis(glycine) squaric acid' IUCrData, 2018, 3, x181324 |
| 1549980 | CIF HKL Paper | C18 H14 O2 S | P 1 21/n 1 | 13.0062; 5.9631; 18.3801 90; 104.019; 90 | 1383.05 | Hemanathan, K.; Raja, R.; Murugesan, K. Sakthi 8,9-Dimethoxybenzo[<i>b</i>]naphtho[2,3-<i>d</i>]thiophene IUCrData, 2018, 3, x181257 |
| 1549981 | CIF HKL Paper | C27 H22 N4 O2 | P 1 21/c 1 | 8.0233; 16.877; 17.013 90; 101.021; 90 | 2261.2 | Liu, Gang; Liu, Qingsong; Zhang, Huihui; Yu, Jianhua 2-(4-Aminophenyl)-3-[3,4-bis(pyridin-2-ylmethoxy)phenyl]acrylonitrile IUCrData, 2018, 3, x181329 |
| 1549982 | CIF HKL Paper | C13 H16 N4 O2 | P 1 21/n 1 | 9.069; 13.319; 11.851 90; 112.161; 90 | 1325.7 | Lahmidi, Sanae; El Hafi, Mohamed; Moussaif, Ahmed; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(5-methyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-7-yl)pent-4-enoate IUCrData, 2018, 3, x181280 |
| 1549983 | CIF HKL Paper | C17 H19 N O5 | P 1 21/c 1 | 8.462; 16.243; 11.477 90; 93.091; 90 | 1575.2 | Wang, Junjun; Zhu, Yin; Wang, Haiyan; Yang, Mingdi 3-Acetyl-7-(2-morpholin-4-yl-ethoxy)-chromen-2-one IUCrData, 2018, 3, x181327 |
| 1549984 | CIF | C35 H32 N2 O4 | P -1 | 10.1174; 10.6043; 14.0472 83.956; 72.182; 87.318 | 1426.66 | Emandi, Ganapathi; Flanagan, Keith J.; Senge, Mathias O. Fluorescent imidazole-based chemosensors for the reversible detection of cyanide and mercury ions. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1450-1461 |
| 1549985 | CIF | C35 H34 N2 O5 S | P 1 21/c 1 | 9.5779; 29.6464; 10.7257 90; 92.205; 90 | 3043.31 | Emandi, Ganapathi; Flanagan, Keith J.; Senge, Mathias O. Fluorescent imidazole-based chemosensors for the reversible detection of cyanide and mercury ions. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1450-1461 |
| 1549986 | CIF | C Cs3 O8 V | C 1 m 1 | 9.447; 10.129; 6.1571 90; 123.42; 90 | 491.7 | Zou, Guohong; Lin, Zhien; Zeng, Hongmei; Jo, Hongil; Lim, Seong-Ji; You, Tae-Soo; Ok, Kang Min Cs<sub>3</sub>VO(O<sub>2</sub>)<sub>2</sub>CO<sub>3</sub>: an exceptionally thermostable carbonatoperoxovanadate with an extremely large second-harmonic generation response. Chemical science, 2018, 9, 8957-8961 |
| 1549987 | CIF HKL Paper | C17 H18 O2 | P -1 | 7.841; 8.203; 11.08 79.131; 85.616; 74.077 | 672.8 | Goyal, Navneet; Donahue, James P.; Do, Camilla; Perry, Timothy; Bongay-Williams, Kyla; Foroozesh, Maryam A dibenzofuran derivative: 2-(pentyloxy)dibenzo[<i>b</i>,<i>d</i>]furan IUCrData, 2018, 3, x181306 |
| 1549988 | CIF HKL Paper | C21 H15 N3 O3 | P 1 21/c 1 | 10.1759; 23.521; 7.4038 90; 95.674; 90 | 1763.4 | Rao, Qingpeng; Wang, Zepeng; Yang, Mingdi; Wu, Zhichao (<i>Z</i>)-2-(4-Nitrophenyl)-3-[4-(pyridin-4-ylmethoxy)phenyl]acrylonitrile IUCrData, 2018, 3, x181328 |
| 1549989 | CIF HKL Paper | C11 H11 N3 O4 | P -1 | 10.1251; 11.1335; 15.9006 102.745; 101.1; 101.52 | 1659.74 | Marten, Jan; Seichter, Wilhelm; Weber, Edwin 3-[2-(3-Nitrophenyl)hydrazin-1-ylidene]pentane-2,4-dione IUCrData, 2018, 3, x181344 |
| 1549990 | CIF | O7 Sm3 Ta | P n m a | 7.6514; 10.8663; 7.5886 90; 90; 90 | 630.93 | Hinatsu, Y.; Doi, Y. Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1473 K Journal of the Ceramic Society of Japan, 2018, 126, 743-749 |
| 1549991 | CIF | O7 Sm3 Ta | C 2 2 21 | 10.7818; 7.6197; 7.6556 90; 90; 90 | 628.94 | Hinatsu, Y.; Doi, Y. Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1073 K Journal of the Ceramic Society of Japan, 2018, 126, 743-749 |
| 1549992 | CIF | Eu0.6 Nb O7 Sm2.4 | C 2 2 21 | 10.7488; 7.6036; 7.6521 90; 90; 90 | 625.4 | Hinatsu, Y.; Doi, Y. Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 973 K Journal of the Ceramic Society of Japan, 2018, 126, 743-749 |
| 1549993 | CIF | Eu0.6 Nb O7 Sm2.4 | P n m a | 7.6451; 10.8612; 7.5613 90; 90; 90 | 627.85 | Hinatsu, Y.; Doi, Y. Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1473 K Journal of the Ceramic Society of Japan, 2018, 126, 743-749 |
| 1549994 | CIF | Ba0.333 Co O2.98 Pr0.667 | P n m a | 5.443765; 7.693164; 5.452008 90; 90; 90 | 228.329 | Zhang, W.; Shiraiwa, M.; Wang, N.; Ma, T.; Fujii, K.; Niwa, E.; Yashima, M. Pr/Ba cation-disordered perovskite Pr2/3Ba1/3CoO3-d as a new bifunctional electrocatalyst for oxygen reduction and oxygen evolution reactions Journal of the Ceramic Society of Japan, 2018, 126, 814-819 |
| 1549995 | CIF | C58 H46 O | P 1 21/c 1 | 11.9262; 37.245; 9.5161 90; 102.531; 90 | 4126.3 | Hsu, Li-Yun; Maity, Subhendu; Matsunaga, Yuki; Hsu, Ying-Feng; Liu, Yi-Hung; Peng, Shie-Ming; Shinmyozu, Teruo; Yang, Jye-Shane Photomechanochromic <i>vs.</i> mechanochromic fluorescence of a unichromophoric bimodal molecular solid: multicolour fluorescence patterning. Chemical science, 2018, 9, 8990-9001 |
| 1549996 | CIF | C58 H46 O | P 1 21/c 1 | 11.7855; 9.0557; 38.491 90; 97.711; 90 | 4070.8 | Hsu, Li-Yun; Maity, Subhendu; Matsunaga, Yuki; Hsu, Ying-Feng; Liu, Yi-Hung; Peng, Shie-Ming; Shinmyozu, Teruo; Yang, Jye-Shane Photomechanochromic <i>vs.</i> mechanochromic fluorescence of a unichromophoric bimodal molecular solid: multicolour fluorescence patterning. Chemical science, 2018, 9, 8990-9001 |
| 1549997 | CIF | C58 H46 O | P 1 21/c 1 | 11.8126; 9.1189; 38.869 90; 98.321; 90 | 4142.8 | Hsu, Li-Yun; Maity, Subhendu; Matsunaga, Yuki; Hsu, Ying-Feng; Liu, Yi-Hung; Peng, Shie-Ming; Shinmyozu, Teruo; Yang, Jye-Shane Photomechanochromic <i>vs.</i> mechanochromic fluorescence of a unichromophoric bimodal molecular solid: multicolour fluorescence patterning. Chemical science, 2018, 9, 8990-9001 |
| 1549998 | CIF | C16 H104 Mn Mo12 N16 O74 P8 | P 1 21/n 1 | 15.8641; 15.937; 17.1695 90; 92.645; 90 | 4336.3 | Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water Chemical Science, 2018 |
| 1549999 | CIF | K16 Mn40 Mo96 Na8 O560 P68 | I 41/a c d | 27.4698; 27.4698; 39.881 90; 90; 90 | 30094 | Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water Chemical Science, 2018 |
| 1550000 | CIF | Co10 Mn30 Mo96 Na24 O576 P68 | I 41/a c d | 26.9679; 26.9679; 41.154 90; 90; 90 | 29930 | Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water Chemical Science, 2018 |
| 1550001 | CIF | C57 Al F45 O3 | P -1 | 13.5287; 14.9354; 15.4422 87.648; 65.253; 71.914 | 2679.32 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550002 | CIF | C61 H8 Al F46 O4 Tl | P -1 | 12.8874; 13.362; 19.1533 81.244; 86.346; 65.335 | 2962.37 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550003 | CIF | C77 H17 Al Cl2 F46 O3 | P -1 | 11.872; 13.5786; 22.6501 83.441; 84.275; 85.147 | 3599.41 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550004 | CIF | C67 H10 Al F46 Fe O3 | P 1 | 11.6429; 11.6834; 12.0655 97.981; 101.382; 98.8 | 1565.64 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550005 | CIF | C68 H16 Al F45 O4 | P -1 | 12.9745; 14.9114; 32.7214 84.388; 88.756; 88.372 | 6296.5 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550006 | CIF | C68 H18 Al F45 O4 | P -1 | 12.473; 12.4862; 24.3363 92.264; 102.069; 109.518 | 3468.7 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550007 | CIF | C65 H20 Al F46 Li O5 | P 1 21/n 1 | 13.5375; 24.2062; 20.9262 90; 104.02; 90 | 6653.1 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550008 | CIF | C73 H32 Al Cs F46 O7 | P -1 | 13.4499; 13.5054; 44.2327 98.198; 92.575; 90.287 | 7944 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550009 | CIF | C66 H11 Al F45 N O3 | P -1 | 13.2289; 14.1466; 17.4224 86.299; 85.794; 67.503 | 3001.9 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550010 | CIF | C63 H15 Al F45 O4 P | P 1 21/c 1 | 24.8884; 23.4948; 22.4273 90; 105.82; 90 | 12617.6 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550011 | CIF | C76 H15 Al Cl F45 O3 | P -1 | 13.8546; 14.2421; 20.1247 94.513; 96.029; 119.026 | 3414.42 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550012 | CIF | C73 H36 Al F46 N O3 | P -1 | 13.3297; 14.3059; 22.5568 71.867; 75.445; 63.622 | 3629.8 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550013 | CIF | C63 H13 Ag Al F46 N O4 | P 1 21/c 1 | 11.7732; 24.2075; 21.9598 90; 90.568; 90 | 6258.2 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550014 | CIF | C62 H5 Al F45 N O3 | P -1 | 22.4236; 24.0454; 29.527 91.684; 111.56; 98.389 | 14588.4 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
| 1550016 | CIF | Al O4 P | P 1 2/a 1 | 8.7802; 4.9087; 10.9191 90; 90.33; 90 | 470.599 | Kanzaki, M. Temperature-induced phase transition of AlPO4-moganite studies by in-situ Raman spectroscopy : alpha phase model optimized by DFT Journal of Mineralogical and Petrological Sciences, 2018, 113, 126-134 |
| 1550017 | CIF | Al O4 P | P m a a | 9.0682; 4.8904; 10.9793 90; 90; 90 | 486.9 | Kanzaki, M. Temperature-induced phase transition of AlPO4-moganite studies by in-situ Raman spectroscopy : beta phase model optimized by DFT Journal of Mineralogical and Petrological Sciences, 2018, 113, 126-134 |
| 1550018 | CIF | C23 H24 Cl F Ir N | P -1 | 9.2681; 10.4733; 10.8722 82.9875; 85.2833; 74.7986 | 1009.4 | Chen, Xiao-Yang; Sorensen, Erik J. Ir(iii)-catalyzed <i>ortho</i> C-H alkylations of (hetero)aromatic aldehydes using alkyl boron reagents. Chemical science, 2018, 9, 8951-8956 |
| 1550019 | CIF | C38 H23 N3 O26 S8 | P 1 n 1 | 11.0583; 10.7138; 21.6433 90; 91.862; 90 | 2562.87 | Jeamet, Emeric; Septavaux, Jean; Héloin, Alexandre; Donnier-Maréchal, Marion; Dumartin, Melissa; OURRI, Benjamin; Mandal, Pradeep Kumar; Huc, Ivan; Bignon, Emmanuelle; Dumont, Elise; Morell, Christophe; Francoia, Jean-Patrick; PERRET, Florent; Vial, Laurent; Leclaire, Julien Wetting the lock and key enthalpically favours polyelectrolytes binding Chemical Science, 2018 |
| 1550020 | CIF | C25 H19 N O2 S | P 1 21/c 1 | 13.4762; 15.1134; 10.0992 90; 107.105; 90 | 1965.93 | Mao, Zhu; Yang, Zhan; Fan, Zhenguo; Ubba, Eethamukkala; Li, Wenlang; Li, Yang; Zhao, Juan; Yang, Zhiyong; Aldred, Matthew Phillip; Chi, Zhenguo Methylation-effect in Prolonging the Pure Organic Room Temperature Phosphorescence Lifetime Chemical Science, 2018 |
| 1550021 | CIF | C27 H23 N O2 S | C 1 2/c 1 | 21.0963; 12.9096; 15.8774 90; 101.148; 90 | 4242.5 | Mao, Zhu; Yang, Zhan; Fan, Zhenguo; Ubba, Eethamukkala; Li, Wenlang; Li, Yang; Zhao, Juan; Yang, Zhiyong; Aldred, Matthew Phillip; Chi, Zhenguo Methylation-effect in Prolonging the Pure Organic Room Temperature Phosphorescence Lifetime Chemical Science, 2018 |
| 1550022 | CIF | C6 H6 N2 O2 | P 1 21/n 1 | 5.2532; 5.321; 10.9671 90; 101.974; 90 | 299.89 | Sieuw, Louis; Jouhara, Alia; Quarez, Eric; Auger, Chloe; Gohy, Jean-François; Poizot, Philippe; Vlad, Alexandru H-bond Stabilized Quinone Electrode Material for Li-Organic Batteries: the Strength of Weak Bonds Chemical Science, 2018 |
| 1550023 | CIF | C55 H78 Cl2 F6 Ir N8 P | P 1 21/c 1 | 15.8369; 16.9326; 21.2999 90; 97.044; 90 | 5668.7 | Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions Chemical Science, 2018 |
| 1550024 | CIF | C54.25 H24 F20.75 Ir N8 O0.75 S0.25 | P 1 21/c 1 | 24.7628; 23.6873; 39.6486 90; 95.9405; 90 | 23131.5 | Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions Chemical Science, 2018 |
| 1550025 | CIF | C54 H64 F6 Ir N8 P | C 1 2/c 1 | 17.9784; 15.124; 19.0318 90; 108.004; 90 | 4921.5 | Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions Chemical Science, 2018 |
| 1550026 | CIF | C58.12 H52.25 Cl0.25 F6 Ir N8 P | P -1 | 12.7322; 16.8417; 26.2843 77.893; 84.194; 78.728 | 5393.9 | Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions Chemical Science, 2018 |
| 1550027 | CIF HKL Paper | C21.5 H20.5 Br N6.5 O0.5 S | P -1 | 9.9957; 14.5325; 15.8353 81.671; 81.344; 80.469 | 2225.6 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 5-[(4-Bromophenyl)diazenyl]-2-{2-[1-(1<i>H</i>-indol-3-yl)ethylidene]hydrazinyl}-4-methylthiazole dimethylformamide hemisolvate IUCrData, 2018, 3, x181378 |
| 1550028 | CIF HKL Paper | C17 H17 N5 O S | P -1 | 9.0292; 9.864; 10.8754 111.021; 105.103; 96.945 | 847.86 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 5-Methyl-1-(4-methylphenyl)-N′-[1-(thiophen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide IUCrData, 2018, 3 |
| 1550029 | CIF | C14 H22 N2 O | P n a 21 | 23.0581; 16.6608; 15.1185 90; 90; 90 | 5808 | Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C. A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure. Soft matter, 2018, 14, 8821-8827 |
| 1550030 | CIF | C14 H22 N2 O | P 1 21/c 1 | 12.9354; 11.92; 27.3126 90; 93.311; 90 | 4204.3 | Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C. A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure. Soft matter, 2018, 14, 8821-8827 |
| 1550031 | CIF | C17 H28 N2 O | P 21 21 21 | 8.8209; 19.6496; 20.2318 90; 90; 90 | 3506.72 | Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C. A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure. Soft matter, 2018, 14, 8821-8827 |
| 1550033 | CIF | C37 H46 B Cl2 Cu F4 N8 | P 1 21/c 1 | 20.808; 31.071; 12.2164 90; 90.694; 90 | 7897.6 | Zelenay, Benjamin; Besora, Maria; Monasterio, Zaira; Ventura-Espinosa, David; White, Andrew J. P.; Maseras, Feliu; Díez-González, Silvia Copper-mediated reduction of azides under seemingly oxidising conditions: catalytic and computational studies Catalysis Science & Technology, 2018, 8, 5763 |
| 1550034 | CIF | C33.5 H41 Cl Cu F3 N4 O3 S | P 1 21/n 1 | 12.3905; 19.0233; 14.481 90; 102.996; 90 | 3325.86 | Zelenay, Benjamin; Besora, Maria; Monasterio, Zaira; Ventura-Espinosa, David; White, Andrew J. P.; Maseras, Feliu; Díez-González, Silvia Copper-mediated reduction of azides under seemingly oxidising conditions: catalytic and computational studies Catalysis Science & Technology, 2018, 8, 5763 |
| 1550035 | CIF | C37 H44 Cu F3 N4 O3 S | P -1 | 9.1002; 10.9858; 19.3481 89.693; 79.192; 82.793 | 1884.64 | Zelenay, Benjamin; Besora, Maria; Monasterio, Zaira; Ventura-Espinosa, David; White, Andrew J. P.; Maseras, Feliu; Díez-González, Silvia Copper-mediated reduction of azides under seemingly oxidising conditions: catalytic and computational studies Catalysis Science & Technology, 2018, 8, 5763 |
| 1550038 | CIF | C12 H14 F N O3 | P 21 21 21 | 8.9101; 9.4553; 14.4099 90; 90; 90 | 1214 | Guan, Yu-Qing; Han, Zhengyu; Li, Xiuxiu; You, Cai; Tan, Xuefeng; Lv, Hui; Zhang, Xumu A cheap metal for a challenging task: nickel-catalyzed highly diastereo- and enantioselective hydrogenation of tetrasubstituted fluorinated enamides Chemical Science, 2018 |
| 1550040 | CIF | C138 H148 Br8 Cl4 N12 Zn2 | P -1 | 17.6822; 17.7483; 25.194 78.121; 77.607; 60.899 | 6699.7 | Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G. Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters. Chemical communications (Cambridge, England), 2018, 54, 12586-12589 |
| 1550041 | CIF | C33 H42 Cl10 N4 | C 1 2/c 1 | 16.0787; 21.553; 24.176 90; 94.498; 90 | 8352.2 | Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G. Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters. Chemical communications (Cambridge, England), 2018, 54, 12586-12589 |
| 1550042 | CIF | C64 H80 Cl12 N8 Zn2 | P b c a | 21.712; 13.037; 54.215 90; 90; 90 | 15346 | Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G. Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters. Chemical communications (Cambridge, England), 2018, 54, 12586-12589 |
| 1550043 | CIF | C74 H102 Cl28 N8 | P -1 | 12.838; 15.476; 27.491 98.93; 92.92; 110.32 | 5027 | Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G. Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters. Chemical communications (Cambridge, England), 2018, 54, 12586-12589 |
| 1550044 | CIF | C22 H26 I Ir N4 | P -1 | 8.5611; 10.9802; 13.2254 109.051; 102.4; 90.413 | 1143.69 | Semwal, Shrivats; Kumar, Abhishek; Choudhury, Joyanta Iridium‒NHC-based catalyst for ambient pressure storage and low temperature release of H2via the CO2/HCO2H couple Catalysis Science & Technology, 2018, 8, 6137 |
| 1550047 | CIF | C64 H70 B Dy F20 | P 1 21/n 1 | 15.2173; 22.8792; 16.8807 90; 90.605; 90 | 5876.9 | Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G. High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets. Chemical science, 2018, 9, 8492-8503 |
| 1550048 | CIF | C62 H66 B Dy F20 | P 1 21/n 1 | 14.9801; 23.0586; 16.7069 90; 90.789; 90 | 5770.4 | Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G. High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets. Chemical science, 2018, 9, 8492-8503 |
| 1550049 | CIF | C58 H58 B Dy F20 | P 1 21 1 | 16.5863; 14.4989; 22.708 90; 90.0586; 90 | 5460.9 | Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G. High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets. Chemical science, 2018, 9, 8492-8503 |
| 1550050 | CIF | C60 H62 B Dy F20 | P 1 21/c 1 | 14.5; 16.63; 46.59 90; 90.027; 90 | 11234 | Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G. High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets. Chemical science, 2018, 9, 8492-8503 |
| 1550055 | CIF | C36 H58 N4 O2 Zn | P 1 21/n 1 | 17.3189; 12.4391; 17.5819 90; 104.339; 90 | 3669.7 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550056 | CIF | C22 H30 N4 O2 Zn | P -4 21 c | 24.0631; 24.0631; 7.4652 90; 90; 90 | 4322.6 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550057 | CIF | C25.5 H30 Cl4 Mg N4 O2 | C 1 2/c 1 | 39.731; 11.9213; 23.8229 90; 99.266; 90 | 11136.4 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550058 | CIF | C23.5 H30 N4 O2 Zn | P 1 21 1 | 12.093; 14.8544; 13.2064 90; 105.887; 90 | 2281.7 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550059 | CIF | C38 H62 Mg N4 O2 | I 1 2/a 1 | 17.113; 15.0517; 29.9562 90; 90.872; 90 | 7715.22 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550060 | CIF | C36 H58 Mg N4 O2 | P 1 21/c 1 | 19.8993; 14.4435; 25.6572 90; 92.143; 90 | 7369.12 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550061 | CIF | C54 H84 N4 O2 Zn | P 1 21/n 1 | 13.4614; 11.975; 31.039 90; 90.965; 90 | 5002.8 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550062 | CIF | C47 H52 Cl8 N8 O4 Zn2 | P -1 | 11.3788; 11.6856; 21.1747 105.712; 94.301; 104.647 | 2590.97 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550063 | CIF | C38 H62 N4 O2 Zn | I 1 2/a 1 | 17.0865; 15.0333; 30.0246 90; 91.193; 90 | 7710.6 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550064 | CIF | C40 H52 Mg2 N8 O4 | P 1 21/n 1 | 9.4092; 13.8925; 14.8093 90; 95.647; 90 | 1926.4 | McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D. Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide Polymer Chemistry, 2018, 9, 5339 |
| 1550065 | CIF | C72 H92 N6 Si2 | P -1 | 10.4966; 12.3975; 13.2265 104.289; 99.208; 101.826 | 1591.78 | Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule. Chemical science, 2018, 9, 8474-8481 |
| 1550066 | CIF | C156 H212 Co2 Gd2 N8 O18 P6 Si2 | P -1 | 10.3106; 14.6582; 27.9536 75.075; 86.248; 70.983 | 3858.64 | Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule. Chemical science, 2018, 9, 8474-8481 |
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