Crystallography Open Database
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Searching journal of publication like 'Chemical science' volume of publication is 12
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1559358 | CIF | C55 H40 Cl2 O2 | P 1 21/c 1 | 14.5132; 21.9543; 12.9943 90; 94.23; 90 | 4129.1 | Mamada, Masashi; Nakamura, Ryota; Adachi, Chihaya Synthesis, crystal structure and charge transport characteristics of stable <i>peri</i>-tetracene analogues. Chemical science, 2020, 12, 552-558 |
1559359 | CIF | C65 H58 Cl2 Si2 | P -1 | 11.6467; 13.896; 16.8565 92.613; 102.408; 104.007 | 2571.41 | Mamada, Masashi; Nakamura, Ryota; Adachi, Chihaya Synthesis, crystal structure and charge transport characteristics of stable <i>peri</i>-tetracene analogues. Chemical science, 2020, 12, 552-558 |
1559386 | CIF | C32 H24 B F4 N | P 1 21/c 1 | 12.586; 15.1416; 13.4977 90; 97.253; 90 | 2551.7 | Li, Qiyao; Gong, Junyi; Li, Ying; Zhang, Ruoyao; Wang, Haoran; Zhang, Jianquan; Yan, He; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Li, Min-Hui; Wang, Jianguo; Tang, Ben Zhong Unusual light-driven amplification through unexpected regioselective photogeneration of five-membered azaheterocyclic AIEgen. Chemical science, 2020, 12, 709-717 |
1559387 | CIF | C33 H22 B Cl6 F4 N | P 1 21/c 1 | 11.07767; 21.641; 13.7711 90; 101.839; 90 | 3231.15 | Li, Qiyao; Gong, Junyi; Li, Ying; Zhang, Ruoyao; Wang, Haoran; Zhang, Jianquan; Yan, He; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Li, Min-Hui; Wang, Jianguo; Tang, Ben Zhong Unusual light-driven amplification through unexpected regioselective photogeneration of five-membered azaheterocyclic AIEgen. Chemical science, 2020, 12, 709-717 |
1559388 | CIF | C31 H22 F6 N P | P -1 | 8.5484; 11.4387; 13.608 103.553; 90.551; 98.266 | 1278.84 | Li, Qiyao; Gong, Junyi; Li, Ying; Zhang, Ruoyao; Wang, Haoran; Zhang, Jianquan; Yan, He; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Li, Min-Hui; Wang, Jianguo; Tang, Ben Zhong Unusual light-driven amplification through unexpected regioselective photogeneration of five-membered azaheterocyclic AIEgen. Chemical science, 2020, 12, 709-717 |
1559389 | CIF | C31 H22 B F4 N | P -1 | 8.4537; 11.0248; 13.8145 108.087; 95.552; 99.64 | 1191.32 | Li, Qiyao; Gong, Junyi; Li, Ying; Zhang, Ruoyao; Wang, Haoran; Zhang, Jianquan; Yan, He; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Li, Min-Hui; Wang, Jianguo; Tang, Ben Zhong Unusual light-driven amplification through unexpected regioselective photogeneration of five-membered azaheterocyclic AIEgen. Chemical science, 2020, 12, 709-717 |
1559390 | CIF | C32 H22 B F4 N | P b c a | 15.62776; 16.52398; 18.67576 90; 90; 90 | 4822.69 | Li, Qiyao; Gong, Junyi; Li, Ying; Zhang, Ruoyao; Wang, Haoran; Zhang, Jianquan; Yan, He; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Li, Min-Hui; Wang, Jianguo; Tang, Ben Zhong Unusual light-driven amplification through unexpected regioselective photogeneration of five-membered azaheterocyclic AIEgen. Chemical science, 2020, 12, 709-717 |
1559577 | CIF | C41 H50 Au B N2 | P -1 | 10.5714; 18.1828; 20.589 72.838; 89.216; 74.717 | 3638.8 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559578 | CIF | C60 H70 Au B N4 | P -1 | 11.951; 12.9306; 18.7852 96.941; 104.913; 104.703 | 2658.95 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559579 | CIF | C48 H60 Au B N4 | C 1 c 1 | 14.021; 17.7771; 17.7051 90; 97.0981; 90 | 4379.22 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559580 | CIF | C50 H59 Au B N3 | P -1 | 12.3065; 17.99; 20.3257 83.34; 79.742; 83.084 | 4375.21 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559581 | CIF | C59 H68 Au B N4 | P -1 | 11.5634; 12.8016; 18.2287 86.266; 72.324; 83.521 | 2553.22 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559582 | CIF | C102 H122 Au2 B2 Cl2 F2 N4 O2 | P 1 21/n 1 | 10.7485; 22.6769; 19.5737 90; 104.387; 90 | 4621.34 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559583 | CIF | C54 H72 Au B N4 | C 1 2/c 1 | 12.3058; 26.0004; 16.284 90; 100.267; 90 | 5126.7 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559584 | CIF | C46 H55 Au B N3 | P -1 | 10.7603; 11.6039; 19.3138 72.527; 85.454; 66.378 | 2105.21 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559585 | CIF | C54 H62 Au B N2 O | P -1 | 11.8822; 12.58; 17.5818 99.538; 106.748; 103.924 | 2363.27 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559586 | CIF | C63 H78 Au B N4 O | P 1 21/n 1 | 13.6039; 23.0648; 18.7378 90; 105.489; 90 | 5665.85 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559587 | CIF | C54 H60 Au B N2 O | P b c a | 18.4407; 23.6412; 21.238 90; 90; 90 | 9258.9 | Suzuki, Akane; Guo, Xueying; Lin, Zhenyang; Yamashita, Makoto Nucleophilic reactivity of the gold atom in a diarylborylgold(i) complex toward polar multiple bonds. Chemical science, 2020, 12, 917-928 |
1559588 | CIF | C22 H13 Au2 Fe N7 O2 | P 1 2/n 1 | 10.4618; 11.5106; 10.467 90; 95.605; 90 | 1254.43 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559589 | CIF | C16 H8 Au2 Fe N6 | C 1 2/m 1 | 12.0682; 16.9687; 11.4632 90; 94.888; 90 | 2338.92 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559590 | CIF | C22 H13 Au2 Fe N7 O2 | P 1 2/n 1 | 10.2342; 11.269; 10.2384 90; 92.665; 90 | 1179.51 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559591 | CIF | C22 H13 Au2 Fe N7 O2 | P 1 2/n 1 | 10.1143; 11.1281; 10.1146 90; 91.745; 90 | 1137.9 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559592 | CIF | C22 H13 Au2 Fe N7 O2 | P 1 2/n 1 | 10.3534; 11.3911; 10.3639 90; 93.954; 90 | 1219.37 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559593 | CIF | C22 H13 Au2 Fe N7 O2 | I 1 2/a 1 | 14.1982; 22.6765; 14.9567 90; 90.0258; 90 | 4815.54 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559594 | CIF | C22 H13 Au2 Fe N7 O2 | P 1 2/n 1 | 10.115; 11.1318; 10.1239 90; 91.852; 90 | 1139.34 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559595 | CIF | C22 H13 Au2 Fe N7 O2 | P 1 2/n 1 | 10.4523; 11.4885; 10.5004 90; 93.379; 90 | 1258.71 | Piñeiro-López, Lucía; Valverde-Muñoz, Francisco-Javier; Trzop, Elzbieta; Muñoz, M Carmen; Seredyuk, Maksym; Castells-Gil, Javier; da Silva, Iván; Martí-Gastaldo, Carlos; Collet, Eric; Real, José Antonio Guest induced reversible on-off switching of elastic frustration in a 3D spin crossover coordination polymer with room temperature hysteretic behaviour. Chemical science, 2020, 12, 1317-1326 |
1559596 | CIF | C54 H126 Ce2 O6 Si6 | P 1 21/n 1 | 12.6609; 23.0055; 12.7568 90; 109.44; 90 | 3503.8 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559597 | CIF | C42 H108 Ce2 Cl4 N6 O2 Si12 | P 1 21/n 1 | 10.868; 16.755; 20.149 90; 90.235; 90 | 3669 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559598 | CIF | C57 H136 Ce2 N6 O2 Si12 | P -1 | 11.4339; 12.0881; 17.5236 83.3194; 71.7094; 63.9637 | 2065.6 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559599 | CIF | C68 H84 Ce2 N8 O9 | P -1 | 11.859; 14.7713; 19.126 79.676; 76.075; 81.398 | 3179.3 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559600 | CIF | C84 H142 Ce2 N12 O4 | P 1 21/n 1 | 11.7195; 18.0849; 21.3488 90; 95.3481; 90 | 4505.1 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559601 | CIF | C70 H142 Ce2 Cl2 N2 O10 Si6 | C 1 2/c 1 | 18.228; 17.588; 28.531 90; 102.369; 90 | 8935 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559602 | CIF | C72 H140 Ce2 O12 Si4 | P 1 21/n 1 | 11.29; 22.03; 17.25 90; 96.25; 90 | 4265 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559603 | CIF | C44 H108 Ce2 Cl2 N8 O2 Si12 | C 1 2/c 1 | 24.8116; 21.794; 17.4764 90; 116.659; 90 | 8445.6 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559604 | CIF | C100 H196 Ce2 O28 Si4 | P 1 21/c 1 | 20.8578; 24.2951; 11.7354 90; 94.4068; 90 | 5929.2 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559605 | CIF | C46 H120 Ce2 N6 O2 Si12 | C 1 2/c 1 | 24.645; 22.211; 17.381 90; 116.237; 90 | 8534 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559606 | CIF | C91 H103 Ce3 N18 O5 | P -1 | 12.7863; 18.594; 18.631 102.525; 90.9634; 93.3308 | 4314.8 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559607 | CIF | C76 H158 Ce2 Cl4 O12 Si6 | P 1 21/c 1 | 11.2124; 12.5614; 34.289 90; 97.212; 90 | 4791.2 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559608 | CIF | C76 H162 Ce2 O10 Si6 | P -1 | 11.655; 12.402; 17.499 92.596; 93.946; 114.855 | 2282 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559609 | CIF | C97.07 H204.13 Ce2 O30 Si6 | P -1 | 13.7919; 14.0585; 20.0654 71.904; 81.904; 60.636 | 3222.7 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559610 | CIF | C66 H132 Ce2 Co2 D8 N6 O3 Si12 | P 1 2/n 1 | 11.7272; 20.2947; 21.6422 90; 99.99; 90 | 5072.7 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559611 | CIF | C90 H186 Ce2 Cl4 O29 Si6 | P n n a | 22.1584; 41.418; 13.425 90; 90; 90 | 12320.9 | Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner Cerium-quinone redox couples put under scrutiny. Chemical science, 2020, 12, 1343-1351 |
1559612 | CIF | C62 H84 N2 O4 | P -1 | 9.8347; 12.6226; 12.8064 118.576; 101.423; 94.672 | 1339.49 | Rausch, Rodger; Röhr, Merle I S; Schmidt, David; Krummenacher, Ivo; Braunschweig, Holger; Würthner, Frank Tuning phenoxyl-substituted diketopyrrolopyrroles from quinoidal to biradical ground states through (hetero-)aromatic linkers. Chemical science, 2020, 12, 793-802 |
1559613 | CIF | C60 H86 N2 O8 | P 1 21/n 1 | 15.3311; 23.844; 15.4674 90; 95.515; 90 | 5628 | Rausch, Rodger; Röhr, Merle I S; Schmidt, David; Krummenacher, Ivo; Braunschweig, Holger; Würthner, Frank Tuning phenoxyl-substituted diketopyrrolopyrroles from quinoidal to biradical ground states through (hetero-)aromatic linkers. Chemical science, 2020, 12, 793-802 |
1559615 | CIF | C19 H22 N2 O3 S | P 1 21/c 1 | 17.0085; 9.896; 10.5439 90; 92.8684; 90 | 1772.5 | Liang, Weida; Cai, Xinpei; Dai, Mingji Cu-catalyzed hydroxycyclopropanol ring-opening cyclization to tetrahydrofurans and tetrahydropyrans: short total syntheses of hyperiones. Chemical science, 2020, 12, 1311-1316 |
1559616 | CIF | Bi K3 S3 | P 21 3 | 9.44906; 9.44906; 9.44906 90; 90; 90 | 843.657 | McClain, Rebecca; Malliakas, Christos D.; Shen, Jiahong; He, Jiangang; Wolverton, Chris; González, Gabriela B; Kanatzidis, Mercouri G. Mechanistic insight of KBiQ<sub>2</sub> (Q = S, Se) using panoramic synthesis towards synthesis-by-design. Chemical science, 2020, 12, 1378-1391 |
1559617 | CIF | Bi K S2 | R -3 m :H | 4.128802; 4.128802; 22.09041 90; 90; 120 | 326.124 | McClain, Rebecca; Malliakas, Christos D.; Shen, Jiahong; He, Jiangang; Wolverton, Chris; González, Gabriela B; Kanatzidis, Mercouri G. Mechanistic insight of KBiQ<sub>2</sub> (Q = S, Se) using panoramic synthesis towards synthesis-by-design. Chemical science, 2020, 12, 1378-1391 |
1559618 | CIF | Bi K Se2 | R -3 m :H | 4.264423; 4.264423; 23.02901 90; 90; 120 | 362.682 | McClain, Rebecca; Malliakas, Christos D.; Shen, Jiahong; He, Jiangang; Wolverton, Chris; González, Gabriela B; Kanatzidis, Mercouri G. Mechanistic insight of KBiQ<sub>2</sub> (Q = S, Se) using panoramic synthesis towards synthesis-by-design. Chemical science, 2020, 12, 1378-1391 |
1559619 | CIF | C14 H11 N O2 S | P 1 21/c 1 | 4.7962; 16.1392; 15.9437 90; 90; 90 | 1234.15 | Chen, Pu; Nan, Jiang; Hu, Yan; Kang, Yifan; Wang, Bo; Ma, Yangmin; Szostak, Michal Metal-free tandem carbene N-H insertions and C-C bond cleavages. Chemical science, 2020, 12, 803-811 |
1559635 | CIF | C31 H30 N4 O5 S | P 1 21/n 1 | 10.14023; 15.89219; 18.23835 90; 105.522; 90 | 2831.92 | Guarnieri-Ibáñez, Alejandro; de Aguirre, Adiran; Besnard, Céline; Poblador-Bahamonde, Amalia I; Lacour, Jérôme Regiodivergent synthesis of pyrazino-indolines <i>vs.</i> triazocines <i>via</i> α-imino carbenes addition to imidazolidines. Chemical science, 2020, 12, 1479-1485 |
1559636 | CIF | C32 H33 N3 O2 S | I 1 2/a 1 | 18.90952; 10.14583; 28.4275 90; 93.3559; 90 | 5444.54 | Guarnieri-Ibáñez, Alejandro; de Aguirre, Adiran; Besnard, Céline; Poblador-Bahamonde, Amalia I; Lacour, Jérôme Regiodivergent synthesis of pyrazino-indolines <i>vs.</i> triazocines <i>via</i> α-imino carbenes addition to imidazolidines. Chemical science, 2020, 12, 1479-1485 |
1559637 | CIF | C32 H33 N3 O2 S | P -1 | 10.9678; 15.3212; 17.9064 111.225; 98.183; 98.485 | 2710.92 | Guarnieri-Ibáñez, Alejandro; de Aguirre, Adiran; Besnard, Céline; Poblador-Bahamonde, Amalia I; Lacour, Jérôme Regiodivergent synthesis of pyrazino-indolines <i>vs.</i> triazocines <i>via</i> α-imino carbenes addition to imidazolidines. Chemical science, 2020, 12, 1479-1485 |
1559638 | CIF | C26 H25 N3 O2 | I b a 2 | 18.50216; 21.27952; 10.92519 90; 90; 90 | 4301.43 | Guarnieri-Ibáñez, Alejandro; de Aguirre, Adiran; Besnard, Céline; Poblador-Bahamonde, Amalia I; Lacour, Jérôme Regiodivergent synthesis of pyrazino-indolines <i>vs.</i> triazocines <i>via</i> α-imino carbenes addition to imidazolidines. Chemical science, 2020, 12, 1479-1485 |
1559639 | CIF | C25 H24 N2 | P b c a | 21.3021; 7.7181; 23.5444 90; 90; 90 | 3871 | Guarnieri-Ibáñez, Alejandro; de Aguirre, Adiran; Besnard, Céline; Poblador-Bahamonde, Amalia I; Lacour, Jérôme Regiodivergent synthesis of pyrazino-indolines <i>vs.</i> triazocines <i>via</i> α-imino carbenes addition to imidazolidines. Chemical science, 2020, 12, 1479-1485 |
1559640 | CIF | C52 H33 Cl2 N O | P 1 21/n 1 | 9.2787; 14.567; 28.3208 90; 96.297; 90 | 3804.8 | Wu, Lin; Wang, Kai; Wang, Cheng; Fan, Xiao-Chun; Shi, Yi-Zhong; Zhang, Xiang; Zhang, Shao-Li; Ye, Jun; Zheng, Cai-Jun; Li, Yan-Qing; Yu, Jia; Ou, Xue-Mei; Zhang, Xiao-Hong Using fluorene to lock electronically active moieties in thermally activated delayed fluorescence emitters for high-performance non-doped organic light-emitting diodes with suppressed roll-off. Chemical science, 2020, 12, 1495-1502 |
1559641 | CIF | C51 H33 N O | P -1 | 12.0934; 13.1272; 13.4509 118.019; 90.255; 105.741 | 1792.4 | Wu, Lin; Wang, Kai; Wang, Cheng; Fan, Xiao-Chun; Shi, Yi-Zhong; Zhang, Xiang; Zhang, Shao-Li; Ye, Jun; Zheng, Cai-Jun; Li, Yan-Qing; Yu, Jia; Ou, Xue-Mei; Zhang, Xiao-Hong Using fluorene to lock electronically active moieties in thermally activated delayed fluorescence emitters for high-performance non-doped organic light-emitting diodes with suppressed roll-off. Chemical science, 2020, 12, 1495-1502 |
1559642 | CIF | C40 H41 Fe N13 O14 | P -1 | 10.01048; 13.6732; 17.5596 73.5259; 85.7741; 69.1588 | 2153.01 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559643 | CIF | C40 H41 Fe N13 O14 | P -1 | 13.5851; 18.7551; 19.6424 64.608; 71.048; 71.168 | 4176.3 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559644 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.99242; 13.64829; 17.4977 73.5796; 85.7654; 69.0385 | 2136.52 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559645 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.9614; 13.577; 17.271 103.019; 94.103; 111.28 | 2090.2 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559646 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.9719; 13.5419; 17.0957 76.716; 85.858; 110.386 | 2076.54 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559647 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.9677; 13.5502; 17.0822 76.876; 85.729; 110.376 | 2076.34 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559648 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.9726; 13.6198; 17.4815 73.5194; 85.7393; 69.1085 | 2126.23 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559649 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.9402; 13.5461; 17.384 73.959; 85.95; 68.735 | 2095.3 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559650 | CIF | C40 H41 Fe N13 O14 | P -1 | 10.008; 13.653; 17.13 76.955; 85.823; 110.551 | 2105.2 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559651 | CIF | C40 H41 Fe N13 O14 | P -1 | 13.5877; 18.7535; 19.6264 64.662; 71.098; 71.086 | 4174.4 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559652 | CIF | C40 H41 Fe N13 O14 | P -1 | 9.9953; 13.6057; 17.1602 76.844; 85.77; 110.502 | 2098.13 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559653 | CIF | C40 H41 Fe N13 O14 | P -1 | 13.63358; 18.8075; 19.6686 64.7142; 71.0809; 71.0628 | 4210.47 | Jornet-Mollá, Verónica; Giménez-Saiz, Carlos; Cañadillas-Delgado, Laura; Yufit, Dmitry S.; Howard, Judith A. K.; Romero, Francisco M. Interplay between spin crossover and proton migration along short strong hydrogen bonds. Chemical science, 2020, 12, 1038-1053 |
1559654 | CIF | C31 H53 N O3 Si | P 21 21 21 | 13.1243; 15.2075; 16.3433 90; 90; 90 | 3261.92 | Homma, Chihiro; Takeshima, Aika; Kano, Taichi; Maruoka, Keiji Construction of chiral α-<i>tert</i>-amine scaffolds <i>via</i> amine-catalyzed asymmetric Mannich reactions of alkyl-substituted ketimines. Chemical science, 2020, 12, 1445-1450 |
1559655 | CIF | C17 H14 O4 | P 1 21/n 1 | 8.047; 11.508; 14.43 90; 90.23; 90 | 1336.3 | Gollapelli, Krishna Kumar; Patil, Vaibhav B.; Vinaykumar, Allam; Chegondi, Rambabu Rh(i)-catalyzed stereoselective desymmetrization of prochiral cyclohexadienones <i>via</i> highly <i>exo</i>-selective Huisgen-type [3 + 2] cycloaddition. Chemical science, 2020, 12, 1544-1550 |
1559656 | CIF | C51 H52 Dy N5 O8 P2 S3 | P 1 21/m 1 | 10.081; 24.946; 11.246 90; 107.46; 90 | 2697.8 | Huang, Xin-Da; Wen, Ge-Hua; Bao, Song-Song; Jia, Jia-Ge; Zheng, Li-Min Thermo- and light-triggered reversible interconversion of dysprosium-anthracene complexes and their responsive optical, magnetic and dielectric properties. Chemical science, 2020, 12, 929-937 |
1559657 | CIF | C51 H52 Dy N5 O8 P2 S3 | P -1 | 9.592; 11.701; 26.2 90.03; 91.86; 112.38 | 2717 | Huang, Xin-Da; Wen, Ge-Hua; Bao, Song-Song; Jia, Jia-Ge; Zheng, Li-Min Thermo- and light-triggered reversible interconversion of dysprosium-anthracene complexes and their responsive optical, magnetic and dielectric properties. Chemical science, 2020, 12, 929-937 |
1559664 | CIF | In Li3 P2 | I 41/a c d :2 | 12.0065; 12.0065; 23.9165 90; 90; 90 | 3447.71 | Restle, Tassilo M. F.; Deringer, Volker L.; Meyer, Jan; Raudaschl-Sieber, Gabriele; Fässler, Thomas F Supertetrahedral polyanionic network in the first lithium phosphidoindate Li<sub>3</sub>InP<sub>2</sub> - structural similarity to Li<sub>2</sub>SiP<sub>2</sub> and Li<sub>2</sub>GeP<sub>2</sub> and dissimilarity to Li<sub>3</sub>AlP<sub>2</sub> and Li<sub>3</sub>GaP<sub>2</sub>. Chemical science, 2020, 12, 1278-1285 |
1559665 | CIF | C26 H30 B11 P | P 1 21/c 1 | 14.029; 9.9593; 20.562 90; 92.648; 90 | 2869.8 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559666 | CIF | C62 H75 B11 N3 P | P -1 | 14.553; 14.829; 15.99 69.051; 79.173; 70.065 | 3021 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559667 | CIF | C58 H67 B11 N3 P | P -1 | 11.524; 14.772; 20.643 77.743; 77.242; 71.242 | 3207.1 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559668 | CIF | C36 H41 B11 N P | P 1 21/n 1 | 11.512; 22.661; 14.8847 90; 95.426; 90 | 3865.6 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559669 | CIF | C54 H65 B11 N O2 P | P -1 | 13.061; 13.363; 17.006 91.902; 112.387; 107.918 | 2572.9 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559670 | CIF | C56 H63 B11 N3 P | P 1 21/c 1 | 15.0697; 14.0752; 29.446 90; 98.86; 90 | 6171.2 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559671 | CIF | C51 H55 B11 N O2 P | P 1 21/c 1 | 12.189; 21.845; 22.102 90; 102.623; 90 | 5743 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559672 | CIF | C78 H91 B11 N3 O2 P | P -1 | 14.84; 15.233; 17.153 78.44; 77.68; 74.344 | 3605.4 | Zhang, Jian; Xie, Zuowei Tri-insertion with dearomatization of terminal arylalkynes using a carborane based frustrated Lewis pair template. Chemical science, 2020, 12, 1745-1749 |
1559673 | CIF | C14 H11 N O2 | P 1 21/n 1 | 5.0451; 13.6147; 15.6358 90; 93.956; 90 | 1071.43 | Palani, Vignesh; Perea, Melecio A.; Gardner, Kristen E.; Sarpong, Richmond A pyrone remodeling strategy to access diverse heterocycles: application to the synthesis of fascaplysin natural products. Chemical science, 2020, 12, 1528-1534 |
1559674 | CIF | C14 H10 Cl N O2 | P 1 21/n 1 | 8.6415; 14.2584; 9.2288 90; 97.831; 90 | 1126.51 | Palani, Vignesh; Perea, Melecio A.; Gardner, Kristen E.; Sarpong, Richmond A pyrone remodeling strategy to access diverse heterocycles: application to the synthesis of fascaplysin natural products. Chemical science, 2020, 12, 1528-1534 |
1559675 | CIF | C21 H15 N O2 | P -1 | 10.184; 11.0563; 14.3733 69.266; 87.583; 89.765 | 1512.13 | Palani, Vignesh; Perea, Melecio A.; Gardner, Kristen E.; Sarpong, Richmond A pyrone remodeling strategy to access diverse heterocycles: application to the synthesis of fascaplysin natural products. Chemical science, 2020, 12, 1528-1534 |
1559727 | CIF | C58 H60 B2 F24 N4 O2 Pt | P 1 21/c 1 | 13.9627; 24.4797; 20.1924 90; 109.711; 90 | 6497.4 | Ríos, Pablo; Martín-de la Calle, Rocío; Vidossich, Pietro; Fernández-de-Córdova, Francisco José; Lledós, Agustí; Conejero, Salvador Reversible carbon-boron bond formation at platinum centers through σ-BH complexes. Chemical science, 2020, 12, 1647-1655 |
1559728 | CIF | C58 H54 B2 F24 N6 Pt | P -1 | 17.784; 19.3314; 19.4985 77.056; 83.793; 71.134 | 6177.4 | Ríos, Pablo; Martín-de la Calle, Rocío; Vidossich, Pietro; Fernández-de-Córdova, Francisco José; Lledós, Agustí; Conejero, Salvador Reversible carbon-boron bond formation at platinum centers through σ-BH complexes. Chemical science, 2020, 12, 1647-1655 |
1559729 | CIF | C58 H54 B2 F24 N6 Pt | P -1 | 12.8046; 13.6804; 18.4265 96.145; 98.035; 91.631 | 3174.7 | Ríos, Pablo; Martín-de la Calle, Rocío; Vidossich, Pietro; Fernández-de-Córdova, Francisco José; Lledós, Agustí; Conejero, Salvador Reversible carbon-boron bond formation at platinum centers through σ-BH complexes. Chemical science, 2020, 12, 1647-1655 |
1559730 | CIF | C63 H69 B2 F24 N5 O2 Pt | P 1 21/c 1 | 13.001; 26.3167; 21.0636 90; 101.229; 90 | 7068.8 | Ríos, Pablo; Martín-de la Calle, Rocío; Vidossich, Pietro; Fernández-de-Córdova, Francisco José; Lledós, Agustí; Conejero, Salvador Reversible carbon-boron bond formation at platinum centers through σ-BH complexes. Chemical science, 2020, 12, 1647-1655 |
1559731 | CIF | C55.17 H44.33 N4 O P Zn | P 61 | 28.129; 28.129; 10.2773 90; 90; 120 | 7042.4 | Chakraborty, Debarshi; Gholami, Hadi; Sarkar, Aritra; Joyce, Leo A.; Jackson, James E.; Borhan, Babak A chiroptical approach for the absolute stereochemical determination of <i>P</i>-stereogenic centers. Chemical science, 2020, 12, 1750-1755 |
1559733 | CIF | C16 H23 Cl N2 O3 | P 1 21 1 | 10.6148; 5.0773; 15.8871 90; 104.929; 90 | 827.33 | Steigerwald, Daniel C.; Soltanzadeh, Bardia; Sarkar, Aritra; Morgenstern, Cecilia C.; Staples, Richard J.; Borhan, Babak Ritter-enabled catalytic asymmetric chloroamidation of olefins. Chemical science, 2020, 12, 1834-1842 |
1559734 | CIF | C15 H20 Br Cl N2 O2 | P 1 | 4.9505; 8.582; 19.942 88.027; 85.435; 89.121 | 843.98 | Steigerwald, Daniel C.; Soltanzadeh, Bardia; Sarkar, Aritra; Morgenstern, Cecilia C.; Staples, Richard J.; Borhan, Babak Ritter-enabled catalytic asymmetric chloroamidation of olefins. Chemical science, 2020, 12, 1834-1842 |
1559735 | CIF | C39 H35 Cl N2 O4 | P -1 | 7.0556; 11.2701; 21.8311 76.95; 80.721; 83.88 | 1664.53 | Yan, Lipeng; Ma, Weixin; Lan, Jingbo; Cheng, Hu; Bin, Zhengyang; Wu, Di; You, Jingsong Molecular engineering enabling reversible transformation between helical and planar conformations by cyclization of alkynes. Chemical science, 2020, 12, 2419-2426 |
1559736 | CIF | C39 H26 N2 | P 1 21/n 1 | 11.61201; 15.7662; 16.56274 90; 96.2696; 90 | 3014.13 | Yan, Lipeng; Ma, Weixin; Lan, Jingbo; Cheng, Hu; Bin, Zhengyang; Wu, Di; You, Jingsong Molecular engineering enabling reversible transformation between helical and planar conformations by cyclization of alkynes. Chemical science, 2020, 12, 2419-2426 |
1559742 | CIF | C123.64 H127.46 F9 Lu N9.82 O29 S3 | P 21 21 21 | 13.2976; 25.7772; 38.6074 90; 90; 90 | 13233.6 | Song, Yiwei; Schaufelberger, Fredrik; Ashbridge, Zoe; Pirvu, Lucian; Vitorica-Yrezabal, Iñigo J; Leigh, David A. Effects of turn-structure on folding and entanglement in artificial molecular overhand knots. Chemical science, 2020, 12, 1826-1833 |
1559743 | CIF | C32 H18 N2 | P -1 | 7.3505; 9.1897; 17.0347 94.567; 91.046; 113.509 | 1050.24 | Vriza, Aikaterini; Canaj, Angelos B.; Vismara, Rebecca; Kershaw Cook, Laurence J.; Manning, Troy D.; Gaultois, Michael W.; Wood, Peter A.; Kurlin, Vitaliy; Berry, Neil; Dyer, Matthew S.; Rosseinsky, Matthew J. One class classification as a practical approach for accelerating π-π co-crystal discovery. Chemical science, 2020, 12, 1702-1719 |
1559744 | CIF | C42 H26 O4 | P 1 21/c 1 | 8.295; 16.3146; 21.1379 90; 91.514; 90 | 2859.6 | Vriza, Aikaterini; Canaj, Angelos B.; Vismara, Rebecca; Kershaw Cook, Laurence J.; Manning, Troy D.; Gaultois, Michael W.; Wood, Peter A.; Kurlin, Vitaliy; Berry, Neil; Dyer, Matthew S.; Rosseinsky, Matthew J. One class classification as a practical approach for accelerating π-π co-crystal discovery. Chemical science, 2020, 12, 1702-1719 |
1559745 | CIF | C18 H18 Al0.5 Mo6 N3 O34.25 P4 | P 1 21/c 1 | 11.438; 23.034; 15.788 90; 95.203; 90 | 4142.4 | Zhang, Ya-Qi; Zhou, Lai-Yun; Ma, Yuan-Yuan; Dastafkan, Kamran; Zhao, Chuan; Wang, Lan-Zhi; Han, Zhan-Gang Stable monovalent aluminum(i) in a reduced phosphomolybdate cluster as an active acid catalyst. Chemical science, 2020, 12, 1886-1890 |
1559746 | CIF | C132 H114 Al6 Mo36 N22 O201 P24 | C 1 2/c 1 | 48.173; 13.8607; 47.347 90; 117.571; 90 | 28024 | Zhang, Ya-Qi; Zhou, Lai-Yun; Ma, Yuan-Yuan; Dastafkan, Kamran; Zhao, Chuan; Wang, Lan-Zhi; Han, Zhan-Gang Stable monovalent aluminum(i) in a reduced phosphomolybdate cluster as an active acid catalyst. Chemical science, 2020, 12, 1886-1890 |
1559747 | CIF | C199 H530 Ce6 Cl8 N36 Si36 | P -1 | 17.4036; 20.6957; 24.9538 103.801; 102.939; 109.687 | 7749.8 | Qiao, Yusen; Yin, Haolin; Moreau, Liane M.; Feng, Rulin; Higgins, Robert F.; Manor, Brian C.; Carroll, Patrick J.; Booth, Corwin H.; Autschbach, Jochen; Schelter, Eric J. Cerium(iv) complexes with guanidinate ligands: intense colors and anomalous electronic structures. Chemical science, 2020, 12, 3558-3567 |
1559748 | CIF | C64 H94 B Ce F24 N7 Si6 | P 1 21/c 1 | 18.6937; 18.0533; 26.789 90; 91.191; 90 | 9038.9 | Qiao, Yusen; Yin, Haolin; Moreau, Liane M.; Feng, Rulin; Higgins, Robert F.; Manor, Brian C.; Carroll, Patrick J.; Booth, Corwin H.; Autschbach, Jochen; Schelter, Eric J. Cerium(iv) complexes with guanidinate ligands: intense colors and anomalous electronic structures. Chemical science, 2020, 12, 3558-3567 |
1559749 | CIF | C50 H46 Mn2 N30 | P -1 | 11.495; 11.697; 11.753 72.463; 82.359; 71.422 | 1427.1 | Vaddypally, Shivaiah; Kiselev, Vitaly G.; Byrne, Alex N.; Goldsmith, C. Franklin; Zdilla, Michael J. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring. Chemical science, 2020, 12, 2268-2275 |
1559750 | CIF | C36 H30 Cu2 N26 | P 1 21/n 1 | 9.332; 13.337; 15.845 90; 97.844; 90 | 1953.6 | Vaddypally, Shivaiah; Kiselev, Vitaly G.; Byrne, Alex N.; Goldsmith, C. Franklin; Zdilla, Michael J. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring. Chemical science, 2020, 12, 2268-2275 |
1559751 | CIF | C3 H2 N10 | P 1 21/n 1 | 8.018; 4.669; 18.877 90; 101.238; 90 | 693.1 | Vaddypally, Shivaiah; Kiselev, Vitaly G.; Byrne, Alex N.; Goldsmith, C. Franklin; Zdilla, Michael J. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring. Chemical science, 2020, 12, 2268-2275 |
1559752 | CIF | C36 H30 N26 Zn2 | P 1 21/n 1 | 9.58; 13.076; 15.904 90; 97.636; 90 | 1974.6 | Vaddypally, Shivaiah; Kiselev, Vitaly G.; Byrne, Alex N.; Goldsmith, C. Franklin; Zdilla, Michael J. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring. Chemical science, 2020, 12, 2268-2275 |
1559753 | CIF | C46 H49 Fe2 N27 O2 | P -1 | 11.034; 13.414; 18.758 91.221; 106.188; 99.178 | 2625.8 | Vaddypally, Shivaiah; Kiselev, Vitaly G.; Byrne, Alex N.; Goldsmith, C. Franklin; Zdilla, Michael J. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring. Chemical science, 2020, 12, 2268-2275 |
1559754 | CIF | C44 H46 N26 Ni2 O2 | P 1 21/c 1 | 11.927; 20.144; 10.56 90; 98.269; 90 | 2510.7 | Vaddypally, Shivaiah; Kiselev, Vitaly G.; Byrne, Alex N.; Goldsmith, C. Franklin; Zdilla, Michael J. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring. Chemical science, 2020, 12, 2268-2275 |
1559758 | CIF | C14 H19 N3 O2 | P 1 21/c 1 | 8.1323; 8.1695; 19.3253 90; 90.803; 90 | 1283.79 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559759 | CIF | C13 H17 N3 O3 | P 1 21/c 1 | 8.0314; 8.1488; 19.2027 90; 90.5479; 90 | 1256.69 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559760 | CIF | C13 H15 N3 O2 | P b c a | 13.4226; 7.6316; 22.4832 90; 90; 90 | 2303.09 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559761 | CIF | C18 H26 N3 O2.5 | P -1 | 7.6118; 9.3656; 12.1634 93.7306; 95.39; 108.127 | 816.35 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559762 | CIF | C15 H21 N3 O2 | P -1 | 7.1405; 8.577; 11.9704 73.957; 88.399; 78.976 | 691.32 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559763 | CIF | C17 H21 N3 O | P -1 | 7.0488; 8.6329; 12.6463 88.989; 74.751; 77.777 | 725.03 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559764 | CIF | C16 H19 N3 O | P -1 | 6.9675; 8.6877; 12.0676 87.02; 74.121; 77.399 | 685.7 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559765 | CIF | C15 H19 N3 O | P 31 | 22.0392; 22.0392; 7.1184 90; 90; 120 | 2994.36 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559766 | CIF | C15 H18 N2 O2 | P 1 21/n 1 | 9.6859; 8.2156; 16.9618 90; 106.12; 90 | 1296.67 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559767 | CIF | C18 H26 N6 O4 | P 21 21 21 | 8.3617; 13.8207; 16.0698 90; 90; 90 | 1857.1 | Millward, Makenzie J.; Ellis, Emily; Ward, John W.; Clayden, Jonathan Hydantoin-bridged medium ring scaffolds by migratory insertion of urea-tethered nitrile anions into aromatic C-N bonds. Chemical science, 2020, 12, 2091-2096 |
1559768 | CIF | C54 H38 F8 N4 | P 1 21 1 | 14.0179; 13.6325; 22.7651 90; 107.536; 90 | 4148.2 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559769 | CIF | C54 H38 F8 N4 | C 1 c 1 | 13.9524; 14.0942; 22.7794 90; 106.433; 90 | 4296.5 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559770 | CIF | C54 H38 F8 N4 | P 1 21/n 1 | 6.824; 14.6816; 21.469 90; 95.4; 90 | 2141.4 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559771 | CIF | C54 H38 F8 N4 | P 1 21 1 | 14.0444; 13.7744; 22.8418 90; 107.59; 90 | 4212.2 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559772 | CIF | C54 H38 F8 N4 | P 1 2/c 1 | 19.158; 6.7794; 17.4666 90; 109.362; 90 | 2140.25 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559773 | CIF | C54 H38 F8 N4 | P 1 21/n 1 | 6.6696; 14.9431; 21.3309 90; 95.362; 90 | 2116.63 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559774 | CIF | C54 H38 F8 N4 | P 1 21/n 1 | 6.7928; 14.5649; 21.3902 90; 95.7754; 90 | 2105.5 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559775 | CIF | C54 H38 F8 N4 | P 1 21/n 1 | 6.6763; 15.0587; 21.4299 90; 94.94; 90 | 2146.5 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559776 | CIF | C54 H37 F8 N4 | P 1 21/n 1 | 6.657; 14.852; 21.2537 90; 95.721; 90 | 2090.88 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559777 | CIF | C54 H38 F8 N4 | P 1 c 1 | 19.0865; 6.767; 17.3518 90; 109.354; 90 | 2114.48 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559778 | CIF | C54 H38 F8 N4 | P 1 21/n 1 | 6.6803; 15.0128; 21.3972 90; 95.143; 90 | 2137.29 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559779 | CIF | C54 H38 F8 N4 | P 1 21/n 1 | 6.7657; 14.4934; 21.3307 90; 96.1667; 90 | 2079.54 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559780 | CIF | C30 H29 N3 | P 1 21/c 1 | 9.148; 22.6374; 11.7158 90; 105.813; 90 | 2334.37 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559781 | CIF | C54 H38 F8 N4 | P 1 2/c 1 | 19.1368; 6.7789; 17.4066 90; 109.373; 90 | 2130.24 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559782 | CIF | C54 H37 F8 N4 | P 1 21/n 1 | 6.6613; 14.8875; 21.2797 90; 95.554; 90 | 2100.4 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559783 | CIF | C54 H38 F8 N4 | P 1 2/c 1 | 19.2225; 6.7835; 17.5663 90; 109.337; 90 | 2161.35 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559784 | CIF | C54 H38 F8 N4 | P 1 2/c 1 | 19.2767; 6.7799; 17.6615 90; 109.29; 90 | 2178.67 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559785 | CIF | C54 H38 F8 N4 | P 1 21 1 | 14.0331; 13.6998; 22.8049 90; 107.555; 90 | 4180.1 | Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science, 2020, 12, 2181-2188 |
1559786 | CIF | C42 H525 Ce4 Mo126 N21 Na4 O623 | P -1 | 32.5994; 32.7694; 35.206 104.753; 98.873; 104.933 | 34154 | She, Shan; Xuan, Weimin; Bell, Nicola L.; Pow, Robert; Ribo, Eduard Garrido; Sinclair, Zoe; Long, De-Liang; Cronin, Leroy Peptide sequence mediated self-assembly of molybdenum blue nanowheel superstructures. Chemical science, 2020, 12, 2427-2432 |
1559787 | CIF | C36 H521 Ce4 Mo124 N16 Na3 O616 | P 21 21 2 | 34.8531; 45.172; 20.9243 90; 90; 90 | 32943 | She, Shan; Xuan, Weimin; Bell, Nicola L.; Pow, Robert; Ribo, Eduard Garrido; Sinclair, Zoe; Long, De-Liang; Cronin, Leroy Peptide sequence mediated self-assembly of molybdenum blue nanowheel superstructures. Chemical science, 2020, 12, 2427-2432 |
1559788 | CIF | C36 H531 Ce4 Mo124 N16 Na3 O617 | P 21 21 2 | 34.884; 45.668; 20.929 90; 90; 90 | 33342 | She, Shan; Xuan, Weimin; Bell, Nicola L.; Pow, Robert; Ribo, Eduard Garrido; Sinclair, Zoe; Long, De-Liang; Cronin, Leroy Peptide sequence mediated self-assembly of molybdenum blue nanowheel superstructures. Chemical science, 2020, 12, 2427-2432 |
1559789 | CIF | C48 H535 Ce4 Mo126 N24 Na3 O626 | P -1 | 32.444; 32.749; 35.233 104.665; 98.814; 104.742 | 34063 | She, Shan; Xuan, Weimin; Bell, Nicola L.; Pow, Robert; Ribo, Eduard Garrido; Sinclair, Zoe; Long, De-Liang; Cronin, Leroy Peptide sequence mediated self-assembly of molybdenum blue nanowheel superstructures. Chemical science, 2020, 12, 2427-2432 |
1559790 | CIF | C40 H516 Ce4 Mo124 N20 Na2 O610 | P 21 21 2 | 34.6572; 45.43; 20.9741 90; 90; 90 | 33023 | She, Shan; Xuan, Weimin; Bell, Nicola L.; Pow, Robert; Ribo, Eduard Garrido; Sinclair, Zoe; Long, De-Liang; Cronin, Leroy Peptide sequence mediated self-assembly of molybdenum blue nanowheel superstructures. Chemical science, 2020, 12, 2427-2432 |
1559791 | CIF | C40 H535 Ce5 Mo122 N20 Na2 O616 | P 21 21 21 | 38.1062; 38.2685; 46.9136 90; 90; 90 | 68413 | She, Shan; Xuan, Weimin; Bell, Nicola L.; Pow, Robert; Ribo, Eduard Garrido; Sinclair, Zoe; Long, De-Liang; Cronin, Leroy Peptide sequence mediated self-assembly of molybdenum blue nanowheel superstructures. Chemical science, 2020, 12, 2427-2432 |
1559792 | CIF | B6.001 H14.002 N2 | F m -3 m | 9.10295; 9.10295; 9.10295 90; 90; 90 | 754.304 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559793 | CIF | Ca F2 | F m -3 m | 5.45095; 5.45095; 5.45095 90; 90; 90 | 161.963 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559794 | CIF | C3 H7 N O2 | P 21 21 21 | 5.9279; 12.2597; 5.7939 90; 90; 90 | 421.07 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559795 | CIF | C6.286 H6 O2.57 | R -3 :H | 16.2023; 16.2023; 5.6943 90; 90; 120 | 1294.57 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559796 | CIF | C5 H10 N2 O3 | P 21 21 21 | 7.4583; 9.4892; 9.7301 90; 90; 90 | 688.63 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559797 | CIF | C10 H10 F2 N4 | P 1 21/n 1 | 6.9196; 14.5749; 9.7248 90; 90.637; 90 | 980.71 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559798 | CIF | C24 H44 Os P2 | P 1 21/n 1 | 10.8918; 13.7619; 17.0714 90; 98.563; 90 | 2530.34 | Kleemiss, Florian; Dolomanov, Oleg V.; Bodensteiner, Michael; Peyerimhoff, Norbert; Midgley, Laura; Bourhis, Luc J.; Genoni, Alessandro; Malaspina, Lorraine A.; Jayatilaka, Dylan; Spencer, John L.; White, Fraser; Grundkötter-Stock, Bernhard; Steinhauer, Simon; Lentz, Dieter; Puschmann, Horst; Grabowsky, Simon Accurate crystal structures and chemical properties from NoSpherA2. Chemical science, 2020, 12, 1675-1692 |
1559814 | CIF | C28 H29 N O4 | P 1 21 1 | 6.1281; 27.1638; 28.2117 90; 91.472; 90 | 4694.6 | Huang, Qi; Suravarapu, Sankar Rao; Renaud, Philippe A Giese reaction for electron-rich alkenes. Chemical science, 2020, 12, 2225-2230 |
1559815 | CIF | C29 H46 O4 Si | P 1 | 6.44725; 10.18619; 22.76512 101.785; 91.4615; 98.5773 | 1444.75 | Huang, Qi; Suravarapu, Sankar Rao; Renaud, Philippe A Giese reaction for electron-rich alkenes. Chemical science, 2020, 12, 2225-2230 |
1559816 | CIF | C25 H36 O4 | P 1 21 1 | 6.1518; 60.5855; 6.15597 90; 106.532; 90 | 2199.54 | Huang, Qi; Suravarapu, Sankar Rao; Renaud, Philippe A Giese reaction for electron-rich alkenes. Chemical science, 2020, 12, 2225-2230 |
1559817 | CIF | C59 H46 B F21 Mg N2 | P -1 | 11.5844; 12.7186; 19.132 86.186; 77.9; 80.916 | 2720.03 | Friedrich, Alexander; Pahl, Jürgen; Eyselein, Jonathan; Langer, Jens; van Eikema Hommes, Nico; Görling, Andreas; Harder, Sjoerd Magnesium-halobenzene bonding: mapping the halogen sigma-hole with a Lewis-acidic complex. Chemical science, 2020, 12, 2410-2418 |
1559818 | CIF | C65 H58 B Br F20 Mg N2 | P 1 21/c 1 | 18.6127; 17.9643; 18.7424 90; 102.994; 90 | 6106.32 | Friedrich, Alexander; Pahl, Jürgen; Eyselein, Jonathan; Langer, Jens; van Eikema Hommes, Nico; Görling, Andreas; Harder, Sjoerd Magnesium-halobenzene bonding: mapping the halogen sigma-hole with a Lewis-acidic complex. Chemical science, 2020, 12, 2410-2418 |
1559819 | CIF | C71 H63 B F22 Mg N2 | P 1 21/c 1 | 18.3734; 18.0983; 19.7295 90; 98.061; 90 | 6495.77 | Friedrich, Alexander; Pahl, Jürgen; Eyselein, Jonathan; Langer, Jens; van Eikema Hommes, Nico; Görling, Andreas; Harder, Sjoerd Magnesium-halobenzene bonding: mapping the halogen sigma-hole with a Lewis-acidic complex. Chemical science, 2020, 12, 2410-2418 |
1559820 | CIF | C71 H63 Al2 F57 Mg N2 O6 | P -1 | 11.3521; 15.9191; 24.738 74.924; 85.545; 89.29 | 4303.5 | Friedrich, Alexander; Pahl, Jürgen; Eyselein, Jonathan; Langer, Jens; van Eikema Hommes, Nico; Görling, Andreas; Harder, Sjoerd Magnesium-halobenzene bonding: mapping the halogen sigma-hole with a Lewis-acidic complex. Chemical science, 2020, 12, 2410-2418 |
1559821 | CIF | C71 H56 B F23 Mg N2 | P -1 | 12.2177; 15.9583; 17.8965 102.494; 106.268; 96.734 | 3210.89 | Friedrich, Alexander; Pahl, Jürgen; Eyselein, Jonathan; Langer, Jens; van Eikema Hommes, Nico; Görling, Andreas; Harder, Sjoerd Magnesium-halobenzene bonding: mapping the halogen sigma-hole with a Lewis-acidic complex. Chemical science, 2020, 12, 2410-2418 |
1559822 | CIF | C65 H58 B F20 I Mg N2 | P 1 21/c 1 | 18.7237; 18.0226; 18.7649 90; 102.692; 90 | 6177.5 | Friedrich, Alexander; Pahl, Jürgen; Eyselein, Jonathan; Langer, Jens; van Eikema Hommes, Nico; Görling, Andreas; Harder, Sjoerd Magnesium-halobenzene bonding: mapping the halogen sigma-hole with a Lewis-acidic complex. Chemical science, 2020, 12, 2410-2418 |
1559823 | CIF | C20 H14 N4 | C 1 2/c 1 | 15.8604; 11.0803; 9.0716 90; 109.9; 90 | 1499.03 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559824 | CIF | C56 H64 F24 N8 P4 | P -1 | 8.895; 12.069; 15.1617 103.06; 94.575; 103.138 | 1529.2 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559825 | CIF | C56 H64 F24 N8 P4 | P 1 2/n 1 | 17.127; 8.8196; 21.3425 90; 103.355; 90 | 3136.7 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559826 | CIF | C104 H100 Ag2 B2 N8 | A e a 2 | 8.9095; 41.3302; 26.6661 90; 90; 90 | 9819.3 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559827 | CIF | C61.5 H44.5 F10.5 N9 O11.5 S3.5 | P 1 21/m 1 | 8.0294; 19.1408; 19.9693 90; 94.97; 90 | 3057.5 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559828 | CIF | C40 H28 N8 | P 1 21/n 1 | 9.2542; 15.7442; 9.9997 90; 94.804; 90 | 1451.8 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559829 | CIF | C28 H18 N4 | P -1 | 6.4661; 8.1703; 10.3854 69.264; 78.354; 79.8 | 499.2 | Bai, Sha; Ma, Li-Li; Yang, Tao; Wang, Fang; Wang, Li-Feng; Hahn, F. Ekkehardt; Wang, Yao-Yu; Han, Ying-Feng Supramolecular-induced regiocontrol over the photochemical [4 + 4] cyclodimerization of NHC- or azole-substituted anthracenes. Chemical science, 2020, 12, 2165-2171 |
1559845 | CIF | C189 H28 S10 Th2 | P b c a | 21.6511; 21.3564; 22.0916 90; 90; 90 | 10214.9 | Liu, Xinye; Li, Bo; Yang, Wei; Yao, Yang-Rong; Yang, Le; Zhuang, Jiaxin; Li, Xiaomeng; Jin, Peng; Chen, Ning Synthesis and characterization of carbene derivatives of Th@<i>C</i> <sub>3v</sub>(8)-C<sub>82</sub> and U@<i>C</i> <sub>2v</sub>(9)-C<sub>82</sub>: exceptional chemical properties induced by strong actinide-carbon cage interaction. Chemical science, 2020, 12, 2488-2497 |
1559846 | CIF | C93 H14 S2 U | P 1 21/n 1 | 11.3037; 21.8879; 20.9098 90; 101.257; 90 | 5073.9 | Liu, Xinye; Li, Bo; Yang, Wei; Yao, Yang-Rong; Yang, Le; Zhuang, Jiaxin; Li, Xiaomeng; Jin, Peng; Chen, Ning Synthesis and characterization of carbene derivatives of Th@<i>C</i> <sub>3v</sub>(8)-C<sub>82</sub> and U@<i>C</i> <sub>2v</sub>(9)-C<sub>82</sub>: exceptional chemical properties induced by strong actinide-carbon cage interaction. Chemical science, 2020, 12, 2488-2497 |
1559850 | CIF | C37 H38 B2 Fe N10 | C 1 2/c 1 | 16.6461; 17.2299; 24.132 90; 102.636; 90 | 6753.7 | Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science, 2020, 12, 2231-2241 |
1559851 | CIF | C65 H63 B4 Fe2 N20 | P -1 | 12.5636; 13.684; 20.5835 98.128; 100.359; 115.218 | 3053.3 | Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science, 2020, 12, 2231-2241 |
1559852 | CIF | C37 H38 B2 F6 Fe N10 Sb | P 1 21/n 1 | 11.98; 25.1657; 14.4893 90; 114.204; 90 | 3984.3 | Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science, 2020, 12, 2231-2241 |
1559853 | CIF | C43 H41 B2 Br Fe N9 | P -1 | 10.252; 12.025; 18.4 104.192; 92.618; 112.901 | 2000.4 | Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science, 2020, 12, 2231-2241 |
1559854 | CIF | C31 H29 B2 F Fe N9 | P n m a | 8.245; 19.3287; 18.0484 90; 90; 90 | 2876.3 | Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science, 2020, 12, 2231-2241 |
1559855 | CIF | C45 H50 B2 Fe N10 O | P 1 2/c 1 | 18.7182; 24.1607; 23.662 90; 98.957; 90 | 10570.5 | Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science, 2020, 12, 2231-2241 |
1559856 | CIF | C30 H50 B2 N2 Ni O2 P2 | P 1 c 1 | 9.294; 15.3277; 11.7365 90; 107.92; 90 | 1590.82 | Ríos, Pablo; Borge, Javier; Fernández de Córdova, Francisco; Sciortino, Giuseppe; Lledós, Agustí; Rodríguez, Amor Ambiphilic boryl groups in a neutral Ni(ii) complex: a new activation mode of H<sub>2</sub>. Chemical science, 2020, 12, 2540-2548 |
1559857 | CIF | C20 H24 B2 N2 O4 | P 1 21/n 1 | 9.273; 18.201; 11.69 90; 106.121; 90 | 1895.4 | Ríos, Pablo; Borge, Javier; Fernández de Córdova, Francisco; Sciortino, Giuseppe; Lledós, Agustí; Rodríguez, Amor Ambiphilic boryl groups in a neutral Ni(ii) complex: a new activation mode of H<sub>2</sub>. Chemical science, 2020, 12, 2540-2548 |
1559858 | CIF | C36 H55 B2 N3 Ni O4 P2 | P 21 21 2 | 17.5213; 20.1284; 12.3444 90; 90; 90 | 4353.6 | Ríos, Pablo; Borge, Javier; Fernández de Córdova, Francisco; Sciortino, Giuseppe; Lledós, Agustí; Rodríguez, Amor Ambiphilic boryl groups in a neutral Ni(ii) complex: a new activation mode of H<sub>2</sub>. Chemical science, 2020, 12, 2540-2548 |
1559859 | CIF | C30 H48 B2 N2 Ni O2 P2 | C 1 2/c 1 | 22.532; 11.3598; 26.302 90; 104.066; 90 | 6530.4 | Ríos, Pablo; Borge, Javier; Fernández de Córdova, Francisco; Sciortino, Giuseppe; Lledós, Agustí; Rodríguez, Amor Ambiphilic boryl groups in a neutral Ni(ii) complex: a new activation mode of H<sub>2</sub>. Chemical science, 2020, 12, 2540-2548 |
1559860 | CIF | C25 H31 K O8 | P 1 21/c 1 | 8.3399; 27.1397; 11.0226 90; 100.071; 90 | 2456.4 | Ahmed, Jasimuddin; Datta, Paramita; Das, Arpan; Jomy, Stephy; Mandal, Swadhin K. Switching between mono and doubly reduced odd alternant hydrocarbon: designing a redox catalyst. Chemical science, 2020, 12, 3039-3049 |
1559861 | CIF | C66 H81 K2 N2 O14 | P 1 21/c 1 | 14.2195; 34.538; 13.8905 90; 113.176; 90 | 6271.3 | Ahmed, Jasimuddin; Datta, Paramita; Das, Arpan; Jomy, Stephy; Mandal, Swadhin K. Switching between mono and doubly reduced odd alternant hydrocarbon: designing a redox catalyst. Chemical science, 2020, 12, 3039-3049 |
1559862 | CIF | C51 H69 K2 O14 | P 21 21 21 | 14.237; 18.7126; 19.1013 90; 90; 90 | 5088.8 | Ahmed, Jasimuddin; Datta, Paramita; Das, Arpan; Jomy, Stephy; Mandal, Swadhin K. Switching between mono and doubly reduced odd alternant hydrocarbon: designing a redox catalyst. Chemical science, 2020, 12, 3039-3049 |
1559874 | CIF | C54 H42 Cl6 D2 N2 O10 | P 1 21/n 1 | 11.8889; 14.4911; 14.9954 90; 104.794; 90 | 2497.81 | Xiao, Wanlong; Mo, Yuhao; Guo, Jing; Su, Zhishan; Dong, Shunxi; Feng, Xiaoming Catalytic enantioselective synthesis of macrodiolides and their application in chiral recognition. Chemical science, 2020, 12, 2940-2947 |
1559875 | CIF | C30 H27 N3 O5 | P 21 21 21 | 10.8152; 12.5754; 20.1202 90; 90; 90 | 2736.46 | Xiao, Wanlong; Mo, Yuhao; Guo, Jing; Su, Zhishan; Dong, Shunxi; Feng, Xiaoming Catalytic enantioselective synthesis of macrodiolides and their application in chiral recognition. Chemical science, 2020, 12, 2940-2947 |
1559876 | CIF | C55 H46 Cl2 N2 O11 | P 41 21 2 | 19.2448; 19.2448; 26.8461 90; 90; 90 | 9942.8 | Xiao, Wanlong; Mo, Yuhao; Guo, Jing; Su, Zhishan; Dong, Shunxi; Feng, Xiaoming Catalytic enantioselective synthesis of macrodiolides and their application in chiral recognition. Chemical science, 2020, 12, 2940-2947 |
1559888 | CIF | C7 H4 D6 O6 | P n a 21 | 12.1157; 6.1134; 9.97 90; 90; 90 | 738.46 | Joffrin, Amélie M.; Saunders, Alex M.; Barneda, David; Flemington, Vikki; Thompson, Amber L.; Sanganee, Hitesh J.; Conway, Stuart J. Development of isotope-enriched phosphatidylinositol-4- and 5-phosphate cellular mass spectrometry probes Chemical Science, 2021, 12, 2549-2557 |
1559889 | CIF | C14 H18 O8 | P 1 21 1 | 10.4164; 6.6513; 11.2592 90; 96.9535; 90 | 774.33 | Joffrin, Amélie M.; Saunders, Alex M.; Barneda, David; Flemington, Vikki; Thompson, Amber L.; Sanganee, Hitesh J.; Conway, Stuart J. Development of isotope-enriched phosphatidylinositol-4- and 5-phosphate cellular mass spectrometry probes Chemical Science, 2021, 12, 2549-2557 |
1559890 | CIF | C26 H34 N2 O6 S | P 1 21 1 | 6.2203; 17.3233; 11.9123 90; 92.951; 90 | 1281.92 | Hao, Taotao; Yang, Yongsheng; Liang, Wenting; Fan, Chunying; Wang, Xin; Wu, Wanhua; Chen, Xiaochuan; Fu, Haiyan; Chen, Hua; Yang, Cheng Trace mild acid-catalysed <i>Z</i> →<i>E</i> isomerization of norbornene-fused stilbene derivatives: intelligent chiral molecular photoswitches with controllable self-recovery. Chemical science, 2020, 12, 2614-2622 |
1559891 | CIF | C26 H25 O | I 1 2 1 | 11.9345; 7.2394; 22.679 90; 99.029; 90 | 1935.2 | Hao, Taotao; Yang, Yongsheng; Liang, Wenting; Fan, Chunying; Wang, Xin; Wu, Wanhua; Chen, Xiaochuan; Fu, Haiyan; Chen, Hua; Yang, Cheng Trace mild acid-catalysed <i>Z</i> →<i>E</i> isomerization of norbornene-fused stilbene derivatives: intelligent chiral molecular photoswitches with controllable self-recovery. Chemical science, 2020, 12, 2614-2622 |
1559892 | CIF | C23 H24 O | P -1 | 9.4684; 10.1128; 11.1589 111.746; 114.773; 91.316 | 880.77 | Hao, Taotao; Yang, Yongsheng; Liang, Wenting; Fan, Chunying; Wang, Xin; Wu, Wanhua; Chen, Xiaochuan; Fu, Haiyan; Chen, Hua; Yang, Cheng Trace mild acid-catalysed <i>Z</i> →<i>E</i> isomerization of norbornene-fused stilbene derivatives: intelligent chiral molecular photoswitches with controllable self-recovery. Chemical science, 2020, 12, 2614-2622 |
1559907 | CIF | C12 H22 B Fe N | P 1 21/c 1 | 12.5601; 7.39591; 14.8102 90; 98.207; 90 | 1361.68 | Zhai, Xiaofang; Pang, Maofu; Feng, Lei; Jia, Jiong; Tung, Chen-Ho; Wang, Wenguang Dehydrogenation of iron amido-borane and resaturation of the imino-borane complex Chemical Science, 2021, 12, 2885-2889 |
1559908 | CIF | C68 H60 B2 F24 Fe N O2 P | P -1 | 12.9415; 14.6375; 19.3031 103.817; 92.601; 92.604 | 3541.17 | Zhai, Xiaofang; Pang, Maofu; Feng, Lei; Jia, Jiong; Tung, Chen-Ho; Wang, Wenguang Dehydrogenation of iron amido-borane and resaturation of the imino-borane complex Chemical Science, 2021, 12, 2885-2889 |
1559909 | CIF | C81 H67 B2 F24 Fe N P2 | P 1 21/c 1 | 13.1206; 16.6063; 36.1078 90; 93.609; 90 | 7851.73 | Zhai, Xiaofang; Pang, Maofu; Feng, Lei; Jia, Jiong; Tung, Chen-Ho; Wang, Wenguang Dehydrogenation of iron amido-borane and resaturation of the imino-borane complex Chemical Science, 2021, 12, 2885-2889 |
1559910 | CIF | C28 H31 B Fe N P | P 1 21/c 1 | 15.3228; 26.7339; 35.8973 90; 99.93; 90 | 14484.6 | Zhai, Xiaofang; Pang, Maofu; Feng, Lei; Jia, Jiong; Tung, Chen-Ho; Wang, Wenguang Dehydrogenation of iron amido-borane and resaturation of the imino-borane complex Chemical Science, 2021, 12, 2885-2889 |
1559911 | CIF | C28 H33 B Fe N P | P 1 21/n 1 | 10.668; 10.792; 21.922 90; 92.119; 90 | 2522.1 | Zhai, Xiaofang; Pang, Maofu; Feng, Lei; Jia, Jiong; Tung, Chen-Ho; Wang, Wenguang Dehydrogenation of iron amido-borane and resaturation of the imino-borane complex Chemical Science, 2021, 12, 2885-2889 |
1559946 | CIF | C30 H14 Cd N4 O8 S | P b a m | 12.8322; 19.9878; 20.044 90; 90; 90 | 5141.03 | Ding, Bowen; Chan, Bun; Proschogo, Nicholas; Solomon, Marcello B.; Kepert, Cameron J.; D'Alessandro, Deanna M. A cofacial metal‒organic framework based photocathode for carbon dioxide reduction Chemical Science, 2021, 12, 3608-3614 |
1559947 | CIF | C30 H14 Cd N4 O8 S | P b a m | 12.9936; 19.8725; 20.0366 90; 90; 90 | 5173.76 | Ding, Bowen; Chan, Bun; Proschogo, Nicholas; Solomon, Marcello B.; Kepert, Cameron J.; D'Alessandro, Deanna M. A cofacial metal‒organic framework based photocathode for carbon dioxide reduction Chemical Science, 2021, 12, 3608-3614 |
1559948 | CIF | C10 H34 I12 N4 Pb3 | C 1 2/m 1 | 8.909; 9.012; 27.896 90; 92.832; 90 | 2237 | Li, Dong; Wu, Wentao; Han, Shiguo; Liu, Xitao; Peng, Yu; Li, Xiaoqi; Li, Lina; Hong, Maochun; Luo, Junhua A reduced-dimensional polar hybrid perovskite for self-powered broad-spectrum photodetection Chemical Science, 2021, 12, 3050-3054 |
1559949 | CIF | C10 H34 I12 N4 Pb3 | P 1 c 1 | 27.3848; 9.0015; 8.8216 90; 95.999; 90 | 2162.65 | Li, Dong; Wu, Wentao; Han, Shiguo; Liu, Xitao; Peng, Yu; Li, Xiaoqi; Li, Lina; Hong, Maochun; Luo, Junhua A reduced-dimensional polar hybrid perovskite for self-powered broad-spectrum photodetection Chemical Science, 2021, 12, 3050-3054 |
1559953 | CIF | C15 H19 F3 N2 O5 Pt S | P 1 21/n 1 | 11.3867; 13.3132; 12.4183 90; 92.717; 90 | 1880.42 | Pal, Shrinwantu; Nozaki, Kyoko; Vedernikov, Andrei N.; Love, Jennifer A. Reversible PtII‒CH3 deuteration without methane loss: metal‒ligand cooperation vs. ligand-assisted PtII-protonation Chemical Science, 2021, 12, 2960-2969 |
1559954 | CIF | C10 H13 F2 N O4 S2 | P 1 21 1 | 6.9704; 8.0097; 11.9695 90; 100.105; 90 | 657.9 | Rossi, Maria-Agustina; Martinez, Veronica; Hinchliffe, Philip; Mojica, Maria F.; Castillo, Valerie; Moreno, Diego M.; Smith, Ryan; Spellberg, Brad; Drusano, George L.; Banchio, Claudia; Bonomo, Robert A.; Spencer, James; Vila, Alejandro J.; Mahler, Graciela 2-Mercaptomethyl-thiazolidines use conserved aromatic‒S interactions to achieve broad-range inhibition of metallo-β-lactamases Chemical Science, 2021, 12, 2898-2908 |
1559955 | CIF | C224 H252 Au44 S28 | R -3 c :H | 45.692; 45.692; 77.435 90; 90; 120 | 140007 | Liu, Xu; Yao, Guo; Cheng, Xinglian; Xu, Jiayu; Cai, Xiao; Hu, Weigang; Xu, Wen Wu; Zhang, Chunfeng; Zhu, Yan Cd-driven surface reconstruction and photodynamics in gold nanoclusters Chemical Science, 2021, 12, 3290-3294 |
1559956 | CIF | C240 H270 Au38 Cd4 S30 | P -1 | 35.243; 36.193; 46.321 78.898; 74.68; 79.183 | 55332 | Liu, Xu; Yao, Guo; Cheng, Xinglian; Xu, Jiayu; Cai, Xiao; Hu, Weigang; Xu, Wen Wu; Zhang, Chunfeng; Zhu, Yan Cd-driven surface reconstruction and photodynamics in gold nanoclusters Chemical Science, 2021, 12, 3290-3294 |
1559978 | CIF | C30 H36 N2 S2 | P -1 | 7.0096; 11.6756; 17.1032 96.573; 98.931; 99.536 | 1349.48 | Sinclair, Geoffrey S.; Claridge, Robert C. M.; Kukor, Andrew J.; Hopkins, W. Scott; Schipper, Derek J. N-Oxide S‒O chalcogen bonding in conjugated materials Chemical Science, 2021, 12, 2304-2312 |
1559979 | CIF | C30 H36 N2 O S2 | P -1 | 6.7333; 7.2344; 14.884 85.396; 80.658; 74.043 | 687.4 | Sinclair, Geoffrey S.; Claridge, Robert C. M.; Kukor, Andrew J.; Hopkins, W. Scott; Schipper, Derek J. N-Oxide S‒O chalcogen bonding in conjugated materials Chemical Science, 2021, 12, 2304-2312 |
1559980 | CIF | C18 H15 N O3 | P 1 21/c 1 | 5.974; 16.697; 14.741 90; 91.617; 90 | 1469.8 | Cheng, Yaohang; Yu, Shijie; He, Yuhang; An, Guanghui; Li, Guangming; Yang, Zhenyu C4-arylation and domino C4-arylation/3,2-carbonyl migration of indoles by tuning Pd catalytic modes: Pd(i)‒Pd(ii) catalysis vs. Pd(ii) catalysis Chemical Science, 2021, 12, 3216-3225 |
1559981 | CIF | C18 H15 N O3 | P -1 | 8.1516; 8.1871; 11.8093 96.901; 107.557; 92.751 | 743.01 | Cheng, Yaohang; Yu, Shijie; He, Yuhang; An, Guanghui; Li, Guangming; Yang, Zhenyu C4-arylation and domino C4-arylation/3,2-carbonyl migration of indoles by tuning Pd catalytic modes: Pd(i)–Pd(ii) catalysis vs. Pd(ii) catalysis Chemical Science, 2021, 12, 3216-3225 |
1559982 | CIF | C285 H325 Ag21 Au B2 Cl2 Fe3 O2 P6 S12 | P -1 | 21.3948; 27.211; 29.938 80.347; 70.094; 67.283 | 15103 | Zou, Xuejuan; He, Shuping; Kang, Xi; Chen, Shuang; Yu, Haizhu; Jin, Shan; Astruc, Didier; Zhu, Manzhou New atomically precise M1Ag21 (M = Au/Ag) nanoclusters as excellent oxygen reduction reaction catalysts Chemical Science, 2021, 12, 3660-3667 |
1559983 | CIF | C298 H333 Ag22 B2 Fe3 P6 S12 | P -1 | 21.412; 27.2727; 29.7612 79.123; 70.493; 66.956 | 15040.9 | Zou, Xuejuan; He, Shuping; Kang, Xi; Chen, Shuang; Yu, Haizhu; Jin, Shan; Astruc, Didier; Zhu, Manzhou New atomically precise M1Ag21 (M = Au/Ag) nanoclusters as excellent oxygen reduction reaction catalysts Chemical Science, 2021, 12, 3660-3667 |
1559984 | CIF | C84 H116 Fe2 K2 N4 Si4 Sm2 | C 1 2/c 1 | 14.315; 21.977; 26.509 90; 95.58; 90 | 8300 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559985 | CIF | C34 H62 Fe N2 O3 Si2 Yb | P 21 21 21 | 13.9723; 15.8539; 16.9858 90; 90; 90 | 3762.62 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559986 | CIF | C52 H92 Fe2 N4 O2 Si4 Yb2 | P -1 | 11.5553; 12.3812; 12.4512 112.215; 96.684; 113.262 | 1439.25 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559987 | CIF | C104 H182 Fe2 K2 N4 O18 Si4 Sm2 | P -1 | 15.0158; 15.8062; 28.2213 83.357; 79.591; 66.665 | 6041.8 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559988 | CIF | C34 H62 Fe N2 O6 Si2 Yb | P -1 | 11.3145; 13.0374; 14.2432 87.291; 81.628; 71.282 | 1968.71 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559989 | CIF | C64 H106 Fe2 K2 N4 O2 Si4 Yb2 | P 1 21/n 1 | 13.2467; 18.78; 14.5436 90; 100.579; 90 | 3556.6 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559990 | CIF | C34 H62 Fe N2 O6 Si2 Yb | P 1 21 1 | 10.201; 33.0414; 12.1739 90; 105.418; 90 | 3955.6 | Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L. Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes. Chemical science, 2020, 12, 227-238 |
1559991 | CIF | C23 H35 Fe N O3 S | P 1 21/c 1 | 26.9077; 7.4341; 11.4663 90; 100.496; 90 | 2255.3 | Bitter, Stefan; Schlötter, Moritz; Schilling, Markus; Krumova, Marina; Polarz, Sebastian; Winter, Rainer F. Ferro-self-assembly: magnetic and electrochemical adaptation of a multiresponsive zwitterionic metalloamphiphile showing a shape-hysteresis effect. Chemical science, 2020, 12, 270-281 |
1559992 | CIF | C29 H21 N3 O Pt | P 1 21/n 1 | 10.309; 13.9097; 15.4326 90; 101.658; 90 | 2167.31 | Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A. Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters Chemical Science, 2021, 12, 3270-3281 |
1559993 | CIF | C29 H17 F4 N3 O Pd | P -1 | 11.8675; 12.4514; 17.2457 94.655; 96.279; 113.088 | 2308.6 | Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A. Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters Chemical Science, 2021, 12, 3270-3281 |
1559994 | CIF | C29 H19 F2 N3 O Pt | P -1 | 9.3869; 11.7589; 11.9012 117.792; 105.826; 94.593 | 1084.42 | Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A. Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters Chemical Science, 2021, 12, 3270-3281 |
1559995 | CIF | C29 H17 F4 N3 O Pt | P 1 2/c 1 | 22.8339; 9.8626; 22.7576 90; 117.704; 90 | 4537.52 | Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A. Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters Chemical Science, 2021, 12, 3270-3281 |
1559996 | CIF | C29 H17 F4 N3 O Pt | P -1 | 9.6007; 11.7181; 12.0959 118.283; 95.325; 104.556 | 1123.48 | Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A. Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters Chemical Science, 2021, 12, 3270-3281 |
1559997 | CIF | C23 H40 Cl O2 P Pd | P 1 21/n 1 | 9.7932; 13.0955; 19.8473 90; 93.9044; 90 | 2539.4 | Kim, Daeun; Choi, Geunho; Kim, Weonjeong; Kim, Dongwook; Kang, Youn K.; Hong, Soon Hyeok The site-selectivity and mechanism of Pd-catalyzed C(sp<sup>2</sup>)-H arylation of simple arenes. Chemical science, 2020, 12, 363-373 |
1559998 | CIF | C126 H53 N5 Ni S2 U2 | P 1 21/c 1 | 17.6663; 16.9578; 26.7308 90; 106.76; 90 | 7667.88 | Li, Xiaomeng; Roselló, Yannick; Yao, Yang-Rong; Zhuang, Jiaxin; Zhang, Xingxing; Rodríguez-Fortea, Antonio; de Graaf, Coen; Echegoyen, Luis; Poblet, Josep M.; Chen, Ning U<sub>2</sub>N@<i>I</i> <sub>h</sub>(7)-C<sub>80</sub>: fullerene cage encapsulating an unsymmetrical U(iv)[double bond, length as m-dash]N[double bond, length as m-dash]U(v) cluster. Chemical science, 2020, 12, 282-292 |
1559999 | CIF | C64.5 H59.5 Cl1.5 F6 P2 Pd2 Ru S3 Sb | P -1 | 11.9921; 12.28439; 21.733 94.518; 91.0356; 101.524 | 3125.45 | Kulichenko, Maksim; Fedik, Nikita; Monfredini, Anna; Muñoz-Castro, Alvaro; Balestri, Davide; Boldyrev, Alexander I.; Maestri, Giovanni "Bottled" spiro-doubly aromatic trinuclear [Pd<sub>2</sub>Ru]<sup>+</sup> complexes. Chemical science, 2020, 12, 477-486 |
1560000 | CIF | C28 H46 Li N2 O P3 | P 1 21/n 1 | 10.215; 30.038; 10.723 90; 116.107; 90 | 2954.5 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560001 | CIF | C58.28 H98.56 Br2 Cl6.56 Cu2 N6 P6 Ti2 | P 1 21/c 1 | 11.6149; 16.6838; 20.0416 90; 90.81; 90 | 3883.3 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560002 | CIF | C40 H38 Cl2 N2 O P3 Ti | P 1 21/n 1 | 10.1219; 16.662; 22.432 90; 99.27; 90 | 3733.8 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560003 | CIF | C45 H44 Cl N4 P3 Ti | P -1 | 12.209; 12.264; 15.876 97.041; 99.249; 98.343 | 2295.3 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560004 | CIF | C24 H38 Cl3 N2 P3 Zr | P b c a | 16.455; 16.291; 22.0025 90; 90; 90 | 5898.2 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560005 | CIF | C29 H49 Au Cl4 N3 P3 Ti | P n m a | 14.2921; 13.7871; 18.9179 90; 90; 90 | 3727.7 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560006 | CIF | C147 H126 Cl18 N8 P12 Zr4 | P -1 | 11.8938; 12.0699; 27.548 82.319; 80.357; 70.217 | 3656.1 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560007 | CIF | C77 H70 B Cl2 N2 O2 P3 Ti | P -1 | 11.7665; 13.781; 20.643 82.299; 86.711; 80.965 | 3273.7 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560008 | CIF | C48 H76 Cu2 N4 P6 | C 1 2/c 1 | 31.2123; 11.3573; 16.6578 90; 111.69; 90 | 5486.9 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560009 | CIF | C28 H47 Cl N3 P3 Ti | P 1 21/n 1 | 19.7139; 17.7743; 20.2496 90; 112.411; 90 | 6559.6 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560010 | CIF | C24 H38 Cl2 N2 P3 Ti | P 1 21/n 1 | 11.1686; 15.39; 16.608 90; 99.796; 90 | 2813 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560011 | CIF | C45 H44 Cl N4 P3 Ti | P -1 | 12.209; 12.264; 15.876 97.041; 99.249; 98.343 | 2295.3 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560012 | CIF | C47 H47 Cl N3 P3 Ti | P 1 21/c 1 | 12.4622; 22.1019; 15.1862 90; 94.567; 90 | 4169.6 | Normand, Adrien T.; Sosa Carrizo, E. Daiann; Magnoux, Corentin; Lobato, Esteban; Cattey, Hélène; Richard, Philippe; Brandès, Stéphane; Devillers, Charles H.; Romieu, Anthony; Le Gendre, Pierre; Fleurat-Lessard, Paul Reappraising Schmidpeter's bis(iminophosphoranyl)phosphides: coordination to transition metals and bonding analysis. Chemical science, 2020, 12, 253-269 |
1560015 | CIF | C18 H24 O2 | P -1 | 8.3649; 10.0504; 10.2831 73.682; 70.348; 86.635 | 780.74 | Kleinmans, Roman; Will, Leon E.; Schwarz, J. Luca; Glorius, Frank Photoredox-enabled 1,2-dialkylation of α-substituted acrylates via Ireland‒Claisen rearrangement Chemical Science, 2021, 12, 2816-2822 |
1560016 | CIF | C12 H21 N O2 S | P -1 | 6.3005; 10.5228; 10.9791 65.837; 82.374; 88.124 | 658.07 | Kleinmans, Roman; Will, Leon E.; Schwarz, J. Luca; Glorius, Frank Photoredox-enabled 1,2-dialkylation of α-substituted acrylates via Ireland‒Claisen rearrangement Chemical Science, 2021, 12, 2816-2822 |
1560017 | CIF | C22 H26 O2 | P 1 21/n 1 | 10.5885; 8.3629; 20.6387 90; 99.927; 90 | 1800.21 | Kleinmans, Roman; Will, Leon E.; Schwarz, J. Luca; Glorius, Frank Photoredox-enabled 1,2-dialkylation of α-substituted acrylates via Ireland‒Claisen rearrangement Chemical Science, 2021, 12, 2816-2822 |
1560018 | CIF | C35 H35 N2 O P | P -1 | 8.9009; 10.4501; 17.0815 104.343; 91.133; 112.507 | 1410.37 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560019 | CIF | C33 H30 N O P | P -1 | 8.2229; 12.4346; 13.1943 108.632; 96.25; 93.485 | 1264.24 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560020 | CIF | C32 H22 F3 O4 P S | P 1 21/c 1 | 7.4114; 15.707; 22.5898 90; 92.536; 90 | 2627.1 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560021 | CIF | C33 H25 F3 N O3 P S | P n a 21 | 8.0035; 27.389; 12.6664 90; 90; 90 | 2776.6 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560022 | CIF | C34 H29 F3 N O3 P S | P 1 21/c 1 | 8.9602; 11.4072; 28.9126 90; 93.074; 90 | 2950.9 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560023 | CIF | C33 H25 F3 N O3 P S | P 1 21/c 1 | 16.162; 12.9217; 14.4246 90; 107.362; 90 | 2875.2 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560024 | CIF | C36 H34 F3 N2 O3 P S | P 1 21/c 1 | 11.0775; 19.2817; 15.3042 90; 104; 90 | 3171.8 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560025 | CIF | C33 H29 Au B Cl F4 N P | P 1 21 1 | 8.2171; 20.0635; 9.9302 90; 111.472; 90 | 1523.51 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560026 | CIF | C36 H33 Au B2 F8 N P S | P 1 21/c 1 | 16.5012; 15.8634; 13.7254 90; 92.673; 90 | 3588.9 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560027 | CIF | C37 H37 Au B2 F8 N P S | P 1 21 1 | 8.2911; 15.0763; 14.2431 90; 97.96; 90 | 1763.2 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560028 | CIF | C39 H42 Au B2 F8 N2 P S | P 1 21/n 1 | 10.2268; 8.5127; 45.347 90; 94.336; 90 | 3936.5 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560029 | CIF | C35 H34 Au B Cl F4 N2 P | P 1 21/c 1 | 20.6017; 8.5026; 20.569 90; 118.012; 90 | 3180.9 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560030 | CIF | C36 H32 Au B2 Cl2 F8 O P S | P -1 | 8.0106; 12.2124; 19.0728 99.359; 93.578; 101.894 | 1792.6 | Litle, Elishua D.; Wilkins, Lewis C.; Gabbaï, François P. Ligand-enforced intimacy between a gold cation and a carbenium ion: impact on stability and reactivity Chemical Science, 2021, 12, 3929-3936 |
1560031 | CIF | C52 H96 O Si8 U2 | P 21 21 21 | 10.5444; 18.4631; 31.5083 90; 90; 90 | 6134.1 | Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A. Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes Chemical Science, 2021, 12, 2948-2954 |
1560032 | CIF | C26 H50 O Si4 U | P 1 21/n 1 | 17.5935; 9.977; 18.6747 90; 110.001; 90 | 3080.27 | Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A. Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes Chemical Science, 2021, 12, 2948-2954 |
1560033 | CIF | C58.34 H113.47 O Si9 U2 | P -4 | 20.3708; 20.3708; 16.6734 90; 90; 90 | 6918.95 | Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A. Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes Chemical Science, 2021, 12, 2948-2954 |
1560034 | CIF | C84 H168 Si12 U2 | P 1 21/c 1 | 26.7057; 15.99077; 26.5612 90; 117.35; 90 | 10074.9 | Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A. Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes Chemical Science, 2021, 12, 2948-2954 |
1560035 | CIF | C24 H44 Si4 U | I 41/a :2 | 31.8409; 31.8409; 11.0234 90; 90; 90 | 11176 | Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A. Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes Chemical Science, 2021, 12, 2948-2954 |
1560036 | CIF | C28 H52 O Si4 U | P 21 21 21 | 11.40224; 16.98119; 17.03377 90; 90; 90 | 3298.14 | Tsoureas, Nikolaos; Mansikkamäki, Akseli; Layfield, Richard A. Synthesis, bonding properties and ether activation reactivity of cyclobutadienyl-ligated hybrid uranocenes Chemical Science, 2021, 12, 2948-2954 |
1560037 | CIF | C34 H48 N4 P2 | P -1 | 7.5552; 9.5169; 11.8279 76.651; 84.11; 72.543 | 788.85 | Lücke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Boosting homogeneous chemoselective hydrogenation of olefins mediated by a bis(silylenyl)terphenyl-nickel(0) pre-catalyst Chemical Science, 2021, 12, 2909-2915 |
1560038 | CIF | C48 H58 N4 Si2 | C 1 2/c 1 | 25.072; 9.1667; 19.7603 90; 99.889; 90 | 4474 | Lücke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Boosting homogeneous chemoselective hydrogenation of olefins mediated by a bis(silylenyl)terphenyl-nickel(0) pre-catalyst Chemical Science, 2021, 12, 2909-2915 |
1560039 | CIF | C34 H48 N4 Ni P2 | P -1 | 10.1955; 10.3773; 16.0898 76.412; 80.446; 88.451 | 1631.6 | Lücke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Boosting homogeneous chemoselective hydrogenation of olefins mediated by a bis(silylenyl)terphenyl-nickel(0) pre-catalyst Chemical Science, 2021, 12, 2909-2915 |
1560040 | CIF | C55 H66 N4 Ni Si2 | P 1 21/m 1 | 9.1662; 26.4418; 9.8935 90; 90.567; 90 | 2397.8 | Lücke, Marcel-Philip; Yao, Shenglai; Driess, Matthias Boosting homogeneous chemoselective hydrogenation of olefins mediated by a bis(silylenyl)terphenyl-nickel(0) pre-catalyst Chemical Science, 2021, 12, 2909-2915 |
1560078 | CIF | C19 H13 N O | P 21 21 21 | 17.214; 14.4042; 5.5668 90; 90; 90 | 1380.3 | Li, Hui; Li, Huanhuan; Gu, Jie; He, Fei; Peng, Hao; Tao, Ye; Tian, Dan; Yang, Qingqing; Li, Ping; Zheng, Chao; Huang, Wei; Chen, Runfeng Fluorine-induced aggregate-interlocking for color-tunable organic afterglow with a simultaneously improved efficiency and lifetime Chemical Science, 2021, 12, 3580-3586 |
1560079 | CIF | C19 H12 F N O | P b c a | 11.8585; 10.3783; 22.8559 90; 90; 90 | 2812.9 | Li, Hui; Li, Huanhuan; Gu, Jie; He, Fei; Peng, Hao; Tao, Ye; Tian, Dan; Yang, Qingqing; Li, Ping; Zheng, Chao; Huang, Wei; Chen, Runfeng Fluorine-induced aggregate-interlocking for color-tunable organic afterglow with a simultaneously improved efficiency and lifetime Chemical Science, 2021, 12, 3580-3586 |
1560080 | CIF | C19 H12 F N O | P 1 21/n 1 | 14.608; 5.4287; 18.371 90; 107.996; 90 | 1385.6 | Li, Hui; Li, Huanhuan; Gu, Jie; He, Fei; Peng, Hao; Tao, Ye; Tian, Dan; Yang, Qingqing; Li, Ping; Zheng, Chao; Huang, Wei; Chen, Runfeng Fluorine-induced aggregate-interlocking for color-tunable organic afterglow with a simultaneously improved efficiency and lifetime Chemical Science, 2021, 12, 3580-3586 |
1560081 | CIF | C19 H12 F N O | P 1 21/c 1 | 8.9406; 22.597; 7.0302 90; 91.313; 90 | 1419.9 | Li, Hui; Li, Huanhuan; Gu, Jie; He, Fei; Peng, Hao; Tao, Ye; Tian, Dan; Yang, Qingqing; Li, Ping; Zheng, Chao; Huang, Wei; Chen, Runfeng Fluorine-induced aggregate-interlocking for color-tunable organic afterglow with a simultaneously improved efficiency and lifetime Chemical Science, 2021, 12, 3580-3586 |
1560082 | CIF | C56 H63 N5 O4 | P 1 21/c 1 | 14.7734; 17.4936; 18.6427 90; 90.2338; 90 | 4817.98 | Villarón, David; Siegler, Maxime A.; Wezenberg, Sander J. A photoswitchable strapped calix[4]pyrrole receptor: highly effective chloride binding and release Chemical Science, 2021, 12, 3188-3193 |
1560083 | CIF | C108 H98 Mn4 Mo9 N3 O43 P5 | P -1 | 16.1432; 18.3888; 24.571 94.772; 109.004; 106.661 | 6480.2 | Li, Chifeng; Jimbo, Atsuhiro; Yamaguchi, Kazuya; Suzuki, Kosuke A protecting group strategy to access stable lacunary polyoxomolybdates for introducing multinuclear metal clusters Chemical Science, 2021, 12, 1240-1244 |
1560084 | CIF | C174 H174 Cl20 Mn6 Mo18 O74 P8 | P -1 | 17.3006; 19.39; 20.7716 95.31; 112.975; 99.33 | 6236.6 | Li, Chifeng; Jimbo, Atsuhiro; Yamaguchi, Kazuya; Suzuki, Kosuke A protecting group strategy to access stable lacunary polyoxomolybdates for introducing multinuclear metal clusters Chemical Science, 2021, 12, 1240-1244 |
1560085 | CIF | C22 H33 Ir | P 1 21/n 1 | 8.01647; 16.3246; 15.049 90; 92.985; 90 | 1966.73 | Tian, Yancong; Jakoobi, Martin; Boulatov, Roman; Sergeev, Alexey G. Selective cleavage of unactivated arene ring C‒C bonds by iridium: key roles of benzylic C‒H activation and metal‒metal cooperativity Chemical Science, 2021, 12, 3568-3579 |
1560086 | CIF | C20 H23 Ir | C 1 c 1 | 22.2884; 22.2818; 26.1267 90; 97.5244; 90 | 12863.5 | Tian, Yancong; Jakoobi, Martin; Boulatov, Roman; Sergeev, Alexey G. Selective cleavage of unactivated arene ring C–C bonds by iridium: key roles of benzylic C–H activation and metal–metal cooperativity Chemical Science, 2021, 12, 3568-3579 |
1560094 | CIF | C51 H48 O6 S | P 21 21 21 | 8.0941; 17.5936; 32.602 90; 90; 90 | 4642.7 | Bartelmann, Thomas; Gnannt, Frederik; Zitzmann, Max; Mayer, Peter; Dube, Henry Sulfoxide hemithioindigo tweezers ‒ visible light addressable capture and release Chemical Science, 2021, 12, 3651-3659 |
1560095 | CIF | C36 H53 B N6 O3 P2 Pd W | P 1 21/c 1 | 16.8853; 15.2569; 15.7122 90; 91.701; 90 | 4046 | Osipova, Elena S.; Gulyaeva, Ekaterina S.; Gutsul, Evgenii I.; Kirkina, Vladislava A.; Pavlov, Alexander A.; Nelyubina, Yulia V.; Rossin, Andrea; Peruzzini, Maurizio; Epstein, Lina M.; Belkova, Natalia V.; Filippov, Oleg A.; Shubina, Elena S. Bifunctional activation of amine-boranes by the W/Pd bimetallic analogs of “frustrated Lewis pairs” Chemical Science, 2021, 12, 3682-3692 |
1560096 | CIF | C32 H48 O3 P2 Pd W | P 1 21/c 1 | 8.2012; 37.372; 10.9355 90; 103.388; 90 | 3260.59 | Osipova, Elena S.; Gulyaeva, Ekaterina S.; Gutsul, Evgenii I.; Kirkina, Vladislava A.; Pavlov, Alexander A.; Nelyubina, Yulia V.; Rossin, Andrea; Peruzzini, Maurizio; Epstein, Lina M.; Belkova, Natalia V.; Filippov, Oleg A.; Shubina, Elena S. Bifunctional activation of amine-boranes by the W/Pd bimetallic analogs of “frustrated Lewis pairs” Chemical Science, 2021, 12, 3682-3692 |
1560097 | CIF | C21 H30 B F2 N O5 | P 1 21/c 1 | 14.1856; 17.0247; 9.5406 90; 94.364; 90 | 2297.4 | Wang, Yandong; Bai, Jingyi; Yang, Youqing; Zhao, Wenxuan; Liang, Yong; Wang, Di; Zhao, Yue; Shi, Zhuangzhi Rhodium-catalysed selective C‒C bond activation and borylation of cyclopropanes Chemical Science, 2021, 12, 3599-3607 |
1560098 | CIF | C22 H34 Cl2 N2 O6 Rh2 | P 1 21/n 1 | 9.2163; 11.7129; 13.3216 90; 108.006; 90 | 1367.63 | Wang, Yandong; Bai, Jingyi; Yang, Youqing; Zhao, Wenxuan; Liang, Yong; Wang, Di; Zhao, Yue; Shi, Zhuangzhi Rhodium-catalysed selective C‒C bond activation and borylation of cyclopropanes Chemical Science, 2021, 12, 3599-3607 |
1560099 | CIF | C14 H19 N O | P 21 21 21 | 9.9241; 11.0168; 24.6334 90; 90; 90 | 2693.21 | Wang, Yandong; Bai, Jingyi; Yang, Youqing; Zhao, Wenxuan; Liang, Yong; Wang, Di; Zhao, Yue; Shi, Zhuangzhi Rhodium-catalysed selective C‒C bond activation and borylation of cyclopropanes Chemical Science, 2021, 12, 3599-3607 |
1560100 | CIF | C23 H16 O | P 1 21/n 1 | 9.3347; 10.0778; 16.957 90; 101.582; 90 | 1562.7 | Uraguchi, Daisuke; Kato, Kohsuke; Ooi, Takashi o-Quinone methide with overcrowded olefin component as a dehydridation catalyst under aerobic photoirradiation conditions Chemical Science, 2021, 12, 2778-2783 |
1560101 | CIF | C26 H20 O | P 1 21/c 1 | 10.294; 16.632; 11.319 90; 112.274; 90 | 1793.3 | Uraguchi, Daisuke; Kato, Kohsuke; Ooi, Takashi o-Quinone methide with overcrowded olefin component as a dehydridation catalyst under aerobic photoirradiation conditions Chemical Science, 2021, 12, 2778-2783 |
1560102 | CIF | C26 H21 B F4 O | P 1 21/n 1 | 7.4982; 19.0172; 14.6488 90; 99.675; 90 | 2059.13 | Uraguchi, Daisuke; Kato, Kohsuke; Ooi, Takashi o-Quinone methide with overcrowded olefin component as a dehydridation catalyst under aerobic photoirradiation conditions Chemical Science, 2021, 12, 2778-2783 |
1560103 | CIF | C4 H2.67 Bi0.67 N4.67 Ni0.67 S4 | P -1 | 8.441; 8.6899; 11.8177 97.574; 92.137; 91.817 | 858.1 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560104 | CIF | C4 H2.67 Bi0.67 N4.67 Ni0.67 S4 | P -1 | 8.4472; 8.7119; 11.9671 97.041; 90.364; 91.558 | 873.67 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560105 | CIF | C2 H6 N4 S | P -1 | 6.9352; 7.0096; 12.3675 90.894; 104.311; 101.787 | 568.89 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560106 | CIF | C7 Bi N7 Ni S6 | P 1 2/n 1 | 12.216; 36.8375; 24.5263 90; 90.224; 90 | 11036.9 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560107 | CIF | C6 H4 Bi N7 Ni S6 | P -1 | 8.4699; 8.6913; 11.9058 97.187; 91.149; 91.61 | 868.96 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560108 | CIF | C6 Bi K N6 Ni S6 | P -1 | 8.5073; 8.5686; 11.9651 97.573; 89.781; 90.997 | 864.46 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560109 | CIF | C0.92 Bi0.15 N1.25 Ni0.17 S0.86 | P n -3 :2 | 12.12528; 12.12528; 12.12528 90; 90; 90 | 1782.69 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
1560111 | CIF | C74 H86 Li4 O2 P2 Si4 | P -1 | 11.4716; 12.6646; 12.7092 85.944; 86.346; 68.446 | 1711.6 | Brand, Alexander; Schulz, Stephen; Hepp, Alexander; Weigand, Jan J.; Uhl, Werner Sterically constrained tricyclic phosphine: redox behaviour, reductive and oxidative cleavage of P‒C bonds, generation of a dilithium phosphaindole as a promising synthon in phosphine chemistry Chemical Science, 2021, 12, 3460-3474 |
1560112 | CIF | C37 H32 O5 P2 Si2 W | P 1 21/c 1 | 10.6448; 12.9069; 26.22 90; 92.664; 90 | 3598.5 | Brand, Alexander; Schulz, Stephen; Hepp, Alexander; Weigand, Jan J.; Uhl, Werner Sterically constrained tricyclic phosphine: redox behaviour, reductive and oxidative cleavage of P‒C bonds, generation of a dilithium phosphaindole as a promising synthon in phosphine chemistry Chemical Science, 2021, 12, 3460-3474 |
1560113 | CIF | C32 H32 P2 Si2 | P 1 21/c 1 | 12.2157; 10.4934; 22.6538 90; 99.262; 90 | 2866 | Brand, Alexander; Schulz, Stephen; Hepp, Alexander; Weigand, Jan J.; Uhl, Werner Sterically constrained tricyclic phosphine: redox behaviour, reductive and oxidative cleavage of P‒C bonds, generation of a dilithium phosphaindole as a promising synthon in phosphine chemistry Chemical Science, 2021, 12, 3460-3474 |
1560114 | CIF | C53 H60 Cl2 O4 P2 Si4 | P 1 21/n 1 | 10.1186; 18.8541; 27.477 90; 91.367; 90 | 5240.5 | Brand, Alexander; Schulz, Stephen; Hepp, Alexander; Weigand, Jan J.; Uhl, Werner Sterically constrained tricyclic phosphine: redox behaviour, reductive and oxidative cleavage of P‒C bonds, generation of a dilithium phosphaindole as a promising synthon in phosphine chemistry Chemical Science, 2021, 12, 3460-3474 |
1560116 | CIF | C12 H32 Cl5 N4 Ti2 | P n a 21 | 19.796; 8.413; 13.102 90; 90; 90 | 2182.1 | Kurogi, Takashi; Kuroki, Kaito; Moritani, Shunsuke; Takai, Kazuhiko Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex Chemical Science, 2021, 12, 3509-3515 |
1560117 | CIF | C14 H36 Cl10 N4 Ti2 | P 1 21/c 1 | 13.348; 13.855; 17.166 90; 112.468; 90 | 2933.6 | Kurogi, Takashi; Kuroki, Kaito; Moritani, Shunsuke; Takai, Kazuhiko Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex Chemical Science, 2021, 12, 3509-3515 |
1560118 | CIF | C10 H24 Cl3 N2 O Ti | P 1 21/n 1 | 10.972; 12.308; 12.075 90; 101.587; 90 | 1597.4 | Kurogi, Takashi; Kuroki, Kaito; Moritani, Shunsuke; Takai, Kazuhiko Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex Chemical Science, 2021, 12, 3509-3515 |
1560119 | CIF | C13 H34 Cl4 N4 Ti2 | C 1 2/c 1 | 23.348; 8.843; 12.648 90; 121.198; 90 | 2233.7 | Kurogi, Takashi; Kuroki, Kaito; Moritani, Shunsuke; Takai, Kazuhiko Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex Chemical Science, 2021, 12, 3509-3515 |
1560120 | CIF | C6 H16 Cl I N2 Zn | C 1 2/c 1 | 23.149; 7.256; 15.032 90; 111.169; 90 | 2354.5 | Kurogi, Takashi; Kuroki, Kaito; Moritani, Shunsuke; Takai, Kazuhiko Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex Chemical Science, 2021, 12, 3509-3515 |
1560121 | CIF | C13 H34 I2 N4 Zn2 | P 21 21 21 | 11.494; 13.09; 14.921 90; 90; 90 | 2245 | Kurogi, Takashi; Kuroki, Kaito; Moritani, Shunsuke; Takai, Kazuhiko Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex Chemical Science, 2021, 12, 3509-3515 |
1560122 | CIF | C24 H28 N2 O6 | P 1 21 1 | 18.5604; 7.5949; 8.0212 90; 96.383; 90 | 1123.69 | Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Bordignon, Simone; Chierotti, Michele R.; Stratford, Samuel A.; Voinovich, Dario; Jones, William; Hasa, Dritan Mechanochemical reactivity inhibited, prohibited and reversed by liquid additives: examples from crystal-form screens Chemical Science, 2021, 12, 3264-3269 |
1560123 | CIF | C24 H28 N2 O6 | C 1 2 1 | 17.9007; 6.3022; 20.9554 90; 105.356; 90 | 2279.66 | Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Bordignon, Simone; Chierotti, Michele R.; Stratford, Samuel A.; Voinovich, Dario; Jones, William; Hasa, Dritan Mechanochemical reactivity inhibited, prohibited and reversed by liquid additives: examples from crystal-form screens Chemical Science, 2021, 12, 3264-3269 |
1560124 | CIF | C24.63 H29.26 N2 O6.32 | C 1 2 1 | 17.8855; 6.3218; 21.0313 90; 105.346; 90 | 2293.19 | Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Bordignon, Simone; Chierotti, Michele R.; Stratford, Samuel A.; Voinovich, Dario; Jones, William; Hasa, Dritan Mechanochemical reactivity inhibited, prohibited and reversed by liquid additives: examples from crystal-form screens Chemical Science, 2021, 12, 3264-3269 |
1560125 | CIF | C24 H20 O4 | P 21 21 21 | 8.9924; 19.5139; 23.2425 90; 90; 90 | 4078.52 | Yang, Chi; Wu, Tian-Rui; Li, Yan; Wu, Bing-Bing; Jin, Ruo-Xing; Hu, Duo-Duo; Li, Yuan-Bo; Bian, Kang-Jie; Wang, Xi-Sheng Facile synthesis of axially chiral styrene-type carboxylic acids via palladium-catalyzed asymmetric C‒H activation Chemical Science, 2021, 12, 3726-3732 |
1560126 | CIF | C25 H18 O2 | P 1 | 8.6935; 11.1218; 12.2142 87.376; 70.785; 81.619 | 1103.26 | Yang, Chi; Wu, Tian-Rui; Li, Yan; Wu, Bing-Bing; Jin, Ruo-Xing; Hu, Duo-Duo; Li, Yuan-Bo; Bian, Kang-Jie; Wang, Xi-Sheng Facile synthesis of axially chiral styrene-type carboxylic acids via palladium-catalyzed asymmetric C‒H activation Chemical Science, 2021, 12, 3726-3732 |
1560133 | CIF | C19 H16 Br N | P 1 21 1 | 10.077; 5.678; 13.478 90; 96.922; 90 | 765.6 | Jiang, Feng; Fu, Chunling; Ma, Shengming Asymmetric construction of pyrido[1,2-<i>a</i>]-1<i>H</i>-indole derivatives <i>via</i> a gold-catalyzed cycloisomerization. Chemical science, 2020, 12, 696-701 |
1560134 | CIF | C17 H20 Cl N O | P 1 21 1 | 10.4093; 6.0139; 12.2223 90; 100.849; 90 | 751.45 | Jiang, Feng; Fu, Chunling; Ma, Shengming Asymmetric construction of pyrido[1,2-<i>a</i>]-1<i>H</i>-indole derivatives <i>via</i> a gold-catalyzed cycloisomerization. Chemical science, 2020, 12, 696-701 |
1560135 | CIF | C167 H154 Cl3 F4 N34 O30 | P 1 21/n 1 | 22.99; 45.82; 40.8 90; 90.92; 90 | 42973 | Mateus, Pedro; Jacquet, Antoine; Méndez-Ardoy, Alejandro; Boulloy, Alice; Kauffmann, Brice; Pecastaings, Gilles; Buffeteau, Thierry; Ferrand, Yann; Bassani, Dario M.; Huc, Ivan Sensing a binding event through charge transport variations using an aromatic oligoamide capsule Chemical Science, 2021, 12, 3743-3750 |
1560136 | CIF | C25 H23 N3 O5 | P 1 21/c 1 | 11.2876; 21.068; 9.751 90; 106.139; 90 | 2227.5 | Park, Hyunchang; Lee, Dongwhan Biomimetic hydrogen-bonding cascade for chemical activation: telling a nucleophile from a base. Chemical science, 2020, 12, 590-598 |
1560137 | CIF | C17 H14 Br Cl3 N2 O4 | P 1 21/c 1 | 25.8801; 6.9453; 23.8077 90; 116.121; 90 | 3842.25 | Park, Hyunchang; Lee, Dongwhan Biomimetic hydrogen-bonding cascade for chemical activation: telling a nucleophile from a base. Chemical science, 2020, 12, 590-598 |
1560138 | CIF | C16 H14 N2 O4 | I 1 2/a 1 | 17.4514; 4.6477; 35.608 90; 102.334; 90 | 2821.46 | Park, Hyunchang; Lee, Dongwhan Biomimetic hydrogen-bonding cascade for chemical activation: telling a nucleophile from a base. Chemical science, 2020, 12, 590-598 |
1560139 | CIF | C27 H43 N O3 | P 1 21/c 1 | 8.2116; 14.8475; 20.2921 90; 96.28; 90 | 2459.2 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560140 | CIF | C116 H190.67 K4 N4 O12 | I -4 3 d | 32.4579; 32.4579; 32.4579 90; 90; 90 | 34194.9 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560141 | CIF | C58 H94 Li2 N2 O7 | C 1 2/c 1 | 16.8366; 13.6239; 24.398 90; 91.454; 90 | 5594.6 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560142 | CIF | C144 H224 N6 Na12 O12 | P 1 21/n 1 | 16.206; 29.7416; 30.0188 90; 102.473; 90 | 14127.3 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560143 | CIF | C108 H172 N4 Na4 O12 | I -4 3 d | 32.0084; 32.0084; 32.0084 90; 90; 90 | 32793.8 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560144 | CIF | C115 H175 K10 N5 O10 | P 1 21/c 1 | 25.5103; 27.8549; 16.3237 90; 90.336; 90 | 11599.2 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560145 | CIF | C77 H121 Li6 N3 O8 | P 1 21 1 | 14.2409; 14.1749; 20.804 90; 104.449; 90 | 4066.7 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560146 | CIF | C138 H210 Li12 N6 O12 | P -1 | 15.9758; 16.9105; 29.646 84.635; 79.342; 87.435 | 7833.4 | Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J. Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes Chemical Science, 2021, 12, 3544-3550 |
1560147 | CIF | C22 H24 O8 | P 1 21/n 1 | 8.5666; 14.3257; 9.2306 90; 112.196; 90 | 1048.86 | Zhou, Jiawang; Stojanović, Ljiljana; Berezin, Andrey A.; Battisti, Tommaso; Gill, Abigail; Kariuki, Benson M.; Bonifazi, Davide; Crespo-Otero, Rachel; Wasielewski, Michael R.; Wu, Yi-Lin Organic room-temperature phosphorescence from halogen-bonded organic frameworks: hidden electronic effects in rigidified chromophores. Chemical science, 2020, 12, 767-773 |
1560148 | CIF | C22 H20 Br4 O8 | P -1 | 9.5351; 12.0414; 12.8133 72.585; 69.31; 89.363 | 1305.8 | Zhou, Jiawang; Stojanović, Ljiljana; Berezin, Andrey A.; Battisti, Tommaso; Gill, Abigail; Kariuki, Benson M.; Bonifazi, Davide; Crespo-Otero, Rachel; Wasielewski, Michael R.; Wu, Yi-Lin Organic room-temperature phosphorescence from halogen-bonded organic frameworks: hidden electronic effects in rigidified chromophores. Chemical science, 2020, 12, 767-773 |
1560149 | CIF | C22 H23 Br O8 | P 1 21 1 | 9.6364; 9.8092; 11.8602 90; 90.442; 90 | 1121.06 | Zhou, Jiawang; Stojanović, Ljiljana; Berezin, Andrey A.; Battisti, Tommaso; Gill, Abigail; Kariuki, Benson M.; Bonifazi, Davide; Crespo-Otero, Rachel; Wasielewski, Michael R.; Wu, Yi-Lin Organic room-temperature phosphorescence from halogen-bonded organic frameworks: hidden electronic effects in rigidified chromophores. Chemical science, 2020, 12, 767-773 |
1560150 | CIF | C65 H80 Cl N6 O6 | P -1 | 12.0771; 13.4199; 18.1881 75.562; 80.992; 87.013 | 2819.2 | Martinez-Cuezva, Alberto; Pastor, Aurelia; Marin-Luna, Marta; Diaz-Marin, Carmen; Bautista, Delia; Alajarin, Mateo; Berna, Jose Cyclization of interlocked fumaramides into β-lactams: experimental and computational mechanistic assessment of the key intercomponent proton transfer and the stereocontrolling active pocket. Chemical science, 2020, 12, 747-756 |
1560151 | CIF | C20 H20 N O2 S2 | P 1 21/n 1 | 12.3021; 7.9076; 18.7346 90; 97.095; 90 | 1808.5 | Hu, Jiefeng; Yang, Xianyu; Shi, Shasha; Cheng, Bo; Luo, Xiaoling; Lan, Yu; Loh, Teck-Peng Metal-free C(sp3)‒H functionalization of sulfonamides via strain-release rearrangement Chemical Science, 2021, 12, 4034-4040 |
1560152 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.2754; 11.2786; 19.1955 81.762; 83.501; 76.134 | 2337.6 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560153 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.3327; 11.4193; 19.3877 82.951; 80.729; 77.436 | 2406.89 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560154 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.2781; 11.2893; 19.213 83.432; 81.586; 76.335 | 2343.29 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560155 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.2958; 11.3414; 19.2872 83.238; 81.374; 76.703 | 2368.53 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560156 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.3259; 11.3917; 19.3628 83.024; 80.932; 77.121 | 2395.24 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560157 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.2236; 25.2061; 13.5364 90; 110.914; 90 | 3258.5 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560158 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.2753; 25.224; 13.5486 90; 111.171; 90 | 3274.6 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560159 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.3328; 25.4063; 13.6255 90; 111.122; 90 | 3336.6 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560160 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.361; 25.435; 13.645 90; 111.064; 90 | 3356 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560161 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.28; 25.269; 13.5675 90; 111.092; 90 | 3288.2 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560162 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.2892; 11.3208; 19.2519 83.33; 81.46; 76.478 | 2357.22 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560163 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.3088; 11.3689; 19.3307 83.1; 81.166; 76.913 | 2382.63 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560164 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.844; 11.6767; 16.7383 94.74; 95.623; 104.722 | 1840.28 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560165 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.3611; 11.5447; 19.4228 82.91; 80.543; 77.861 | 2446.24 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560166 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.8233; 11.6256; 16.7174 94.917; 95.464; 104.784 | 1825.52 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560167 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.3456; 11.4668; 19.414 82.907; 80.58; 77.69 | 2424.07 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560168 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.7522; 11.4459; 16.6761 95.5; 95.052; 104.805 | 1779.06 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560169 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.3108; 25.3315; 13.5949 90; 111.123; 90 | 3312.2 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560170 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.7269; 11.4193; 16.6601 95.565; 95.014; 104.744 | 1769.03 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560171 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.3821; 25.543; 13.668 90; 111.172; 90 | 3380 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560172 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.8091; 11.5747; 16.7136 95.109; 95.249; 104.806 | 1814.42 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560173 | CIF | C32 H40 F6 Fe N O6 P | P 1 21/n 1 | 10.354; 25.443; 13.638 90; 111.061; 90 | 3352.7 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560174 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.8649; 11.7188; 16.7606 94.613; 95.802; 104.684 | 1853.36 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560175 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.691; 11.3787; 16.6251 95.673; 94.963; 104.636 | 1753.22 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560176 | CIF | C47 H62 F6 Fe N O10 P | P -1 | 11.3733; 11.6068; 19.427 83.003; 80.579; 77.986 | 2464.26 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560177 | CIF | C33 H42 Cl2 F6 Fe N O6 P | P -1 | 9.7922; 11.5185; 16.7041 95.266; 95.19; 104.874 | 1800.49 | Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki Ring rotation of ferrocene in interlocked molecules in single crystals Chemical Science, 2021, 12, 3871-3875 |
1560178 | CIF | C26 H42 Si2 | P 1 21/c 1 | 12.1094; 11.0077; 9.4271 90; 103.617; 90 | 1221.28 | He, Tao; Wang, Guoqiang; Long, Peng-Wei; Kemper, Sebastian; Irran, Elisabeth; Klare, Hendrik F. T.; Oestreich, Martin Intramolecular Friedel-Crafts alkylation with a silylium-ion-activated cyclopropyl group: formation of tricyclic ring systems from benzyl-substituted vinylcyclopropanes and hydrosilanes. Chemical science, 2020, 12, 569-575 |
1560179 | CIF | C62 H26 Al F20 N6 | P 1 21/n 1 | 10.6538; 21.0744; 27.7419 90; 90.186; 90 | 6228.6 | Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A. Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling. Chemical science, 2020, 12, 675-682 |
1560180 | CIF | C35 H21 Al Cl2 F10 N3 O | P 1 21/n 1 | 13.3802; 15.1258; 17.4402 90; 110.95; 90 | 3296.3 | Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A. Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling. Chemical science, 2020, 12, 675-682 |
1560181 | CIF | C44 H39 Al Cl F10 N3 O2.5 | P 1 21 1 | 9.8433; 10.2481; 20.401 90; 103.193; 90 | 2003.63 | Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A. Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling. Chemical science, 2020, 12, 675-682 |
1560182 | CIF | C88 H84 Al N10 | C 1 2/c 1 | 24.1574; 16.2905; 19.344 90; 110.105; 90 | 7148.7 | Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A. Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling. Chemical science, 2020, 12, 675-682 |
1560183 | CIF | C26 H28 Co Ho N10 O8 | C m c m | 14.7754; 14.9336; 14.0276 90; 90; 90 | 3095.2 | Wang, Junhao; Zakrzewski, Jakub J.; Zychowicz, Mikolaj; Vieru, Veacheslav; Chibotaru, Liviu F.; Nakabayashi, Koji; Chorazy, Szymon; Ohkoshi, Shin-Ichi Holmium(iii) molecular nanomagnets for optical thermometry exploring the luminescence re-absorption effect. Chemical science, 2020, 12, 730-741 |
1560184 | CIF | C26 H28 Ho Ir N10 O8 | C m c m | 14.872; 15.2339; 14.1487 90; 90; 90 | 3205.51 | Wang, Junhao; Zakrzewski, Jakub J.; Zychowicz, Mikolaj; Vieru, Veacheslav; Chibotaru, Liviu F.; Nakabayashi, Koji; Chorazy, Szymon; Ohkoshi, Shin-Ichi Holmium(iii) molecular nanomagnets for optical thermometry exploring the luminescence re-absorption effect. Chemical science, 2020, 12, 730-741 |
1560185 | CIF | C26 H28 Ho N10 O8 Rh | C m c m | 14.8236; 15.1198; 14.066 90; 90; 90 | 3152.6 | Wang, Junhao; Zakrzewski, Jakub J.; Zychowicz, Mikolaj; Vieru, Veacheslav; Chibotaru, Liviu F.; Nakabayashi, Koji; Chorazy, Szymon; Ohkoshi, Shin-Ichi Holmium(iii) molecular nanomagnets for optical thermometry exploring the luminescence re-absorption effect. Chemical science, 2020, 12, 730-741 |
1560186 | CIF | C8 H8 N2 O2 | P -1 | 6.931; 7.59; 7.735 60.94; 82.44; 75.12 | 343.75 | Nicks, Joshua; Boer, Stephanie A.; White, Nicholas G.; Foster, Jonathan A. Monolayer nanosheets formed by liquid exfoliation of charge-assisted hydrogen-bonded frameworks Chemical Science, 2021, 12, 3322-3327 |
1560187 | CIF | C8 H8 N2 O2 | P -1 | 7.0348; 7.8512; 7.8827 61.268; 74.309; 82.32 | 367.54 | Nicks, Joshua; Boer, Stephanie A.; White, Nicholas G.; Foster, Jonathan A. Monolayer nanosheets formed by liquid exfoliation of charge-assisted hydrogen-bonded frameworks Chemical Science, 2021, 12, 3322-3327 |
1560188 | CIF | C8 H8 N2 O2 | P -1 | 5.5557; 7.8957; 9.0549 71.386; 83.555; 74.217 | 362.09 | Nicks, Joshua; Boer, Stephanie A.; White, Nicholas G.; Foster, Jonathan A. Monolayer nanosheets formed by liquid exfoliation of charge-assisted hydrogen-bonded frameworks Chemical Science, 2021, 12, 3322-3327 |
1560189 | CIF | C9 H11 N O3 | P 1 21/c 1 | 6.0794; 23.851; 6.5545 90; 114.294; 90 | 866.24 | Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines. Chemical science, 2020, 12, 774-779 |
1560190 | CIF | C9 H11 N O3 | P c a 21 | 10.2859; 10.6455; 7.6374 90; 90; 90 | 836.28 | Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines. Chemical science, 2020, 12, 774-779 |
1560191 | CIF | C12 H11 N O3 | P 1 21/c 1 | 12.4596; 7.5335; 10.8814 90; 92.749; 90 | 1020.2 | Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines. Chemical science, 2020, 12, 774-779 |
1560192 | CIF | C12 H11 N O3 | P 1 21/c 1 | 9.4978; 19.9607; 11.2962 90; 91.786; 90 | 2140.5 | Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines. Chemical science, 2020, 12, 774-779 |
1560197 | CIF | C33 H17 N | P 1 21/c 1 | 9.5983; 7.4141; 28.155 90; 97.017; 90 | 1988.6 | Ghosh, Animesh; Csókás, Dániel; Budanović, Maja; Webster, Richard D.; Pápai, Imre; Stuparu, Mihaiela C. Synthesis of azahelicenes through Mallory reaction of imine precursors: corannulene substrates provide an exception to the rule in oxidative photocyclizations of diarylethenes Chemical Science, 2021, 12, 3977-3983 |
1560198 | CIF | As B F H4 N O4 | C 1 c 1 | 4.4453; 8.1098; 12.7463 90; 90; 90 | 459.51 | Bai, Zhiyong; Liu, Lehui; Wang, Dongmei; Hu, Chun-Li; Lin, Zhoubin To improve the key properties of nonlinear optical crystals assembled with tetrahedral functional building units Chemical Science, 2021, 12, 4014-4020 |
1560199 | CIF | C65 H65 Cu F3 N4 O4 P3 S | P -1 | 10.6937; 10.7364; 25.1952 88.365; 83.658; 83.887 | 2858.25 | Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C. Using internal electrostatic fields to manipulate the valence manifolds of copper complexes Chemical Science, 2021, 12, 4395-4404 |
1560200 | CIF | C43 H49 B Cl Cu F20 N4 O P3 | P 1 21/c 1 | 16.4423; 20.739; 15.7833 90; 104.388; 90 | 5213.2 | Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C. Using internal electrostatic fields to manipulate the valence manifolds of copper complexes Chemical Science, 2021, 12, 4395-4404 |
1560201 | CIF | C15 H39 Cl2 Cu N4 P3 | P b c a | 16.2129; 16.8046; 17.8201 90; 90; 90 | 4855.1 | Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C. Using internal electrostatic fields to manipulate the valence manifolds of copper complexes Chemical Science, 2021, 12, 4395-4404 |
1560202 | CIF | C54 H45 B Cu F20 N4 P3 | P 1 21/n 1 | 12.8794; 28.2479; 15.6613 90; 110.76; 90 | 5327.9 | Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C. Using internal electrostatic fields to manipulate the valence manifolds of copper complexes Chemical Science, 2021, 12, 4395-4404 |
1560203 | CIF | C39 H39 B Cu F20 N4 P3 | P -1 | 13.443; 14.253; 14.599 93.503; 105.397; 107.916 | 2534.8 | Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C. Using internal electrostatic fields to manipulate the valence manifolds of copper complexes Chemical Science, 2021, 12, 4395-4404 |
1560204 | CIF | C19 H18 N2 O2 S2 | P 1 21 1 | 9.6009; 10.3983; 9.9867 90; 115.222; 90 | 901.95 | Zhong, Xia; Zhong, Ziwei; Wu, Zhikun; Ye, Zhen; Feng, Yuxiang; Dong, Shunxi; Liu, Xiaohua; Peng, Qian; Feng, Xiaoming Chiral Lewis acid-bonded picolinaldehyde enables enantiodivergent carbonyl catalysis in the Mannich/condensation reaction of glycine ester Chemical Science, 2021, 12, 4353-4360 |
1560205 | CIF | C38 H56 F9 N4 O16 S3 Yb | P 21 21 2 | 23.069; 24.5839; 9.5501 90; 90; 90 | 5416.1 | Zhong, Xia; Zhong, Ziwei; Wu, Zhikun; Ye, Zhen; Feng, Yuxiang; Dong, Shunxi; Liu, Xiaohua; Peng, Qian; Feng, Xiaoming Chiral Lewis acid-bonded picolinaldehyde enables enantiodivergent carbonyl catalysis in the Mannich/condensation reaction of glycine ester Chemical Science, 2021, 12, 4353-4360 |
1560206 | CIF | C49 H78 F9 N4 O17 S3 Yb | P 1 21 1 | 11.9789; 20.7474; 12.9099 90; 106.293; 90 | 3079.7 | Zhong, Xia; Zhong, Ziwei; Wu, Zhikun; Ye, Zhen; Feng, Yuxiang; Dong, Shunxi; Liu, Xiaohua; Peng, Qian; Feng, Xiaoming Chiral Lewis acid-bonded picolinaldehyde enables enantiodivergent carbonyl catalysis in the Mannich/condensation reaction of glycine ester Chemical Science, 2021, 12, 4353-4360 |
1560207 | CIF | C122 H112 O4 S2 | P -1 | 8.9363; 15.5536; 17.3731 106.709; 97.475; 95.961 | 2267.6 | Lu, Xuefeng; An, Dongyue; Han, Yi; Zou, Ya; Qiao, Yanjun; Zhang, Ning; Chang, Dongdong; Wu, Jishan; Liu, Yunqi A cyclopenta-fused dibenzo[b,d]thiophene-co-phenanthrene macrocyclic tetraradicaloid Chemical Science, 2021, 12, 3952-3957 |
1560208 | CIF | C63 H66 Cu3 N9 | P -1 | 9.7333; 27.941; 42.675 75.096; 83.457; 84.935 | 11121.3 | Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong; Zou, Bo; Li, Dan Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex Chemical Science, 2021, 12, 4425-4431 |
1560209 | CIF | C63 H66 Cu3 N9 | P 1 c 1 | 11.4093; 28.8937; 17.7109 90; 104.338; 90 | 5656.66 | Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong; Zou, Bo; Li, Dan Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex Chemical Science, 2021, 12, 4425-4431 |
1560210 | CIF | C63 H66 Cu3 N9 | P 1 21/c 1 | 11.52641; 29.1085; 17.85854 90; 103.99; 90 | 5814.11 | Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong; Zou, Bo; Li, Dan Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex Chemical Science, 2021, 12, 4425-4431 |
1560211 | CIF | C22 H45 Fe N4 O7 | P 1 21/c 1 | 13.571; 11.046; 19.406 90; 102.992; 90 | 2834.6 | Keshari, Kritika; Bera, Moumita; Velasco, Lucía; Munshi, Sandip; Gupta, Geetika; Moonshiram, Dooshaye; Paria, Sayantan Characterization and reactivity study of non-heme high-valent iron‒hydroxo complexes Chemical Science, 2021, 12, 4418-4424 |
1560212 | CIF | C30 H16 O2 | P 1 21/c 1 | 8.1656; 15.1358; 15.7979 90; 102.468; 90 | 1906.5 | Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes Chemical Science, 2021, 12, 2784-2793 |
1560213 | CIF | C30 H18 N2 | P 1 21/c 1 | 15.9958; 15.9492; 7.8148 90; 91.516; 90 | 1993.02 | Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes Chemical Science, 2021, 12, 2784-2793 |
1560214 | CIF | C15 H8 O2 S | C 1 2/c 1 | 17.7976; 10.4721; 11.7388 90; 99.158; 90 | 2159.97 | Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes Chemical Science, 2021, 12, 2784-2793 |
1560215 | CIF | C57 H34 Cl2 | P 21 21 21 | 8.57192; 20.53361; 22.43166 90; 90; 90 | 3948.25 | Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes Chemical Science, 2021, 12, 2784-2793 |
1560216 | CIF | C30 H16 S2 | P 1 21/n 1 | 9.338; 13.622; 16.299 90; 102.204; 90 | 2026.4 | Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes Chemical Science, 2021, 12, 2784-2793 |
1560217 | CIF | C28.5 H16.5 Cl1.5 O | P 41 2 2 | 9.0201; 9.0201; 49.382 90; 90; 90 | 4017.8 | Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes Chemical Science, 2021, 12, 2784-2793 |
1560218 | CIF | C70 H86 B P2 Y | P 1 21/c 1 | 19.84621; 15.33735; 19.6362 90; 91.1824; 90 | 5975.76 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560219 | CIF | C39 H57 Cl2 F6 P2 Ru Sb | P 1 21/n 1 | 14.68263; 10.27641; 28.8561 90; 94.9221; 90 | 4337.89 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560220 | CIF | C26 H36 Cl4 Hf P2 | P 1 21/c 1 | 13.847; 11.756; 17.937 90; 95.395; 90 | 2907 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560221 | CIF | C33 H43 Cl5 N P2 Ta | P b c a | 20.20265; 16.84883; 20.7566 90; 90; 90 | 7065.36 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560222 | CIF | C30.5 H39 Br Cl3 Mn O3 P2 | P 1 21/c 1 | 12.12; 18.798; 15.683 90; 111.303; 90 | 3329 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560223 | CIF | C30 H36 Cr O4 P2 | P 1 21/n 1 | 11.87864; 15.68278; 15.58857 90; 102.773; 90 | 2832.13 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560224 | CIF | C45 H60 Cl N O2 P2 Pt | P 1 21/c 1 | 18.1766; 11.59885; 21.4296 90; 114.947; 90 | 4096.41 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560225 | CIF | C38 H55 Cl5 F6 P2 Rh Sb | P 1 21/c 1 | 8.68119; 24.5831; 20.7842 90; 96.7728; 90 | 4404.61 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560226 | CIF | C33 H42 N2 O3 P2 W | P 1 21/n 1 | 10.771; 18.02; 16.983 90; 97.989; 90 | 3264 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560227 | CIF | C29 H36 O3 P2 W | P b c a | 15.652; 16.072; 22.3038 90; 90; 90 | 5610.7 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560228 | CIF | C33 H42 Mo N2 O3 P2 | P 1 21/n 1 | 10.771; 18.08; 16.992 90; 97.838; 90 | 3278 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560229 | CIF | C38 H52 Mo O6 P2 | P 1 21/c 1 | 10.8424; 15.9246; 22.3877 90; 101.63; 90 | 3786.12 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560230 | CIF | C35 H48 Mo O4.5 P2 | C 1 2/c 1 | 32.514; 11.57882; 39.5477 90; 113.917; 90 | 13610.2 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560231 | CIF | C86 H100 Au B F2 O P2 | P 1 21/c 1 | 11.28458; 13.79053; 47.7699 90; 90.5291; 90 | 7433.65 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560232 | CIF | C29 H36 Mo O3 P2 | P b c a | 15.65317; 16.11165; 22.26048 90; 90; 90 | 5614.06 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560233 | CIF | C56 H82 O3 P2 S2 Zn | P 1 21/c 1 | 20.688; 26.218; 40.07 90; 95.99; 90 | 21615 | Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation Chemical Science, 2021, 12, 3693-3701 |
1560236 | CIF | C32 H43 Ba N6 O11 S2 | P c a 21 | 17.6827; 10.4422; 22.5408 90; 90; 90 | 4162.08 | Abou, Diane S.; Thiele, Nikki A.; Gutsche, Nicholas T.; Villmer, Alexandria; Zhang, Hanwen; Woods, Joshua J.; Baidoo, Kwamena E.; Escorcia, Freddy E.; Wilson, Justin J.; Thorek, Daniel L. J. Towards the stable chelation of radium for biomedical applications with an 18-membered macrocyclic ligand Chemical Science, 2021, 12, 3733-3742 |
1560237 | CIF | C59 H76 Cl Ir N2 | P 21 21 21 | 16.297; 17.0451; 17.8125 90; 90; 90 | 4948.03 | Foster, Daven; Gao, Pengchao; Zhang, Ziyun; Sipos, Gellért; Sobolev, Alexandre N.; Nealon, Gareth; Falivene, Laura; Cavallo, Luigi; Dorta, Reto Design, scope and mechanism of highly active and selective chiral NHC‒iridium catalysts for the intramolecular hydroamination of a variety of unactivated aminoalkenes Chemical Science, 2021, 12, 3751-3767 |
1560238 | CIF | C55 H64 Br2 N4 O13 | P -1 | 9.3936; 16.783; 17.8687 75.171; 83.247; 84.427 | 2697.7 | Wilson, Benjamin H.; Abdulla, Louae M.; Schurko, Robert W.; Loeb, Stephen J. Translational dynamics of a non-degenerate molecular shuttle imbedded in a zirconium metal‒organic framework Chemical Science, 2021, 12, 3944-3951 |
1560239 | CIF | C50 H52 Br2 N4 O12 | P 1 21/n 1 | 19.889; 18.209; 33.691 90; 105.93; 90 | 11733 | Wilson, Benjamin H.; Abdulla, Louae M.; Schurko, Robert W.; Loeb, Stephen J. Translational dynamics of a non-degenerate molecular shuttle imbedded in a zirconium metal‒organic framework Chemical Science, 2021, 12, 3944-3951 |
1560240 | CIF | C57 H67.5 B Br2 F4 N4.5 O12.5 | P 1 21/c 1 | 28.49; 10.505; 43.418 90; 106.34; 90 | 12470 | Wilson, Benjamin H.; Abdulla, Louae M.; Schurko, Robert W.; Loeb, Stephen J. Translational dynamics of a non-degenerate molecular shuttle imbedded in a zirconium metal‒organic framework Chemical Science, 2021, 12, 3944-3951 |
1560241 | CIF | C38 H41 F3 P2 | P 1 21/c 1 | 9.60831; 33.8371; 10.09764 90; 99.1105; 90 | 3241.5 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560242 | CIF | C41.79 H50.79 Cl0.41 N0.79 P2 | P -1 | 10.9245; 12.9655; 14.1731 63.574; 81.1475; 75.1466 | 1735.83 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560243 | CIF | C38 H44 Au Cl O P2 | C 1 2/c 1 | 41.898; 15.2834; 11.6875 90; 93.097; 90 | 7473.1 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560244 | CIF | C41 H50 Au Cl O P2 | P -1 | 9.3045; 10.502; 18.6397 97.739; 91.819; 94.738 | 1796.94 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560245 | CIF | C38 H44 P2 | P 1 21/n 1 | 10.29027; 10.5467; 29.0177 90; 96.2428; 90 | 3130.57 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560246 | CIF | C45 H52 Au Cl P2 | P 1 21/c 1 | 11.24594; 18.3601; 18.9125 90; 95.9476; 90 | 3883.97 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560247 | CIF | C40 H48 Au Cl P2 | P 1 21/n 1 | 12.0432; 16.7764; 17.8978 90; 106.65; 90 | 3464.49 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560248 | CIF | C38 H41 Au Cl F3 P2 | P -1 | 11.01072; 17.1399; 18.8182 80.1354; 77.3539; 89.9789 | 3411.48 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560249 | CIF | C38 H44 O P2 | P c a 21 | 11.3956; 15.6766; 18.1208 90; 90; 90 | 3237.18 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560250 | CIF | C44 H50 P2 | P -1 | 9.3576; 13.3096; 14.9346 93.442; 93.343; 107.914 | 1760.89 | Handelmann, Jens; Babu, Chatla Naga; Steinert, Henning; Schwarz, Christopher; Scherpf, Thorsten; Kroll, Alexander; Gessner, Viktoria H. Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis Chemical Science, 2021, 12, 4329-4337 |
1560274 | CIF | C32 H40 K N O6 | P 1 21 1 | 9.4575; 13.1739; 12.1272 90; 101.138; 90 | 1482.49 | Panetti, Grace B.; Carroll, Patrick J.; Gau, Michael R.; Manor, Brian C.; Schelter, Eric J.; Walsh, Patrick J. Synthesis of an elusive, stable 2-azaallyl radical guided by electrochemical and reactivity studies of 2-azaallyl anions Chemical Science, 2021, 12, 4405-4410 |
1560275 | CIF | C38 H50 N Na O6 | P 1 21/c 1 | 17.7615; 11.8703; 34.9201 90; 100.04; 90 | 7249.6 | Panetti, Grace B.; Carroll, Patrick J.; Gau, Michael R.; Manor, Brian C.; Schelter, Eric J.; Walsh, Patrick J. Synthesis of an elusive, stable 2-azaallyl radical guided by electrochemical and reactivity studies of 2-azaallyl anions Chemical Science, 2021, 12, 4405-4410 |
1560276 | CIF | C32 H46 N Na O6 | P -1 | 11.6153; 11.6198; 12.645 104.751; 95.937; 99.774 | 1607.08 | Panetti, Grace B.; Carroll, Patrick J.; Gau, Michael R.; Manor, Brian C.; Schelter, Eric J.; Walsh, Patrick J. Synthesis of an elusive, stable 2-azaallyl radical guided by electrochemical and reactivity studies of 2-azaallyl anions Chemical Science, 2021, 12, 4405-4410 |
1560277 | CIF | C26 H20 N | P 1 21 1 | 9.8522; 7.7653; 12.2084 90; 95.841; 90 | 929.16 | Panetti, Grace B.; Carroll, Patrick J.; Gau, Michael R.; Manor, Brian C.; Schelter, Eric J.; Walsh, Patrick J. Synthesis of an elusive, stable 2-azaallyl radical guided by electrochemical and reactivity studies of 2-azaallyl anions Chemical Science, 2021, 12, 4405-4410 |
1560278 | CIF | C64 H92 Li2 N2 O12 | P 1 21/c 1 | 11.6347; 18.1467; 31.5962 90; 95.756; 90 | 6637.3 | Panetti, Grace B.; Carroll, Patrick J.; Gau, Michael R.; Manor, Brian C.; Schelter, Eric J.; Walsh, Patrick J. Synthesis of an elusive, stable 2-azaallyl radical guided by electrochemical and reactivity studies of 2-azaallyl anions Chemical Science, 2021, 12, 4405-4410 |
1560279 | CIF | C17.24 H19.73 N3 O4.75 | P -1 | 7.2814; 10.1224; 12.178 92.523; 106.963; 100.062 | 841.02 | Brownsey, Duncan K.; Rowley, Ben C.; Gorobets, Evgueni; Gelfand, Benjamin S.; Derksen, Darren J. Rapid synthesis of pomalidomide-conjugates for the development of protein degrader libraries Chemical Science, 2021, 12, 4519-4525 |
1560298 | CIF | C22 H21 B F2 N2 O2 | P c a 21 | 12.6493; 9.244; 18.0005 90; 90; 90 | 2104.8 | Meazza, Marta; Cruz, Carlos M.; Ortuño, Ana M.; Cuerva, Juan M.; Crovetto, Luis; Rios, Ramon Studying the reactivity of alkyl substituted BODIPYs: first enantioselective addition of BODIPY to MBH carbonates Chemical Science, 2021, 12, 4503-4508 |
1560301 | CIF | C144 H124 N2 P8 Ru2 S | P n a 21 | 25.3115; 44.5483; 10.235 90; 90; 90 | 11540.8 | Tanaka, Yuya; Kato, Yuya; Sugimoto, Kaho; Kawano, Reo; Tada, Tomofumi; Fujii, Shintaro; Kiguchi, Manabu; Akita, Munetaka Single-molecule junctions of multinuclear organometallic wires: long-range carrier transport brought about by metal‒metal interaction Chemical Science, 2021, 12, 4338-4344 |
1560302 | CIF | C198 H178 P12 Ru3 S2 Si2 | P -1 | 12.3659; 17.9279; 20.5933 108.974; 100.29; 100.6 | 4101.7 | Tanaka, Yuya; Kato, Yuya; Sugimoto, Kaho; Kawano, Reo; Tada, Tomofumi; Fujii, Shintaro; Kiguchi, Manabu; Akita, Munetaka Single-molecule junctions of multinuclear organometallic wires: long-range carrier transport brought about by metal‒metal interaction Chemical Science, 2021, 12, 4338-4344 |
1560303 | CIF | C126 H116 P8 Ru2 S Si2 | P -1 | 10.107; 15.3835; 37.02 83.51; 89.395; 86.371 | 5707.5 | Tanaka, Yuya; Kato, Yuya; Sugimoto, Kaho; Kawano, Reo; Tada, Tomofumi; Fujii, Shintaro; Kiguchi, Manabu; Akita, Munetaka Single-molecule junctions of multinuclear organometallic wires: long-range carrier transport brought about by metal‒metal interaction Chemical Science, 2021, 12, 4338-4344 |
1560304 | CIF | C25 H14 O3 S | P 1 21/m 1 | 7.5851; 43.318; 8.593 90; 100.325; 90 | 2777.7 | Shaikh, Aslam C.; Veleta, José M.; Moutet, Jules; Gianetti, Thomas L. Trioxatriangulenium (TOTA+) as a robust carbon-based Lewis acid in frustrated Lewis pair chemistry Chemical Science, 2021, 12, 4841-4849 |
1560305 | CIF | C62 H41 B F24 N2 O3 | P -1 | 13.4502; 15.5304; 16.0826 106.612; 101.513; 105.375 | 2962.9 | Shaikh, Aslam C.; Veleta, José M.; Moutet, Jules; Gianetti, Thomas L. Trioxatriangulenium (TOTA+) as a robust carbon-based Lewis acid in frustrated Lewis pair chemistry Chemical Science, 2021, 12, 4841-4849 |
1560306 | CIF | C70.5 H56 B Cl F24 N3 O3 P | P -1 | 13.1828; 17.102; 17.4082 114.902; 105.306; 96.778 | 3313.7 | Shaikh, Aslam C.; Veleta, José M.; Moutet, Jules; Gianetti, Thomas L. Trioxatriangulenium (TOTA+) as a robust carbon-based Lewis acid in frustrated Lewis pair chemistry Chemical Science, 2021, 12, 4841-4849 |
1560307 | CIF | C64 H50 B F24 O4 P | P 1 21/c 1 | 19.596; 18.3533; 18.172 90; 108.476; 90 | 6198.7 | Shaikh, Aslam C.; Veleta, José M.; Moutet, Jules; Gianetti, Thomas L. Trioxatriangulenium (TOTA+) as a robust carbon-based Lewis acid in frustrated Lewis pair chemistry Chemical Science, 2021, 12, 4841-4849 |
1560308 | CIF | C23 H20 B Cl2 F4 O3 P | P 1 21/c 1 | 10.071; 18.5524; 13.0354 90; 111.106; 90 | 2272.16 | Shaikh, Aslam C.; Veleta, José M.; Moutet, Jules; Gianetti, Thomas L. Trioxatriangulenium (TOTA+) as a robust carbon-based Lewis acid in frustrated Lewis pair chemistry Chemical Science, 2021, 12, 4841-4849 |
1560309 | CIF | C12 H8 N2 O | P 1 21/c 1 | 14.2681; 3.9182; 17.1782 90; 109.954; 90 | 902.7 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560310 | CIF | C13 H11 N O2 | P 1 21/c 1 | 10.6358; 9.5636; 10.4269 90; 100.187; 90 | 1043.87 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560311 | CIF | C13 H11 N O | P 1 21/c 1 | 10.8844; 9.9707; 9.168 90; 91.835; 90 | 994.45 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560312 | CIF | C14 H13 N O2 | P 1 21/c 1 | 11.6656; 9.4061; 10.7626 90; 97.797; 90 | 1170.04 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560313 | CIF | C23 H25 N O3 | C 1 2 1 | 21.9099; 6.5137; 14.4743 90; 115.663; 90 | 1861.93 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560314 | CIF | C10 H11 N S | P -1 | 7.3211; 7.9973; 8.7918 69.178; 74.117; 83.714 | 462.72 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560315 | CIF | C13 H11 N O2 | P 1 21/n 1 | 12.1957; 7.1469; 12.4085 90; 105.197; 90 | 1043.72 | Mayer, Robert J.; Allihn, Patrick W. A.; Hampel, Nathalie; Mayer, Peter; Sieber, Stephan A.; Ofial, Armin R. Electrophilic reactivities of cyclic enones and α,β-unsaturated lactones Chemical Science, 2021, 12, 4850-4865 |
1560367 | CIF | C35 H51 K Mn N3 O12 | P 1 21/c 1 | 9.4091; 15.768; 25.766 90; 94.907; 90 | 3808.7 | Yang, Yong; Ertem, Mehmed Z.; Duan, Lele An amide-based second coordination sphere promotes the dimer pathway of Mn-catalyzed CO2-to-CO reduction at low overpotential Chemical Science, 2021, 12, 4779-4788 |
1560368 | CIF | C16 H13 Br Mn N3 O4 | P 1 21/n 1 | 10.5955; 10.5011; 15.0027 90; 94.048; 90 | 1665.1 | Yang, Yong; Ertem, Mehmed Z.; Duan, Lele An amide-based second coordination sphere promotes the dimer pathway of Mn-catalyzed CO2-to-CO reduction at low overpotential Chemical Science, 2021, 12, 4779-4788 |
1560369 | CIF | C15 H11 Br Mn N3 O4 | P 1 21/c 1 | 10.65; 9.121; 16.456 90; 100.266; 90 | 1572.9 | Yang, Yong; Ertem, Mehmed Z.; Duan, Lele An amide-based second coordination sphere promotes the dimer pathway of Mn-catalyzed CO2-to-CO reduction at low overpotential Chemical Science, 2021, 12, 4779-4788 |
1560370 | CIF | C22 H20 N2 O9 | P 1 21 1 | 6.8601; 20.5081; 7.345 90; 92.708; 90 | 1032.2 | Yang, Jinghui; Xia, Yan Mechanochemical generation of acid-degradable poly(enol ether)s Chemical Science, 2021, 12, 4389-4394 |
1560371 | CIF | C9 H15 B F4 N6 | I 1 2/m 1 | 10.535; 6.4885; 18.7172 90; 92.323; 90 | 1278.39 | Stubbe, Jessica; Suhr, Simon; Beerhues, Julia; Nößler, Maite; Sarkar, Biprajit The transformations of a methylene-bridged bis-triazolium salt: a mesoionic carbene based metallocage and analogues of TCNE and NacNac Chemical Science, 2021, 12, 3170-3178 |
1560372 | CIF | C9 H16 B2 F8 N6 | P -1 | 7.1669; 9.7427; 11.6885 90.304; 91.835; 105.407 | 786.33 | Stubbe, Jessica; Suhr, Simon; Beerhues, Julia; Nößler, Maite; Sarkar, Biprajit The transformations of a methylene-bridged bis-triazolium salt: a mesoionic carbene based metallocage and analogues of TCNE and NacNac Chemical Science, 2021, 12, 3170-3178 |
1560373 | CIF | C22 H34 B4 F16 N14 | P -1 | 10.15; 11.83; 15.93 97.92; 92.65; 102.91 | 1841 | Stubbe, Jessica; Suhr, Simon; Beerhues, Julia; Nößler, Maite; Sarkar, Biprajit The transformations of a methylene-bridged bis-triazolium salt: a mesoionic carbene based metallocage and analogues of TCNE and NacNac Chemical Science, 2021, 12, 3170-3178 |
1560374 | CIF | C42 H57 Ag4 B4 F15.987 N27 | P -1 | 11.052; 14.637; 21.244 85.032; 81.796; 77.855 | 3319.6 | Stubbe, Jessica; Suhr, Simon; Beerhues, Julia; Nößler, Maite; Sarkar, Biprajit The transformations of a methylene-bridged bis-triazolium salt: a mesoionic carbene based metallocage and analogues of TCNE and NacNac Chemical Science, 2021, 12, 3170-3178 |
1560499 | CIF | C57 H43 Cl3 N6 Ni | P 1 21/c 1 | 9.4132; 16.3463; 31.8 90; 91.407; 90 | 4891.6 | Abid, Seifallah; Gisbert, Yohan; Kojima, Mitsuru; Saffon-Merceron, Nathalie; Cuny, Jérôme; Kammerer, Claire; Rapenne, Gwénaël Desymmetrised pentaporphyrinic gears mounted on metallo-organic anchors Chemical Science, 2021, 12, 4709-4721 |
1560500 | CIF | C127 H101 B Br4 N12 Ni Ru S3 | P -1 | 16.1291; 19.1492; 24.8626 75.72; 89.677; 66.509 | 6787.8 | Abid, Seifallah; Gisbert, Yohan; Kojima, Mitsuru; Saffon-Merceron, Nathalie; Cuny, Jérôme; Kammerer, Claire; Rapenne, Gwénaël Desymmetrised pentaporphyrinic gears mounted on metallo-organic anchors Chemical Science, 2021, 12, 4709-4721 |
1560501 | CIF | C28 H36 Br O3 P | P 21 21 21 | 9.15691; 16.71291; 17.53844 90; 90; 90 | 2684.06 | Huang, Qiu-Hong; Zhou, Qian-Yi; Yang, Chen; Chen, Li; Cheng, Jin-Pei; Li, Xin Access to P-stereogenic compounds via desymmetrizing enantioselective bromination Chemical Science, 2021, 12, 4582-4587 |
1560502 | CIF | C22 H20 O4 | P 21 21 21 | 8.9798; 11.0389; 17.2809 90; 90; 90 | 1713.01 | Lu, Xiao-Long; Qiu, Yuanyou; Yang, Baochao; He, Haibing; Gao, Shuanhu Asymmetric total synthesis of (+)-xestoquinone and (+)-adociaquinones A and B Chemical Science, 2021, 12, 4747-4752 |
1560503 | CIF | C22 H20 O4 | P 21 21 21 | 9.1038; 11.1728; 17.3015 90; 90; 90 | 1759.82 | Lu, Xiao-Long; Qiu, Yuanyou; Yang, Baochao; He, Haibing; Gao, Shuanhu Asymmetric total synthesis of (+)-xestoquinone and (+)-adociaquinones A and B Chemical Science, 2021, 12, 4747-4752 |
1560504 | CIF | C26 H32 Cl2 O5 | P 21 21 21 | 7.4407; 11.6989; 28.3425 90; 90; 90 | 2467.16 | Lu, Xiao-Long; Qiu, Yuanyou; Yang, Baochao; He, Haibing; Gao, Shuanhu Asymmetric total synthesis of (+)-xestoquinone and (+)-adociaquinones A and B Chemical Science, 2021, 12, 4747-4752 |
1560527 | CIF | C40 H52 B20 | P 32 2 1 | 11.3287; 11.3287; 29.3678 90; 90; 120 | 3264.1 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560528 | CIF | C18 H38 B20 Cl2 | C 1 2/c 1 | 33.909; 13.6784; 13.6791 90; 108.58; 90 | 6014 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560529 | CIF | C22 H46 B20 Cl2 | P 21 21 21 | 11.7538; 12.8616; 21.8976 90; 90; 90 | 3310.3 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560530 | CIF | C44 H60 B20 | P 1 21/n 1 | 11.4361; 19.1205; 21.4742 90; 94.001; 90 | 4684.2 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560531 | CIF | C27 H54.5 B20 O0.25 | P -1 | 13.3453; 16.5248; 18.4539 82.5401; 78.3148; 83.5363 | 3935.9 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560532 | CIF | C30 H60 B20 | C 1 2/c 1 | 24.2513; 10.403; 18.2107 90; 120.094; 90 | 3975 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560533 | CIF | C22 H48 B20 | P 21 21 21 | 10.3911; 13.0014; 24.381 90; 90; 90 | 3293.8 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560534 | CIF | C26 H56 B20 | P 1 21/n 1 | 13.3754; 13.4901; 19.9071 90; 91.104; 90 | 3591.3 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560535 | CIF | C24 H54 B20 | P 1 21/n 1 | 13.2519; 11.98; 21.8685 90; 105.683; 90 | 3342.5 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560536 | CIF | C26 H62 B20 Si2 | P -1 | 11.326; 12.468; 15.493 108.096; 95.522; 104.001 | 1982.7 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560537 | CIF | C38 H59 B20 | P -1 | 11.6972; 13.3199; 15.5282 75.8963; 79.1092; 66.3809 | 2138.51 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560538 | CIF | C27 H48 B20 | P 1 21/c 1 | 11.0591; 17.981; 17.9274 90; 92.3086; 90 | 3562 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560539 | CIF | C14 H30 B10 | P 1 21/c 1 | 11.1066; 27.939; 12.8423 90; 90.244; 90 | 3985 | Zhang, Jie; Xie, Zuowei Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics Chemical Science, 2021, 12, 5616-5620 |
1560599 | CIF | C30 H18 N4 S | R -3 :H | 25.7763; 25.7763; 17.9852 90; 90; 120 | 10348.7 | Liu, Tiantian; Chen, Xiaojie; Zhao, Juan; Wei, Weichun; Mao, Zhu; Wu, William; Jiao, Shibo; Liu, Yang; Yang, Zhiyong; Chi, Zhenguo Hybridized local and charge-transfer excited state fluorophores enabling organic light-emitting diodes with record high efficiencies close to 20% Chemical Science, 2021, 12, 5171-5176 |
1560600 | CIF | C47 H52 Cl2 N4 S | P -1 | 10.6634; 10.9432; 18.341 88.604; 83.994; 82.942 | 2112.2 | Liu, Tiantian; Chen, Xiaojie; Zhao, Juan; Wei, Weichun; Mao, Zhu; Wu, William; Jiao, Shibo; Liu, Yang; Yang, Zhiyong; Chi, Zhenguo Hybridized local and charge-transfer excited state fluorophores enabling organic light-emitting diodes with record high efficiencies close to 20% Chemical Science, 2021, 12, 5171-5176 |
1560601 | CIF | C64 H72 N4 S | P -1 | 12.041; 15.9608; 16.4529 114.757; 104.294; 93.279 | 2735.8 | Liu, Tiantian; Chen, Xiaojie; Zhao, Juan; Wei, Weichun; Mao, Zhu; Wu, William; Jiao, Shibo; Liu, Yang; Yang, Zhiyong; Chi, Zhenguo Hybridized local and charge-transfer excited state fluorophores enabling organic light-emitting diodes with record high efficiencies close to 20% Chemical Science, 2021, 12, 5171-5176 |
1560602 | CIF | C29 H23 F O5 | P 1 21 1 | 9.9631; 9.1494; 13.3605 90; 102.001; 90 | 1191.28 | Zheng, Haifeng; Wang, Rui; Wang, Kan; Wherritt, Daniel; Arman, Hadi; Doyle, Michael P. Formal [4 + 4]-, [4 + 3]-, and [4 + 2]-cycloaddition reactions of donor‒acceptor cyclobutenes, cyclopropenes and siloxyalkynes induced by Brønsted acid catalysis Chemical Science, 2021, 12, 4819-4824 |
1560603 | CIF | C15 H15 F O2 | P 1 21/n 1 | 7.3867; 19.0785; 9.3357 90; 111.972; 90 | 1220.09 | Zheng, Haifeng; Wang, Rui; Wang, Kan; Wherritt, Daniel; Arman, Hadi; Doyle, Michael P. Formal [4 + 4]-, [4 + 3]-, and [4 + 2]-cycloaddition reactions of donor‒acceptor cyclobutenes, cyclopropenes and siloxyalkynes induced by Brønsted acid catalysis Chemical Science, 2021, 12, 4819-4824 |
1560604 | CIF | C28 H20 F N O4 | P 1 21/c 1 | 12.28538; 20.3181; 8.91344 90; 99.0372; 90 | 2197.31 | Zheng, Haifeng; Wang, Rui; Wang, Kan; Wherritt, Daniel; Arman, Hadi; Doyle, Michael P. Formal [4 + 4]-, [4 + 3]-, and [4 + 2]-cycloaddition reactions of donor‒acceptor cyclobutenes, cyclopropenes and siloxyalkynes induced by Brønsted acid catalysis Chemical Science, 2021, 12, 4819-4824 |
1560621 | CIF | C56.08 H50 Cl12.16 N4 Ni Sb | P -1 | 9.2156; 20.0257; 21.5606 114.68; 94.469; 98.787 | 3528.32 | Miyagawa, Kazuya; Hisaki, Ichiro; Fukui, Norihito; Shinokubo, Hiroshi Redox-induced reversible [2 + 2] cycloaddition of an etheno-fused diporphyrin Chemical Science, 2021, 12, 5224-5229 |
1560622 | CIF | C254 H248 N16 Ni4 | P -1 | 21.0654; 22.4572; 25.0542 104.279; 98.423; 111.649 | 10298.3 | Miyagawa, Kazuya; Hisaki, Ichiro; Fukui, Norihito; Shinokubo, Hiroshi Redox-induced reversible [2 + 2] cycloaddition of an etheno-fused diporphyrin Chemical Science, 2021, 12, 5224-5229 |
1560717 | CIF | C17.5 H29 N9 Ni O0.5 S2 | P 1 21/n 1 | 14.8018; 16.4349; 19.1348 90; 102.494; 90 | 4544.6 | Rubín-Osanz, Marcos; Lambert, François; Shao, Feng; Rivière, Eric; Guillot, Régis; Suaud, Nicolas; Guihéry, Nathalie; Zueco, David; Barra, Anne-Laure; Mallah, Talal; Luis, Fernando Chemical tuning of spin clock transitions in molecular monomers based on nuclear spin-free Ni(ii) Chemical Science, 2021, 12, 5123-5133 |
1560718 | CIF | C38 H38 Cl6 N8 S6 | P -1 | 10.2559; 15.7584; 16.1989 67.534; 71.56; 75.75 | 2271.55 | Ding, Yanjun; Alimi, Lukman O.; Moosa, Basem; Maaliki, Carine; Jacquemin, Johan; Huang, Feihe; Khashab, Niveen M. Selective adsorptive separation of cyclohexane over benzene using thienothiophene cages Chemical Science, 2021, 12, 5315-5318 |
1560719 | CIF | C45 H45 N8 S6 | P 1 21/n 1 | 12.8314; 15.7916; 21.178 90; 92.517; 90 | 4287.12 | Ding, Yanjun; Alimi, Lukman O.; Moosa, Basem; Maaliki, Carine; Jacquemin, Johan; Huang, Feihe; Khashab, Niveen M. Selective adsorptive separation of cyclohexane over benzene using thienothiophene cages Chemical Science, 2021, 12, 5315-5318 |
1560720 | CIF | C42 H48 N8 S6 | P c a 21 | 14.1011; 14.1412; 41.847 90; 90; 90 | 8344.6 | Ding, Yanjun; Alimi, Lukman O.; Moosa, Basem; Maaliki, Carine; Jacquemin, Johan; Huang, Feihe; Khashab, Niveen M. Selective adsorptive separation of cyclohexane over benzene using thienothiophene cages Chemical Science, 2021, 12, 5315-5318 |
1560726 | CIF | C6 H14 Cl N2 Na O6 | P 1 2/n 1 | 9.1493; 10.1833; 13.22 90; 108.244; 90 | 1169.8 | Prakash, Prabhat; Ardhra, Shylendran; Fall, Birane; Zdilla, Michael J.; Wunder, Stephanie L.; Venkatnathan, Arun Solvate sponge crystals of (DMF)3NaClO4: reversible pressure/temperature controlled juicing in a melt/press-castable sodium-ion conductor Chemical Science, 2021, 12, 5574-5581 |
1560727 | CIF | C130 H93 Br4 Co F12 N27 Ni4 O12 S4 | P 1 21/c 1 | 31.1965; 18.5947; 28.7563 90; 110.013; 90 | 15673.9 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560728 | CIF | C154 H126 Cl4 F18 N38 Ni5 O18 S6 | C 1 2/c 1 | 31.8614; 20.267; 26.4739 90; 114.773; 90 | 15521.9 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560729 | CIF | C126 H84 Cl4 F18 Mn N24 Ni4 O18 S6 | C 1 2/c 1 | 32.5915; 19.6893; 26.8651 90; 116.807; 90 | 15386.7 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560730 | CIF | C147.5 H124 Br2 F24 Fe0.5 N24 Ni4 O29 S7.5 | C 1 2/c 1 | 31.3026; 20.566; 26.4213 90; 112.812; 90 | 15678.8 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560731 | CIF | C126 H84 Br4 Cu F18 N24 Ni4 O18 S6 | C 1 2/c 1 | 33.6581; 19.3004; 27.7984 90; 119.638; 90 | 15695.6 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560732 | CIF | C132 H88 F24 N26 Ni4 O24 S8 | C 1 2/c 1 | 31.7631; 20.376; 26.2656 90; 114.263; 90 | 15497.7 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560733 | CIF | C151 H120 Cl4 F21 Fe N36 Ni4 O21 S7 | C 1 2/c 1 | 31.6627; 20.3859; 26.5585 90; 114.491; 90 | 15600.4 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560734 | CIF | C138 H105 Cl4 Co F18 N28 Ni4 O19 S6 | P 1 21/n 1 | 20.4016; 29.7181; 26.8106 90; 91.1568; 90 | 16251.9 | Scott, Aaron J.; Vallejo, Julia; Sarkar, Arup; Smythe, Lucy; Regincós Martí, E.; Nichol, Gary S.; Klooster, Wim T.; Coles, Simon J.; Murrie, Mark; Rajaraman, Gopalan; Piligkos, Stergios; Lusby, Paul J.; Brechin, Euan K. Exploiting host‒guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages Chemical Science, 2021, 12, 5134-5142 |
1560749 | CIF | C68 H65 Dy O P4 S4 | P -1 | 11.2686; 12.7447; 21.7296 89.265; 88.319; 83.122 | 3096.8 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560750 | CIF | C54 H49 O P4 S4 Y | P 1 21/n 1 | 10.8536; 22.5853; 21.0093 90; 99.013; 90 | 5086.5 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560751 | CIF | C116 H120 Dy2 K2 O8 P8 S8 | P -1 | 13.521; 20.9074; 22.2017 71.645; 79.408; 84.373 | 5849.94 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560752 | CIF | C76 H92 K N2 O8 P4 S4 Y | P -1 | 11.9072; 12.5346; 26.216 81.43; 83.556; 84.318 | 3831.2 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560753 | CIF | C116 H120 K2 O8 P8 S8 Y2 | P -1 | 13.4728; 20.8633; 22.1735 71.523; 79.315; 84.386 | 5803.8 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560754 | CIF | C93 H116 Dy K N4 O7 P4 Si4 | P 1 21/n 1 | 13.23949; 23.5137; 30.0645 90; 97.5329; 90 | 9278.6 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560755 | CIF | C62 H70 Dy Na O6 P4 S4 | P 1 21/c 1 | 14.1523; 30.8391; 15.6028 90; 110.56; 90 | 6376 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560756 | CIF | C62 H70 Gd Na O6 P4 S4 | P 1 21/c 1 | 14.1998; 30.9404; 15.6211 90; 110.508; 90 | 6428.1 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560757 | CIF | C72 H84 Dy K N2 O7 P4 S4 | P -1 | 15.0677; 15.8625; 17.3285 97.435; 91.979; 116.19 | 3665.66 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560758 | CIF | C62 H70 Na O6 P4 S4 Y | P 1 21/c 1 | 14.155; 30.9664; 15.632 90; 110.731; 90 | 6408.3 | Thomas-Hargreaves, Lewis R.; Giansiracusa, Marcus J.; Gregson, Matthew; Zanda, Emanuele; O'Donnell, Felix; Wooles, Ashley J.; Chilton, Nicholas F.; Liddle, Stephen T. Correlating axial and equatorial ligand field effects to the single-molecule magnet performances of a family of dysprosium bis-methanediide complexes Chemical Science, 2021, 12, 3911-3920 |
1560759 | CIF | C26 H24 F6 N2 O6 Pd2 | P 1 21/n 1 | 17.9432; 15.8649; 21.6563 90; 114.273; 90 | 5619.8 | Tóth, Balázs L.; Monory, Anna; Egyed, Orsolya; Domján, Attila; Bényei, Attila; Szathury, Bálint; Novák, Zoltán; Stirling, András The ortho effect in directed C‒H activation Chemical Science, 2021, 12, 5152-5163 |
1560760 | CIF | C35 H30 F6 N2 O7 Pd2 | F d d 2 | 37.712; 13.024; 15.254 90; 90; 90 | 7492 | Tóth, Balázs L.; Monory, Anna; Egyed, Orsolya; Domján, Attila; Bényei, Attila; Szathury, Bálint; Novák, Zoltán; Stirling, András The ortho effect in directed C‒H activation Chemical Science, 2021, 12, 5152-5163 |
1560761 | CIF | C33 H26 F6 N2 O7 Pd2 | P 1 21/c 1 | 19.2535; 8.0799; 21.9245 90; 93.765; 90 | 3403.4 | Tóth, Balázs L.; Monory, Anna; Egyed, Orsolya; Domján, Attila; Bényei, Attila; Szathury, Bálint; Novák, Zoltán; Stirling, András The ortho effect in directed C‒H activation Chemical Science, 2021, 12, 5152-5163 |
1560762 | CIF | C34 H26 F6 N2 O8 Pd2 | C 1 2/c 1 | 32.598; 12.5843; 22.685 90; 128.447; 90 | 7288.2 | Tóth, Balázs L.; Monory, Anna; Egyed, Orsolya; Domján, Attila; Bényei, Attila; Szathury, Bálint; Novák, Zoltán; Stirling, András The ortho effect in directed C‒H activation Chemical Science, 2021, 12, 5152-5163 |
1560763 | CIF | C37 H34 F6 N2 O7 Pd2 | F d d 2 | 37.337; 13.419; 15.197 90; 90; 90 | 7614 | Tóth, Balázs L.; Monory, Anna; Egyed, Orsolya; Domján, Attila; Bényei, Attila; Szathury, Bálint; Novák, Zoltán; Stirling, András The ortho effect in directed C‒H activation Chemical Science, 2021, 12, 5152-5163 |
1560764 | CIF | C17 H14 F3 N O4 Pd | C 1 2/c 1 | 20.9754; 13.1973; 15.3039 90; 125.008; 90 | 3469.9 | Tóth, Balázs L.; Monory, Anna; Egyed, Orsolya; Domján, Attila; Bényei, Attila; Szathury, Bálint; Novák, Zoltán; Stirling, András The ortho effect in directed C‒H activation Chemical Science, 2021, 12, 5152-5163 |
1560765 | CIF | C42 H26 N2 | P 1 21/c 1 | 13.9636; 12.6503; 17.3356 90; 103.979; 90 | 2971.5 | Dhbaibi, Kais; Abella, Laura; Meunier-Della-Gatta, Sylvia; Roisnel, Thierry; Vanthuyne, Nicolas; Jamoussi, Bassem; Pieters, Grégory; Racine, Benoît; Quesnel, Etienne; Autschbach, Jochen; Crassous, Jeanne; Favereau, Ludovic Achieving high circularly polarized luminescence with push‒pull helicenic systems: from rationalized design to top-emission CP-OLED applications Chemical Science, 2021, 12, 5522-5533 |
1560766 | CIF | C42 H22 N2 O4 | C 1 2/c 1 | 18.9074; 9.4843; 18.9118 90; 97.294; 90 | 3363.9 | Dhbaibi, Kais; Abella, Laura; Meunier-Della-Gatta, Sylvia; Roisnel, Thierry; Vanthuyne, Nicolas; Jamoussi, Bassem; Pieters, Grégory; Racine, Benoît; Quesnel, Etienne; Autschbach, Jochen; Crassous, Jeanne; Favereau, Ludovic Achieving high circularly polarized luminescence with push‒pull helicenic systems: from rationalized design to top-emission CP-OLED applications Chemical Science, 2021, 12, 5522-5533 |
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