Crystallography Open Database

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1559358 CIFC55 H40 Cl2 O2P 1 21/c 114.5132; 21.9543; 12.9943
90; 94.23; 90
4129.1Mamada, 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 CIFC65 H58 Cl2 Si2P -111.6467; 13.896; 16.8565
92.613; 102.408; 104.007
2571.41Mamada, 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 CIFC32 H24 B F4 NP 1 21/c 112.586; 15.1416; 13.4977
90; 97.253; 90
2551.7Li, 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 CIFC33 H22 B Cl6 F4 NP 1 21/c 111.07767; 21.641; 13.7711
90; 101.839; 90
3231.15Li, 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 CIFC31 H22 F6 N PP -18.5484; 11.4387; 13.608
103.553; 90.551; 98.266
1278.84Li, 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 CIFC31 H22 B F4 NP -18.4537; 11.0248; 13.8145
108.087; 95.552; 99.64
1191.32Li, 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 CIFC32 H22 B F4 NP b c a15.62776; 16.52398; 18.67576
90; 90; 90
4822.69Li, 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 CIFC41 H50 Au B N2P -110.5714; 18.1828; 20.589
72.838; 89.216; 74.717
3638.8Suzuki, 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 CIFC60 H70 Au B N4P -111.951; 12.9306; 18.7852
96.941; 104.913; 104.703
2658.95Suzuki, 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 CIFC48 H60 Au B N4C 1 c 114.021; 17.7771; 17.7051
90; 97.0981; 90
4379.22Suzuki, 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 CIFC50 H59 Au B N3P -112.3065; 17.99; 20.3257
83.34; 79.742; 83.084
4375.21Suzuki, 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 CIFC59 H68 Au B N4P -111.5634; 12.8016; 18.2287
86.266; 72.324; 83.521
2553.22Suzuki, 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 CIFC102 H122 Au2 B2 Cl2 F2 N4 O2P 1 21/n 110.7485; 22.6769; 19.5737
90; 104.387; 90
4621.34Suzuki, 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 CIFC54 H72 Au B N4C 1 2/c 112.3058; 26.0004; 16.284
90; 100.267; 90
5126.7Suzuki, 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 CIFC46 H55 Au B N3P -110.7603; 11.6039; 19.3138
72.527; 85.454; 66.378
2105.21Suzuki, 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 CIFC54 H62 Au B N2 OP -111.8822; 12.58; 17.5818
99.538; 106.748; 103.924
2363.27Suzuki, 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 CIFC63 H78 Au B N4 OP 1 21/n 113.6039; 23.0648; 18.7378
90; 105.489; 90
5665.85Suzuki, 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 CIFC54 H60 Au B N2 OP b c a18.4407; 23.6412; 21.238
90; 90; 90
9258.9Suzuki, 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 CIFC22 H13 Au2 Fe N7 O2P 1 2/n 110.4618; 11.5106; 10.467
90; 95.605; 90
1254.43Piñeiro-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 CIFC16 H8 Au2 Fe N6C 1 2/m 112.0682; 16.9687; 11.4632
90; 94.888; 90
2338.92Piñeiro-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 CIFC22 H13 Au2 Fe N7 O2P 1 2/n 110.2342; 11.269; 10.2384
90; 92.665; 90
1179.51Piñeiro-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 CIFC22 H13 Au2 Fe N7 O2P 1 2/n 110.1143; 11.1281; 10.1146
90; 91.745; 90
1137.9Piñeiro-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 CIFC22 H13 Au2 Fe N7 O2P 1 2/n 110.3534; 11.3911; 10.3639
90; 93.954; 90
1219.37Piñeiro-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 CIFC22 H13 Au2 Fe N7 O2I 1 2/a 114.1982; 22.6765; 14.9567
90; 90.0258; 90
4815.54Piñeiro-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 CIFC22 H13 Au2 Fe N7 O2P 1 2/n 110.115; 11.1318; 10.1239
90; 91.852; 90
1139.34Piñeiro-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 CIFC22 H13 Au2 Fe N7 O2P 1 2/n 110.4523; 11.4885; 10.5004
90; 93.379; 90
1258.71Piñeiro-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 CIFC54 H126 Ce2 O6 Si6P 1 21/n 112.6609; 23.0055; 12.7568
90; 109.44; 90
3503.8Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559597 CIFC42 H108 Ce2 Cl4 N6 O2 Si12P 1 21/n 110.868; 16.755; 20.149
90; 90.235; 90
3669Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559598 CIFC57 H136 Ce2 N6 O2 Si12P -111.4339; 12.0881; 17.5236
83.3194; 71.7094; 63.9637
2065.6Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559599 CIFC68 H84 Ce2 N8 O9P -111.859; 14.7713; 19.126
79.676; 76.075; 81.398
3179.3Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559600 CIFC84 H142 Ce2 N12 O4P 1 21/n 111.7195; 18.0849; 21.3488
90; 95.3481; 90
4505.1Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559601 CIFC70 H142 Ce2 Cl2 N2 O10 Si6C 1 2/c 118.228; 17.588; 28.531
90; 102.369; 90
8935Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559602 CIFC72 H140 Ce2 O12 Si4P 1 21/n 111.29; 22.03; 17.25
90; 96.25; 90
4265Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559603 CIFC44 H108 Ce2 Cl2 N8 O2 Si12C 1 2/c 124.8116; 21.794; 17.4764
90; 116.659; 90
8445.6Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559604 CIFC100 H196 Ce2 O28 Si4P 1 21/c 120.8578; 24.2951; 11.7354
90; 94.4068; 90
5929.2Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559605 CIFC46 H120 Ce2 N6 O2 Si12C 1 2/c 124.645; 22.211; 17.381
90; 116.237; 90
8534Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559606 CIFC91 H103 Ce3 N18 O5P -112.7863; 18.594; 18.631
102.525; 90.9634; 93.3308
4314.8Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559607 CIFC76 H158 Ce2 Cl4 O12 Si6P 1 21/c 111.2124; 12.5614; 34.289
90; 97.212; 90
4791.2Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559608 CIFC76 H162 Ce2 O10 Si6P -111.655; 12.402; 17.499
92.596; 93.946; 114.855
2282Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559609 CIFC97.07 H204.13 Ce2 O30 Si6P -113.7919; 14.0585; 20.0654
71.904; 81.904; 60.636
3222.7Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559610 CIFC66 H132 Ce2 Co2 D8 N6 O3 Si12P 1 2/n 111.7272; 20.2947; 21.6422
90; 99.99; 90
5072.7Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559611 CIFC90 H186 Ce2 Cl4 O29 Si6P n n a22.1584; 41.418; 13.425
90; 90; 90
12320.9Bayer, Uwe; Werner, Daniel; Berkefeld, Andreas; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Cerium-quinone redox couples put under scrutiny.
Chemical science, 2020, 12, 1343-1351
1559612 CIFC62 H84 N2 O4P -19.8347; 12.6226; 12.8064
118.576; 101.423; 94.672
1339.49Rausch, 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 CIFC60 H86 N2 O8P 1 21/n 115.3311; 23.844; 15.4674
90; 95.515; 90
5628Rausch, 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 CIFC19 H22 N2 O3 SP 1 21/c 117.0085; 9.896; 10.5439
90; 92.8684; 90
1772.5Liang, 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 CIFBi K3 S3P 21 39.44906; 9.44906; 9.44906
90; 90; 90
843.657McClain, 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 CIFBi K S2R -3 m :H4.128802; 4.128802; 22.09041
90; 90; 120
326.124McClain, 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 CIFBi K Se2R -3 m :H4.264423; 4.264423; 23.02901
90; 90; 120
362.682McClain, 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 CIFC14 H11 N O2 SP 1 21/c 14.7962; 16.1392; 15.9437
90; 90; 90
1234.15Chen, 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 CIFC31 H30 N4 O5 SP 1 21/n 110.14023; 15.89219; 18.23835
90; 105.522; 90
2831.92Guarnieri-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

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