Crystallography Open Database
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Searching journal of publication like 'Chemical science' volume of publication is 11
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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1552456 | CIF | C31 H23 F3 N2 O5 | P 21 21 21 | 8.97942; 10.9358; 27.051 90; 90; 90 | 2656.33 | Shu, Chang; Liu, Honglei; Slawin, Alexandra M. Z.; Carpenter-Warren, Cameron; Smith, Andrew D. Isothiourea-catalysed enantioselective Michael addition of N-heterocyclic pronucleophiles to α,β-unsaturated aryl esters Chemical Science, 2020, 11, 241-247 |
1552457 | CIF | C28 H26 F3 N3 O2 | P 1 21/c 1 | 19.7387; 13.4237; 9.3356 90; 93.107; 90 | 2469.98 | Shu, Chang; Liu, Honglei; Slawin, Alexandra M. Z.; Carpenter-Warren, Cameron; Smith, Andrew D. Isothiourea-catalysed enantioselective Michael addition of N-heterocyclic pronucleophiles to α,β-unsaturated aryl esters Chemical Science, 2020, 11, 241-247 |
1552458 | CIF | C28 H26 F3 N3 O2 | P 1 21 1 | 13.5575; 23.9425; 19.8418 90; 93.584; 90 | 6428.06 | Shu, Chang; Liu, Honglei; Slawin, Alexandra M. Z.; Carpenter-Warren, Cameron; Smith, Andrew D. Isothiourea-catalysed enantioselective Michael addition of N-heterocyclic pronucleophiles to α,β-unsaturated aryl esters Chemical Science, 2020, 11, 241-247 |
1552504 | CIF | C20 H22 B N | F d d 2 | 39.763; 37.788; 8.9491 90; 90; 90 | 13446.6 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1552505 | CIF | C17 H17 B Cr O3 S | P 1 21/c 1 | 11.605; 9.0305; 15.7985 90; 102.127; 90 | 1618.72 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1552506 | CIF | C28 H27 B O | P -1 | 8.7781; 10.9283; 12.3004 70.809; 87.538; 79.597 | 1095.91 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1552507 | CIF | C27 H27 B O | C 1 c 1 | 13.441; 13.1854; 24.0772 90; 94.762; 90 | 4252.4 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1552508 | CIF | C28 H29 B O | P 1 21/n 1 | 14.454; 7.2349; 21.474 90; 100.708; 90 | 2206.5 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1552533 | CIF | C88 H76 F24 N14 P4 Ru2 | P -1 | 13.885; 17.841; 22.499 83.99; 73.932; 85.868 | 5320.9 | Smitten, Kirsty L.; Fairbanks, Simon D.; Robertson, Craig C.; Bernardino de la Serna, Jorge; Foster, Simon J.; Thomas, Jim A. Ruthenium based antimicrobial theranostics - using nanoscopy to identify therapeutic targets and resistance mechanisms in <i>Staphylococcus aureus</i>. Chemical science, 2020, 11, 70-79 |
1552713 | CIF | C44 H42 F18 N6 P3 S2 | P b a m | 14.8195; 20.8662; 9.5394 90; 90; 90 | 2949.8 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552714 | CIF | C78 H73 F30 N11 P5 | C m c 21 | 19.886; 20.698; 20.515 90; 90; 90 | 8444 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552715 | CIF | C48 H46 F18 N6 P3 | P b a m | 14.1423; 21.9108; 9.5937 90; 90; 90 | 2972.79 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552716 | CIF | C36 H32 F24 N4 P4 | P 1 21/c 1 | 7.4563; 20.125; 13.948 90; 91.831; 90 | 2091.9 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552717 | CIF | C32 H28 F12 N4 P2 S2 | P b a m | 10.3821; 21.5348; 9.6558 90; 90; 90 | 2158.81 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552718 | CIF | C35 H31 F24 N5 P4 | P -1 | 11.2904; 16.9439; 24.966 75.157; 86.061; 86.58 | 4601.4 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552719 | CIF | C34 H30 F12 N4 P2 S | P b a m | 10.266; 21.7433; 9.8244 90; 90; 90 | 2193 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552720 | CIF | C44 H42 F18 N6 P3 S | P b a m | 14.8597; 21.003; 9.5902 90; 90; 90 | 2993.1 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552721 | CIF | C18 H16.5 F12 N2.5 P2 S0.5 | P -1 | 13.603; 13.8062; 16.0216 101.314; 111.832; 107.987 | 2486.3 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552722 | CIF | C47 H45 F18 N7 P3 | P b a m | 14.1183; 21.8905; 9.5412 90; 90; 90 | 2948.8 | Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes. Chemical science, 2020, 11, 107-112 |
1552754 | CIF | Al B3 Cs F O6 | P n a 21 | 8.064; 11.97; 7.036 90; 90; 90 | 679.2 | Liu, Hongkun; Wang, Ying; Zhang, Bingbing; Yang, Zhihua; Pan, Shilie CsAlB3O6F: a beryllium-free deep-ultraviolet nonlinear optical material with enhanced thermal stability Chemical Science, 2020, 11, 694-698 |
1552766 | CIF | C28 H22 N3 P | R 3 :H | 34.841; 34.841; 5.566 90; 90; 120 | 5851.3 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552767 | CIF | C19 H17 N3 O P | P 21 21 21 | 9.0625; 10.9721; 18.2236 90; 90; 90 | 1812.1 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552768 | CIF | C19 H23 O3 P | P 1 21 1 | 8.3114; 10.1411; 10.8128 90; 107.963; 90 | 866.95 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552769 | CIF | C24 H32 N O2 P S | P 1 21 1 | 6.0745; 19.8094; 9.9683 90; 98.06; 90 | 1187.66 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552770 | CIF | C16 H18 Au Cl3 P | P -1 | 8.6866; 10.7017; 11.1556 72.428; 86.595; 70.591 | 931.5 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552771 | CIF | C36 H33 Cl N3 O3 P | P 1 21 1 | 14.421; 7.7894; 16.028 90; 114.539; 90 | 1637.8 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552772 | CIF | C15 H13 O P | P 21 21 21 | 7.6851; 12.5057; 13.9472 90; 90; 90 | 1340.43 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1552854 | CIF | C18 H7 F9 | P -1 | 7.427; 7.782; 13.74 89.382; 89.146; 68.679 | 739.7 | Xie, Qiqiang; Zhu, Ziyue; Li, Lingchun; Ni, Chuanfa; Hu, Jinbo Controllable double CF2-insertion into sp2 C‒Cu bond using TMSCF3: a facile access to tetrafluoroethylene-bridged structures Chemical Science, 2020, 11, 276-280 |
1552855 | CIF | C24 H32 N2 O3 S Si | I 1 2/a 1 | 14.4384; 16.0496; 20.713 90; 96.573; 90 | 4768.29 | Rej, Supriya; Chatani, Naoto Rh(ii)-catalyzed branch-selective C-H alkylation of aryl sulfonamides with vinylsilanes. Chemical science, 2020, 11, 389-395 |
1552856 | CIF | C38 H36 N4 O12 Rh2 S2 | I 1 2/a 1 | 17.4067; 10.6112; 22.164 90; 98.333; 90 | 4050.6 | Rej, Supriya; Chatani, Naoto Rh(ii)-catalyzed branch-selective C-H alkylation of aryl sulfonamides with vinylsilanes. Chemical science, 2020, 11, 389-395 |
1552876 | CIF | C39 H45 Au N4 O4 S | P -1 | 10.7063; 13.5187; 13.5554 71.713; 76.289; 70.466 | 1736.4 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552877 | CIF | C41 H52 Au Cl2 N3 | P b c a | 10.4512; 18.0543; 38.7653 90; 90; 90 | 7314.59 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552878 | CIF | C39 H47 Au N2 S | P 1 21/c 1 | 12.6173; 13.9286; 19.607 90; 108.245; 90 | 3272.5 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552879 | CIF | C45 H51 Au N2 | P 1 21/c 1 | 12.6669; 17.4884; 17.3107 90; 108.451; 90 | 3637.6 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552880 | CIF | C40 H49 Au Cl2 N2 O | P b c a | 10.0502; 17.6546; 39.3833 90; 90; 90 | 6987.9 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552881 | CIF | C79 H96 Au2 Cl2 N4 O4 S2 | P 1 21/c 1 | 21.965; 16.1816; 20.6249 90; 99.929; 90 | 7220.9 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552882 | CIF | C42 H53 Au N2 | P b c n | 34.2921; 13.9716; 17.0268 90; 90; 90 | 8157.8 | Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science, 2020, 11, 435-446 |
1552883 | CIF | C28 H24 O2 | P -1 | 9.5034; 10.6505; 21.889 96.945; 102.069; 99.44 | 2109.4 | Nickerson, Leslie A.; Bergstrom, Benjamin D.; Gao, Mingchun; Shiue, Yuan-Shin; Laconsay, Croix J.; Culberson, Matthew R.; Knauss, Walker A.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Enantioselective synthesis of isochromans and tetrahydroisoquinolines by C-H insertion of donor/donor carbenes. Chemical science, 2020, 11, 494-498 |
1552884 | CIF | C23 H20 O | I 1 2 1 | 17.3724; 5.5677; 18.8919 90; 111.661; 90 | 1698.27 | Nickerson, Leslie A.; Bergstrom, Benjamin D.; Gao, Mingchun; Shiue, Yuan-Shin; Laconsay, Croix J.; Culberson, Matthew R.; Knauss, Walker A.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Enantioselective synthesis of isochromans and tetrahydroisoquinolines by C-H insertion of donor/donor carbenes. Chemical science, 2020, 11, 494-498 |
1552885 | CIF | C18 H17 N O2 | P 21 21 21 | 9.0262; 10.7097; 14.6781 90; 90; 90 | 1418.9 | Nickerson, Leslie A.; Bergstrom, Benjamin D.; Gao, Mingchun; Shiue, Yuan-Shin; Laconsay, Croix J.; Culberson, Matthew R.; Knauss, Walker A.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Enantioselective synthesis of isochromans and tetrahydroisoquinolines by C-H insertion of donor/donor carbenes. Chemical science, 2020, 11, 494-498 |
1552886 | CIF | C23 H19 N O2 | P 21 21 21 | 5.5431; 17.2727; 17.7127 90; 90; 90 | 1695.89 | Nickerson, Leslie A.; Bergstrom, Benjamin D.; Gao, Mingchun; Shiue, Yuan-Shin; Laconsay, Croix J.; Culberson, Matthew R.; Knauss, Walker A.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Enantioselective synthesis of isochromans and tetrahydroisoquinolines by C-H insertion of donor/donor carbenes. Chemical science, 2020, 11, 494-498 |
1552946 | CIF | C23 H31 N O7 Si | P 1 21 1 | 10.936; 9.071; 12.562 90; 94.63; 90 | 1242.1 | Yu, Haiyong; Zong, Yan; Xu, Tao Total synthesis of (−)-penicimutanin a and related congeners Chemical Science, 2020, 11, 656-660 |
1552947 | CIF | C45 H47 N4 O9 | P 1 21 1 | 8.7818; 21.1435; 10.5555 90; 92.327; 90 | 1958.3 | Yu, Haiyong; Zong, Yan; Xu, Tao Total synthesis of (−)-penicimutanin a and related congeners Chemical Science, 2020, 11, 656-660 |
1552948 | CIF | C26 H12 Br2 N2 O6 | P 21 21 21 | 7.355; 12.9923; 24.5807 90; 90; 90 | 2348.9 | Bao, Xiaoze; Rodriguez, Jean; Bonne, Damien Bidirectional enantioselective synthesis of bis-benzofuran atropisomeric oligoarenes featuring two distal C-C stereogenic axes. Chemical science, 2020, 11, 403-408 |
1552949 | CIF | C16.05 H12.45 N O5 | I 1 2 1 | 15.0405; 8.4792; 13.8431 90; 106.602; 90 | 1691.83 | Bao, Xiaoze; Rodriguez, Jean; Bonne, Damien Bidirectional enantioselective synthesis of bis-benzofuran atropisomeric oligoarenes featuring two distal C-C stereogenic axes. Chemical science, 2020, 11, 403-408 |
1552950 | CIF | C66 H50 N2 O4 | P 1 21 1 | 15.2114; 15.0318; 22.042 90; 93.831; 90 | 5028.7 | Dhbaibi, Kais; Favereau, Ludovic; Srebro-Hooper, Monika; Quinton, Cassandre; Vanthuyne, Nicolas; Arrico, Lorenzo; Roisnel, Thierry; Jamoussi, Bassem; Poriel, Cyril; Cabanetos, Clément; Autschbach, Jochen; Crassous, Jeanne Modulation of circularly polarized luminescence through excited-state symmetry breaking and interbranched exciton coupling in helical push-pull organic systems. Chemical science, 2020, 11, 567-576 |
1552951 | CIF | C78 H19 N O S2 | P 1 21/c 1 | 14.2115; 13.2334; 26.4184 90; 116.384; 90 | 4450.9 | Liu, Kai-Qing; Wang, Jun-Jie; Yan, Xing-Xing; Niu, Chuang; Wang, Guan-Wu Regioselective electrosynthesis of tetra- and hexa-functionalized [60]fullerene derivatives with unprecedented addition patterns. Chemical science, 2020, 11, 384-388 |
1556080 | CIF | C35 H38 Cl2 F6 Fe N4 O6 S2 | P 1 21 1 | 11.2529; 12.5689; 14.178 90; 101.369; 90 | 1965.94 | Wei, Jinhu; Cao, Bei; Tse, Chun-Wai; Chang, Xiao-Yong; Zhou, Cong-Ying; Che, Chi-Ming Chiral cis-iron(ii) complexes with metal- and ligand-centered chirality for highly regio- and enantioselective alkylation of N-heteroaromatics Chemical Science, 2020, 11, 684-693 |
1556081 | CIF | C38 H44 Cl4 F6 Fe N4 O6 S2 | P 21 21 21 | 11.265; 16.5488; 23.0009 90; 90; 90 | 4287.9 | Wei, Jinhu; Cao, Bei; Tse, Chun-Wai; Chang, Xiao-Yong; Zhou, Cong-Ying; Che, Chi-Ming Chiral cis-iron(ii) complexes with metal- and ligand-centered chirality for highly regio- and enantioselective alkylation of N-heteroaromatics Chemical Science, 2020, 11, 684-693 |
1556082 | CIF | C24 H26 N3 O | C 1 2 1 | 21.5973; 5.0981; 17.5377 90; 91.771; 90 | 1930.07 | Wei, Jinhu; Cao, Bei; Tse, Chun-Wai; Chang, Xiao-Yong; Zhou, Cong-Ying; Che, Chi-Ming Chiral cis-iron(ii) complexes with metal- and ligand-centered chirality for highly regio- and enantioselective alkylation of N-heteroaromatics Chemical Science, 2020, 11, 684-693 |
1556083 | CIF | C18 H21 N3 O | P 1 21 1 | 8.63; 15.205; 12.2 90; 105.42; 90 | 1543.2 | Wei, Jinhu; Cao, Bei; Tse, Chun-Wai; Chang, Xiao-Yong; Zhou, Cong-Ying; Che, Chi-Ming Chiral cis-iron(ii) complexes with metal- and ligand-centered chirality for highly regio- and enantioselective alkylation of N-heteroaromatics Chemical Science, 2020, 11, 684-693 |
1556084 | CIF | C22 H17 N O6 S | P 21 21 21 | 5.761; 15.9645; 20.7087 90; 90; 90 | 1904.61 | Wang, Yunsheng; Yang, Jie; Tian, Yu; Fang, Manman; Liao, Qiuyan; Wang, Liwei; Hu, Wenping; Tang, Ben Zhong; Li, Zhen Persistent organic room temperature phosphorescence: what is the role of molecular dimers? Chemical Science, 2020, 11, 833-838 |
1556085 | CIF | C22 H17 N O4 S | P n m a | 6.6807; 19.9408; 14.2683 90; 90; 90 | 1900.8 | Wang, Yunsheng; Yang, Jie; Tian, Yu; Fang, Manman; Liao, Qiuyan; Wang, Liwei; Hu, Wenping; Tang, Ben Zhong; Li, Zhen Persistent organic room temperature phosphorescence: what is the role of molecular dimers? Chemical Science, 2020, 11, 833-838 |
1556261 | CIF | C13 H7 F6 N S | P 1 21 1 | 9.5947; 4.8799; 13.6316 90; 94.414; 90 | 636.35 | Zubkov, Mikhail O.; Kosobokov, Mikhail D.; Levin, Vitalij V.; Kokorekin, Vladimir A.; Korlyukov, Alexander A.; Hu, Jinbo; Dilman, Alexander D. A novel photoredox-active group for the generation of fluorinated radicals from difluorostyrenes Chemical Science, 2020, 11, 737-741 |
1556262 | CIF | C24 H14 F4 N2 S | P 1 21/c 1 | 8.6198; 7.7249; 29.3919 90; 91.201; 90 | 1956.69 | Zubkov, Mikhail O.; Kosobokov, Mikhail D.; Levin, Vitalij V.; Kokorekin, Vladimir A.; Korlyukov, Alexander A.; Hu, Jinbo; Dilman, Alexander D. A novel photoredox-active group for the generation of fluorinated radicals from difluorostyrenes Chemical Science, 2020, 11, 737-741 |
1556265 | CIF | C76 H94 Cl6 F6 N6 O10 Pt2 S2 | P -1 | 13.4362; 18.3994; 20.2998 106.666; 108.577; 103.771 | 4246.8 | Leung, Sam Ka-Ming; Chan, Alan Kwun-Wa; Leung, Sammual Yu-Lut; Leung, Ming-Yi; Yam, Vivian Wing-Wah Supramolecular assembly of bent dinuclear amphiphilic alkynylplatinum(ii) terpyridine complexes: diverse nanostructures through subtle tuning of the mode of molecular stacking. Chemical science, 2020, 11, 499-507 |
1556406 | CIF | C54 H54 N18 O12 | P 1 21/c 1 | 16.615; 27.205; 13.426 90; 112.678; 90 | 5600 | Nakashima, Kensuke; Shimizu, Takeshi; Kamakura, Yoshinobu; Hinokimoto, Akira; Kitagawa, Yasutaka; Yoshikawa, Hirofumi; Tanaka, Daisuke A new design strategy for redox-active molecular assemblies with crystalline porous structures for lithium-ion batteries. Chemical science, 2020, 11, 37-43 |
1556409 | CIF | C37 H47 B N3 O P | P 1 21/n 1 | 10.6925; 19.6374; 17.0321 90; 101.118; 90 | 3509.16 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556410 | CIF | C46 H58 B N4 P | P -1 | 10.6744; 13.4621; 14.8146 82.534; 88.654; 84.679 | 2101.57 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556411 | CIF | C31 H45 B N3 P | P 1 21/n 1 | 17.2385; 10.9928; 33.0859 90; 96.506; 90 | 6229.38 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556412 | CIF | C52 H72 B2 N4 P2 | P 1 21/n 1 | 13.0269; 14.1779; 14.8915 90; 112.746; 90 | 2536.47 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556413 | CIF | C36 H47 B N3 P | P 1 21/c 1 | 18.9679; 7.4054; 25.1568 90; 107.29; 90 | 3373.97 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556414 | CIF | C74 H113 B2 N6 O2 P2 | P -1 | 14.0563; 14.7947; 20.1864 73.781; 76.257; 67.558 | 3684.82 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556415 | CIF | C27 H36 B N2 O P | P 1 21/n 1 | 9.3904; 14.2038; 20.3914 90; 99.177; 90 | 2684.98 | Wilson, Daniel W. N.; Franco, Mauricio P.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Base induced isomerisation of a phosphaethynolato-borane: mechanistic insights into boryl migration and decarbonylation to afford a triplet phosphinidene Chemical Science, 2020, 11, 862-869 |
1556534 | CIF | C34.5 H29 Cl F6 N P | P 1 21/n 1 | 11.2525; 9.2194; 59.1397 90; 93.8053; 90 | 6121.7 | Khorloo, Michidmaa; Cheng, Yanhua; Zhang, Haoke; Chen, Ming; Sung, Herman H. Y.; Williams, Ian D.; Lam, Jacky W. Y.; Tang, Ben Zhong Polymorph selectivity of an AIE luminogen under nano-confinement to visualize polymer microstructures Chemical Science, 2020, 11, 997-1005 |
1556535 | CIF | C34 H28 F6 N P | P 1 21/c 1 | 24.8939; 9.1783; 12.5794 90; 98.168; 90 | 2845.03 | Khorloo, Michidmaa; Cheng, Yanhua; Zhang, Haoke; Chen, Ming; Sung, Herman H. Y.; Williams, Ian D.; Lam, Jacky W. Y.; Tang, Ben Zhong Polymorph selectivity of an AIE luminogen under nano-confinement to visualize polymer microstructures Chemical Science, 2020, 11, 997-1005 |
1556536 | CIF | C15 H13 N2 O5 Re | P 21 21 21 | 6.345; 14.5492; 16.7909 90; 90; 90 | 1550.05 | Morrison, Christine N.; Prosser, Kathleen E.; Stokes, Ryjul W.; Cordes, Anna; Metzler-Nolte, Nils; Cohen, Seth M. Expanding medicinal chemistry into 3D space: metallofragments as 3D scaffolds for fragment-based drug discovery Chemical Science, 2020, 11, 1216-1225 |
1556537 | CIF | C13 H9 N2 O5 Re | P 1 21/c 1 | 9.1929; 13.3161; 11.3352 90; 106.8; 90 | 1328.36 | Morrison, Christine N.; Prosser, Kathleen E.; Stokes, Ryjul W.; Cordes, Anna; Metzler-Nolte, Nils; Cohen, Seth M. Expanding medicinal chemistry into 3D space: metallofragments as 3D scaffolds for fragment-based drug discovery Chemical Science, 2020, 11, 1216-1225 |
1556538 | CIF | C15 H12 N O4 Re S | P 1 21/n 1 | 8.5304; 8.156; 22.7941 90; 96.365; 90 | 1576.1 | Morrison, Christine N.; Prosser, Kathleen E.; Stokes, Ryjul W.; Cordes, Anna; Metzler-Nolte, Nils; Cohen, Seth M. Expanding medicinal chemistry into 3D space: metallofragments as 3D scaffolds for fragment-based drug discovery Chemical Science, 2020, 11, 1216-1225 |
1556539 | CIF | C20.5 H15 Cl N O5 Re | P 1 21/c 1 | 20.753; 7.0352; 13.7941 90; 105.388; 90 | 1941.8 | Morrison, Christine N.; Prosser, Kathleen E.; Stokes, Ryjul W.; Cordes, Anna; Metzler-Nolte, Nils; Cohen, Seth M. Expanding medicinal chemistry into 3D space: metallofragments as 3D scaffolds for fragment-based drug discovery Chemical Science, 2020, 11, 1216-1225 |
1556540 | CIF | C13 H11 N2 O6 Re | P -1 | 9.108; 9.5099; 9.7673 70.669; 80.012; 61.781 | 703.28 | Morrison, Christine N.; Prosser, Kathleen E.; Stokes, Ryjul W.; Cordes, Anna; Metzler-Nolte, Nils; Cohen, Seth M. Expanding medicinal chemistry into 3D space: metallofragments as 3D scaffolds for fragment-based drug discovery Chemical Science, 2020, 11, 1216-1225 |
1556629 | CIF | C15 H13 F | P 1 21/n 1 | 13.5004; 5.6062; 15.1666 90; 104.738; 90 | 1110.13 | Fu, Wai Chung; Kwong, Fuk Yee A denitrogenative palladium-catalyzed cascade for regioselective synthesis of fluorenes Chemical Science, 2020, 11, 1411-1417 |
1556630 | CIF | C40 H50 Br N5 O5 | P 1 21/c 1 | 11.9227; 17.3502; 17.7857 90; 90.611; 90 | 3678.96 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556631 | CIF | C29 H27 Cl N2 O | P 1 21/c 1 | 10.8554; 18.2505; 12.2873 90; 105.01; 90 | 2351.26 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556632 | CIF | C46 H42 Br N3 O | P 1 21/n 1 | 10.2078; 19.152; 18.9514 90; 94.804; 90 | 3691.98 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556633 | CIF | C28 H29 N3 O | P 1 21/c 1 | 9.0448; 14.0503; 18.8685 90; 102.053; 90 | 2344.99 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556634 | CIF | C31 H31 Br N2 O | P 1 21/n 1 | 14.485; 10.8239; 16.4134 90; 90.869; 90 | 2573.07 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556635 | CIF | C39 H39 N5 O5 | P 1 21/c 1 | 11.80408; 18.74504; 31.2581 90; 79.1361; 90 | 6792.46 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556636 | CIF | C45 H39 Cl2 N3 O | P 1 21/n 1 | 13.58053; 20.7753; 29.2921 90; 102.897; 90 | 8055.96 | Miao, Hong-Jie; Wang, Le-Le; Han, Hua-Bin; Zhao, Yong-De; Wang, Qi-Lin; Bu, Zhan-Wei Regio- and diastereoselective dearomatizations of N-alkyl activated azaarenes: the maximization of the reactive sites Chemical Science, 2020, 11, 1418-1424 |
1556642 | CIF | C50 H67 B2 P3 | P -1 | 10.6022; 10.6218; 20.1023 94.418; 99.288; 100.371 | 2184.47 | Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science, 2020, 11, 1335-1341 |
1556643 | CIF | C34 H48 B2 Br P3 | P b c a | 10.5062; 17.5469; 36.649 90; 90; 90 | 6756.3 | Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science, 2020, 11, 1335-1341 |
1556644 | CIF | C34 H48 B2 Br P3 | P 1 21/n 1 | 11.8091; 16.5734; 17.4767 90; 107.828; 90 | 3256.2 | Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science, 2020, 11, 1335-1341 |
1556645 | CIF | C40 H55 B2 Br N2 P2 | F d d 2 | 28.3736; 57.198; 10.0055 90; 90; 90 | 16238.1 | Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science, 2020, 11, 1335-1341 |
1556646 | CIF | C58 H71 B2 N4 P | P -1 | 11.3635; 13.09; 19.2394 89.968; 76.353; 70.181 | 2606.41 | Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science, 2020, 11, 1335-1341 |
1556647 | CIF | C26 H18 B F10 N | P 1 21/c 1 | 16.8585; 9.6751; 15.4623 90; 111.832; 90 | 2341.14 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556648 | CIF | C44 H30 B F10 P | P -1 | 8.3209; 11.319; 19.7803 99.399; 98.04; 104.051 | 1751.34 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556649 | CIF | C27 H20 B F10 N | P 21 21 21 | 9.724; 14.9525; 16.4897 90; 90; 90 | 2397.57 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556650 | CIF | C46 H38 B Cl2 F10 P | P 1 21/c 1 | 11.605; 20.1373; 17.8823 90; 102.818; 90 | 4074.83 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556651 | CIF | C46 H38 B Cl2 F10 P | P -1 | 11.1982; 11.5411; 16.5533 96.789; 96.943; 106.576 | 2009 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556652 | CIF | C39 H28 B F10 P | P 1 21/c 1 | 12.2953; 14.3056; 20.8746 90; 100.3; 90 | 3612.5 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556653 | CIF | C27 H21 B F10 | P 1 21/c 1 | 6.4255; 17.461; 21.2763 90; 95.037; 90 | 2377.9 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556654 | CIF | C40 H30 B F10 P | P -1 | 12.4783; 15.7635; 20.7617 102.312; 93.184; 112.263 | 3650.3 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556655 | CIF | C43 H24 B2 F20 N2 | P -1 | 9.0564; 10.3497; 21.915 91.873; 96.63; 96.996 | 2022.9 | Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science, 2020, 11, 1542-1548 |
1556673 | CIF | C36 H23 Cu2 F14 N8 O8 P S4 | P 1 21/c 1 | 19.7106; 9.9489; 22.7748 90; 99.808; 90 | 4400.83 | Nicolay, Amélie; Ziegler, Micah S.; Small, David W.; Grünbauer, Rebecca; Scheer, Manfred; Tilley, T. Don Isomerism and dynamic behavior of bridging phosphaalkynes bound to a dicopper complex. Chemical science, 2020, 11, 1607-1616 |
1556674 | CIF | C42 H34 Cu2 F14 N8 O9 S4 | P -1 | 12.5211; 14.8116; 15.6245 76.518; 67.701; 76.651 | 2574.23 | Nicolay, Amélie; Ziegler, Micah S.; Small, David W.; Grünbauer, Rebecca; Scheer, Manfred; Tilley, T. Don Isomerism and dynamic behavior of bridging phosphaalkynes bound to a dicopper complex. Chemical science, 2020, 11, 1607-1616 |
1556675 | CIF | C43 H39 Cu2 F14 N8 O9 P S4 | P -1 | 12.4499; 12.637; 18.5946 89.354; 84.84; 72.243 | 2774.4 | Nicolay, Amélie; Ziegler, Micah S.; Small, David W.; Grünbauer, Rebecca; Scheer, Manfred; Tilley, T. Don Isomerism and dynamic behavior of bridging phosphaalkynes bound to a dicopper complex. Chemical science, 2020, 11, 1607-1616 |
1556676 | CIF | C45 H35 Cu2 F14 N9 O8 S4 | P 21 21 21 | 10.918; 20.4455; 23.1939 90; 90; 90 | 5177.4 | Nicolay, Amélie; Ziegler, Micah S.; Small, David W.; Grünbauer, Rebecca; Scheer, Manfred; Tilley, T. Don Isomerism and dynamic behavior of bridging phosphaalkynes bound to a dicopper complex. Chemical science, 2020, 11, 1607-1616 |
1556677 | CIF | C45 H35 Cu2 F14 N8 O8 P S4 | P 1 21/n 1 | 18.6915; 16.5896; 18.8035 90; 96.346; 90 | 5794.9 | Nicolay, Amélie; Ziegler, Micah S.; Small, David W.; Grünbauer, Rebecca; Scheer, Manfred; Tilley, T. Don Isomerism and dynamic behavior of bridging phosphaalkynes bound to a dicopper complex. Chemical science, 2020, 11, 1607-1616 |
1556703 | CIF | C65.25 N4 O8 S2 | P -1 | 22.2613; 26.916; 28.2117 83.387; 73.393; 69.33 | 15154.3 | Su, Feng; Chen, Shuqi; Mo, Xiaogang; Wu, Kongchuan; Wu, Jiajun; Lin, Weidong; Lin, Zhiwei; Lin, Jianbin; Zhang, Hui-Jun; Wen, Ting-Bin Trisulfur radical anion-triggered stitching thienannulation: rapid access to largely π-extended thienoacenes Chemical Science, 2020, 11, 1503-1509 |
1556704 | CIF | C37 N4 O8 S3 | P 1 21 1 | 22.0328; 21.2168; 33.589 90; 102.198; 90 | 15347.2 | Su, Feng; Chen, Shuqi; Mo, Xiaogang; Wu, Kongchuan; Wu, Jiajun; Lin, Weidong; Lin, Zhiwei; Lin, Jianbin; Zhang, Hui-Jun; Wen, Ting-Bin Trisulfur radical anion-triggered stitching thienannulation: rapid access to largely π-extended thienoacenes Chemical Science, 2020, 11, 1503-1509 |
1556719 | CIF | C21 H19 N O S | P -1 | 7.2702; 8.7819; 13.6782 98.564; 100.026; 104.633 | 814.84 | Ho, Hon Eong; Pagano, Angela; Rossi-Ashton, James A.; Donald, James R.; Epton, Ryan G.; Churchill, Jonathan C.; James, Michael J.; O'Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Visible-light-induced intramolecular charge transfer in the radical spirocyclisation of indole-tethered ynones Chemical Science, 2020, 11, 1353-1360 |
1556720 | CIF | C18 H13 N O | P 1 21/c 1 | 11.42288; 8.41061; 28.0872 90; 100.454; 90 | 2653.64 | Ho, Hon Eong; Pagano, Angela; Rossi-Ashton, James A.; Donald, James R.; Epton, Ryan G.; Churchill, Jonathan C.; James, Michael J.; O'Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Visible-light-induced intramolecular charge transfer in the radical spirocyclisation of indole-tethered ynones Chemical Science, 2020, 11, 1353-1360 |
1556721 | CIF | C24 H19 N O S | P 21 21 21 | 5.81156; 17.547; 18.1227 90; 90; 90 | 1848.07 | Ho, Hon Eong; Pagano, Angela; Rossi-Ashton, James A.; Donald, James R.; Epton, Ryan G.; Churchill, Jonathan C.; James, Michael J.; O'Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Visible-light-induced intramolecular charge transfer in the radical spirocyclisation of indole-tethered ynones Chemical Science, 2020, 11, 1353-1360 |
1556722 | CIF | C19 H15 N O | P 21 21 21 | 7.4225; 9.90594; 19.5109 90; 90; 90 | 1434.57 | Ho, Hon Eong; Pagano, Angela; Rossi-Ashton, James A.; Donald, James R.; Epton, Ryan G.; Churchill, Jonathan C.; James, Michael J.; O'Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Visible-light-induced intramolecular charge transfer in the radical spirocyclisation of indole-tethered ynones Chemical Science, 2020, 11, 1353-1360 |
1556723 | CIF | C25 H21 N O S | P -1 | 8.7543; 9.971; 11.6327 81.846; 74.281; 81.076 | 960.27 | Ho, Hon Eong; Pagano, Angela; Rossi-Ashton, James A.; Donald, James R.; Epton, Ryan G.; Churchill, Jonathan C.; James, Michael J.; O'Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Visible-light-induced intramolecular charge transfer in the radical spirocyclisation of indole-tethered ynones Chemical Science, 2020, 11, 1353-1360 |
1556844 | CIF | C45 H57 B N2 O2 | P -1 | 9.6381; 11.485; 19.0369 85.238; 75.946; 75.838 | 1981.44 | Bhunia, Mrinal; Sahoo, Sumeet Ranjan; Das, Arpan; Ahmed, Jasimuddin; P., Sreejyothi; Mandal, Swadhin K. Transition metal-free catalytic reduction of primary amides using an abnormal NHC based potassium complex: integrating nucleophilicity with Lewis acidic activation Chemical Science, 2020, 11, 1848-1854 |
1556845 | CIF | C244 H327 Ag31 Cl5 F24 O2 P6 Pt S16 Sb4 | P -1 | 21.515; 24.1156; 35.321 81.037; 78.006; 68.595 | 16625 | Kang, Xi; Jin, Shan; Xiong, Lin; Wei, Xiao; Zhou, Manman; Qin, Chenwanli; Pei, Yong; Wang, Shuxin; Zhu, Manzhou Nanocluster growth <i>via</i> "graft-onto": effects on geometric structures and optical properties. Chemical science, 2020, 11, 1691-1697 |
1556846 | CIF | C11 H13 F9 O2 | P 21 21 21 | 5.6044; 9.5819; 26.472 90; 90; 90 | 1421.57 | Sperandio, Céline; Rodriguez, Jean; Quintard, Adrien Development of copper-catalyzed enantioselective decarboxylative aldolization for the preparation of perfluorinated 1,3,5-triols featuring supramolecular recognition properties. Chemical science, 2020, 11, 1629-1635 |
1556847 | CIF | C7 H10 F6 O3 | P 1 21 1 | 4.9029; 9.8824; 10.7838 90; 100.543; 90 | 513.68 | Sperandio, Céline; Rodriguez, Jean; Quintard, Adrien Development of copper-catalyzed enantioselective decarboxylative aldolization for the preparation of perfluorinated 1,3,5-triols featuring supramolecular recognition properties. Chemical science, 2020, 11, 1629-1635 |
1556860 | CIF | C45 H44 Cl F5 N4 Ni | P 1 21/c 1 | 19.2423; 10.9261; 21.5899 90; 106.046; 90 | 4362.3 | Dong, Yuyang; Lukens, James T.; Clarke, Ryan M.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A. Synthesis, characterization and C‒H amination reactivity of nickel iminyl complexes Chemical Science, 2020, 11, 1260-1268 |
1556861 | CIF | C45 H50 F5 N3 Ni | P 1 21/c 1 | 12.0799; 14.6404; 24.1769 90; 91.408; 90 | 4274.5 | Dong, Yuyang; Lukens, James T.; Clarke, Ryan M.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A. Synthesis, characterization and C‒H amination reactivity of nickel iminyl complexes Chemical Science, 2020, 11, 1260-1268 |
1556862 | CIF | C44 H45 F5 N3 Ni | P -1 | 9.5949; 11.8426; 18.3253 92.953; 104.293; 100.626 | 1972.9 | Dong, Yuyang; Lukens, James T.; Clarke, Ryan M.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A. Synthesis, characterization and C‒H amination reactivity of nickel iminyl complexes Chemical Science, 2020, 11, 1260-1268 |
1556863 | CIF | C45 H49 F5 N3 Ni | P n a 21 | 14.1294; 16.6197; 15.8282 90; 90; 90 | 3716.9 | Dong, Yuyang; Lukens, James T.; Clarke, Ryan M.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A. Synthesis, characterization and C‒H amination reactivity of nickel iminyl complexes Chemical Science, 2020, 11, 1260-1268 |
1556864 | CIF | C40 H39 F5 N3 Ni | P 1 21/c 1 | 17.7017; 15.1269; 13.141 90; 109.571; 90 | 3315.5 | Dong, Yuyang; Lukens, James T.; Clarke, Ryan M.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A. Synthesis, characterization and C‒H amination reactivity of nickel iminyl complexes Chemical Science, 2020, 11, 1260-1268 |
1556865 | CIF | C12 H8 I2 N2 O7 | P n a 21 | 8.2007; 7.7793; 24.6164 90; 90; 90 | 1570.42 | Zhang, Guangtao; Wang, Yuanxun; Xu, Jun; Sun, Jiyun; Sun, Fengxia; Zhang, Yilin; Zhang, Chenglin; Du, Yunfei A new hypervalent iodine(iii/v) oxidant and its application to the synthesis of 2H-azirines Chemical Science, 2020, 11, 947-953 |
1556866 | CIF | C36 H50 B2 | P -1 | 9.035; 12.0924; 14.7514 92.899; 103.022; 103.134 | 1520.32 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1556867 | CIF | C32 H35 B O | P 1 21/c 1 | 10.6036; 17.5824; 17.446 90; 125.621; 90 | 2643.98 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1556868 | CIF | C34 H31 B O | P b c a | 10.0358; 12.1076; 43.226 90; 90; 90 | 5252.4 | Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science, 2020, 11, 126-131 |
1556869 | CIF | C61 H60 Cl2 N4 O2 Ru | P 1 21/c 1 | 11.5545; 17.3432; 25.028 90; 95.757; 90 | 4990.1 | Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity. Chemical science, 2020, 11, 2243-2259 |
1556870 | CIF | C64 H52 F4 N4 Os | P -1 | 11.0536; 11.1353; 11.8926 97.46; 108.927; 107.647 | 1276.53 | Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity. Chemical science, 2020, 11, 2243-2259 |
1556871 | CIF | C59 H27 F20 Fe N5 | P 1 | 10.5317; 14.347; 17.434 76.71; 80.147; 84.826 | 2522.3 | Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity. Chemical science, 2020, 11, 2243-2259 |
1556872 | CIF | C59 H50 Cl3 D Fe N4 | P -1 | 11.3588; 13.5043; 16.5422 85.786; 84.24; 70.986 | 2384.6 | Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity. Chemical science, 2020, 11, 2243-2259 |
1556873 | CIF | C65.5 H39.5 F20 N8 Ru | C 1 2/c 1 | 24.815; 20.891; 24.043 90; 100.174; 90 | 12268 | Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity. Chemical science, 2020, 11, 2243-2259 |
1556874 | CIF | C48 H54 Cu F12 N6 O2 P2 | P 1 21/n 1 | 21.313; 9.951; 24.687 90; 107.778; 90 | 4986 | Ryan, Michael C.; Kim, Yeon Jung; Gerken, James B.; Wang, Fei; Aristov, Michael M.; Martinelli, Joseph R.; Stahl, Shannon S. Mechanistic insights into copper-catalyzed aerobic oxidative coupling of N‒N bonds Chemical Science, 2020, 11, 1170-1175 |
1556875 | CIF | C311.2 H387.9 B90.2 F18 Fe4 N55.5 O36 S6 | C 1 c 1 | 33.357; 32.3478; 45.8124 90; 102.32; 90 | 48294.4 | Lu, Zhenpin; Ronson, Tanya K.; Nitschke, Jonathan R. Reversible reduction drives anion ejection and C60 binding within an FeII4L6 cage Chemical Science, 2020, 11, 1097-1101 |
1556876 | CIF | C26 H42 N2 S8 Sn2 | P -1 | 7.7711; 10.3961; 12.6341 113.062; 96.284; 98.114 | 914.39 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556877 | CIF | C120 H88 B2 F48 Fe2 O2 S8 Sn2 | P 1 21/c 1 | 12.734; 31.568; 18.543 90; 107.358; 90 | 7115 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556878 | CIF | C57 H53.5 B F24 N0.5 O0.5 S8 Sn2 | P 1 21/c 1 | 9.5804; 23.505; 30.294 90; 97.92; 90 | 6756.8 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556879 | CIF | C122 H72 B2 F48 Ni2 P4 S8 | C 1 2/c 1 | 40.752; 18.985; 17.7197 90; 107.903; 90 | 13045.5 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556880 | CIF | C90 H60 B F24 Ni2 P4 S8 | P -1 | 14.1624; 18.3974; 20.189 94.073; 103.397; 106.515 | 4852.9 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556881 | CIF | C102 H92 B2 F48 O4 S8 Sn2 | P -1 | 12.9111; 15.863; 16.368 88.537; 88.979; 69.195 | 3132.6 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556882 | CIF | C106 H68 B F24 Fe2 P4 Pd2 S8 | P -1 | 13.503; 19.054; 28.239 105.082; 91.975; 90.73 | 7009 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556883 | CIF | C540 H360 B6 F144 P24 Pd12 S48 | P -1 | 29.421; 31.324; 35.123 92.011; 91.984; 99.304 | 31897 | Xie, Jiaze; Boyn, Jan-Niklas; Filatov, Alexander S.; McNeece, Andrew J.; Mazziotti, David A.; Anderson, John S. Redox, transmetalation, and stacking properties of tetrathiafulvalene-2,3,6,7-tetrathiolate bridged tin, nickel, and palladium compounds Chemical Science, 2020, 11, 1066-1078 |
1556884 | CIF | C40 H36 F6 N3 O3 P | P 1 21 1 | 8.20579; 29.4208; 16.5731 90; 93.223; 90 | 3994.76 | Duwald, Romain; Bosson, Johann; Pascal, Simon; Grass, Stéphane; Zinna, Francesco; Besnard, Céline; Di Bari, Lorenzo; Jacquemin, Denis; Lacour, Jérôme Merging polyacenes and cationic helicenes: from weak to intense chiroptical properties in the far red region Chemical Science, 2020, 11, 1165-1169 |
1556885 | CIF | C61 H46 F6 N5 O2 P | C 1 2/c 1 | 27.6234; 16.7146; 21.7661 90; 106.545; 90 | 9633.6 | Duwald, Romain; Bosson, Johann; Pascal, Simon; Grass, Stéphane; Zinna, Francesco; Besnard, Céline; Di Bari, Lorenzo; Jacquemin, Denis; Lacour, Jérôme Merging polyacenes and cationic helicenes: from weak to intense chiroptical properties in the far red region Chemical Science, 2020, 11, 1165-1169 |
1556886 | CIF | C95 H78 Cl6 F12 N6 O2 P2 | P 1 21/c 1 | 11.678; 12.9347; 27.785 90; 90.912; 90 | 4196.4 | Duwald, Romain; Bosson, Johann; Pascal, Simon; Grass, Stéphane; Zinna, Francesco; Besnard, Céline; Di Bari, Lorenzo; Jacquemin, Denis; Lacour, Jérôme Merging polyacenes and cationic helicenes: from weak to intense chiroptical properties in the far red region Chemical Science, 2020, 11, 1165-1169 |
1556900 | CIF | C62 H79 Cl2 N5 O6 Pt S | I 1 2/a 1 | 26.7934; 12.4321; 39.1414 90; 106.494; 90 | 12501.4 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556901 | CIF | C67 H79 B2 F8 N7 O6 Pt | P -1 | 10.1982; 18.2063; 19.7708 105.665; 99.693; 96.105 | 3439.2 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556902 | CIF | C65 H76 F6 N6 O6 Pt Sb | P -1 | 11.78747; 15.5279; 22.4447 101.252; 102.144; 103.723 | 3769.49 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556903 | CIF | C66 H77 B F4 N8 O5 Pt | P 1 21/n 1 | 21.738; 14.9289; 21.8888 90; 107.531; 90 | 6773.5 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556904 | CIF | C69 H85 Ag F12 N6 O6 Pt Sb2 | P 1 21/n 1 | 18.7462; 15.4022; 27.6759 90; 104.791; 90 | 7726.1 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556905 | CIF | C60 H72 B F4 N5 O5 Pt | P -1 | 12.2375; 14.6363; 18.2789 81.118; 76.017; 74.098 | 3041.7 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556906 | CIF | C67 H77 Ag F15 N7 O5 Pt Sb2.5 | P -1 | 13.0371; 18.3984; 18.4639 88.81; 89.789; 83.438 | 4398.8 | Zhang, Zhihui; Tizzard, Graham J.; Williams, J. A. Gareth; Goldup, Stephen M. Rotaxane PtII-complexes: mechanical bonding for chemically robust luminophores and stimuli responsive behaviour Chemical Science, 2020, 11, 1839-1847 |
1556907 | CIF | C23 H24 N2 O5 S | P 21 21 2 | 30.4605; 11.6596; 6.1159 90; 90; 90 | 2172.11 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556908 | CIF | C20 H23 N3 O3 | P 21 21 21 | 7.191; 13.5045; 18.6644 90; 90; 90 | 1812.52 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556909 | CIF | C20 H25 N3 O2 | P 1 21/n 1 | 6.8118; 17.5495; 15.1113 90; 91.427; 90 | 1805.9 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556910 | CIF | C22 H21.25 N3 O2.125 | P 1 21 1 | 10.18405; 9.71457; 18.82762 90; 93.0169; 90 | 1860.1 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556911 | CIF | C24 H21 F3 N2 O4 S | P 21 21 21 | 32.8358; 11.60538; 5.85758 90; 90; 90 | 2232.16 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556912 | CIF | C22 H25 N3 O2 | P 1 21 1 | 12.4713; 9.02632; 17.84198 90; 92.8702; 90 | 2005.95 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556913 | CIF | C20 H19 N3 O | P 1 21 1 | 10.10659; 5.94958; 13.62038 90; 99.5974; 90 | 807.53 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556914 | CIF | C28 H30 N2 O2 | P 21 21 21 | 8.33247; 15.71709; 17.93381 90; 90; 90 | 2348.65 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556915 | CIF | C24 H24 N2 O4 S | P 21 21 21 | 6.0985; 11.5023; 30.8387 90; 90; 90 | 2163.2 | Dean, Conor; Rajkumar, Sundaram; Roesner, Stefan; Carson, Nessa; Clarkson, Guy J.; Wills, Martin; Jones, Matthew; Shipman, Michael Readily accessible sp<sup>3</sup>-rich cyclic hydrazine frameworks exploiting nitrogen fluxionality. Chemical science, 2020, 11, 1636-1642 |
1556992 | CIF | C18 H16 O4 | P b c n | 9.7263; 11.8883; 24.935 90; 90; 90 | 2883.2 | Liang, Kangjiang; Li, Tao; Li, Na; Zhang, Yang; Shen, Lei; Ma, Zhixian; Xia, Chengfeng Redox-neutral photochemical Heck-type arylation of vinylphenols activated by visible light Chemical Science, 2020, 11, 2130-2135 |
1556993 | CIF | C26 H24 N2 O2 S | P -1 | 10.6565; 11.1408; 12.3 69.374; 76.912; 65.303 | 1236.26 | Lee, Jiyoun; Ko, Donguk; Park, Hyunju; Yoo, Eun Jeong Direct cyclopropanation of activated N-heteroarenes <i>via</i> site- and stereoselective dearomative reactions. Chemical science, 2020, 11, 1672-1676 |
1556994 | CIF | C28 H26 N2 | P 21 21 21 | 9.072; 9.846; 23.918 90; 90; 90 | 2136.4 | Lee, Jiyoun; Ko, Donguk; Park, Hyunju; Yoo, Eun Jeong Direct cyclopropanation of activated N-heteroarenes <i>via</i> site- and stereoselective dearomative reactions. Chemical science, 2020, 11, 1672-1676 |
1556995 | CIF | C54 H31.2 F0.8 O8 Zn2 | C 1 2/c 1 | 37.1066; 31.0733; 11.8903 90; 99.208; 90 | 13533.1 | Lustig, William P.; Shen, Zeqing; Teat, Simon J.; Javed, Nasir; Velasco, Ever; O'Carroll, Deirdre M.; Li, Jing Rational design of a high-efficiency, multivariate metal‒organic framework phosphor for white LED bulbs Chemical Science, 2020, 11, 1814-1824 |
1557024 | CIF | C38 H34 S4 | C 1 2/c 1 | 41.708; 5.7563; 12.67 90; 98.46; 90 | 3008.8 | Suzuki, Mitsuharu; Terai, Kengo; Quinton, Cassandre; Hayashi, Hironobu; Aratani, Naoki; Yamada, Hiroko Open-circuit-voltage shift of over 0.5 V in organic photovoltaic cells induced by a minor structural difference in alkyl substituents Chemical Science, 2020, 11, 1825-1831 |
1557025 | CIF | C42 H42 S4 | P 1 21/c 1 | 23.82; 5.837; 12.5 90; 104.133; 90 | 1685 | Suzuki, Mitsuharu; Terai, Kengo; Quinton, Cassandre; Hayashi, Hironobu; Aratani, Naoki; Yamada, Hiroko Open-circuit-voltage shift of over 0.5 V in organic photovoltaic cells induced by a minor structural difference in alkyl substituents Chemical Science, 2020, 11, 1825-1831 |
1557026 | CIF | C42 H42 S4 | P 1 21/c 1 | 22.15; 5.7413; 13.1188 90; 95.85; 90 | 1659.6 | Suzuki, Mitsuharu; Terai, Kengo; Quinton, Cassandre; Hayashi, Hironobu; Aratani, Naoki; Yamada, Hiroko Open-circuit-voltage shift of over 0.5 V in organic photovoltaic cells induced by a minor structural difference in alkyl substituents Chemical Science, 2020, 11, 1825-1831 |
1557027 | CIF | C66 H30 Al3 Ba F89 O9 | P 1 c 1 | 28.173; 16.4313; 20.453 90; 90.107; 90 | 9468.1 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557028 | CIF | C52 H26 Al2 Ca F68 O7 | P 1 21 1 | 17.765; 20.654; 20.031 90; 93.018; 90 | 7340 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557029 | CIF | C36 H18 Al2 F55 In O6 | P -1 | 10.6319; 22.3961; 24.4869 79.144; 79.696; 77.759 | 5537.2 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557030 | CIF | C50 H22 Al2 F74 Mg N6 O8 | P 1 | 14.3953; 18.2606; 25.8315 73.784; 74.37; 66.821 | 5895.1 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557031 | CIF | C84 H34 Al4 F118 O12 Sr | P -1 | 13.8661; 20.2883; 23.0336 80.031; 85.985; 79.942 | 6278.6 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557032 | CIF | C84 H34 Al4 Ca F118 O12 | P -1 | 13.9542; 20.3286; 22.9128 80.085; 84.743; 80.239 | 6296.8 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557033 | CIF | C60 H26 Al3 Ca F87 O9 | P 1 21/c 1 | 23.429; 18.9075; 22.4874 90; 118.27; 90 | 8773.4 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557034 | CIF | C66 H30 Al3 F89 O9 Sr | P -1 | 13.5412; 25.3825; 27.3385 90.017; 90.111; 92.474 | 9387.7 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557045 | CIF | C17 H14 Cl N O2 | P 21 21 21 | 5.3182; 10.94; 23.9705 90; 90; 90 | 1394.63 | Burg, Finn; Breitenlechner, Stefan; Jandl, Christian; Bach, Thorsten Enantioselective oxygenation of exocyclic methylene groups by a manganese porphyrin catalyst with a chiral recognition site Chemical Science, 2020, 11, 2121-2129 |
1557052 | CIF | C22 H28 N | P -1 | 5.899; 7.547; 20.535 83.465; 84.681; 82.512 | 897.7 | Mongin, Cédric; Ardoy, Alejandro Mendez; Méreau, Raphaël; Bassani, Dario M.; Bibal, Brigitte Singlet oxygen stimulus for switchable functional organic cages Chemical Science, 2020, 11, 1478-1484 |
1557053 | CIF | C28 H18 O2 | P 1 21/c 1 | 13.0175; 9.329; 8.3512 90; 106.37; 90 | 973.06 | Mongin, Cédric; Ardoy, Alejandro Mendez; Méreau, Raphaël; Bassani, Dario M.; Bibal, Brigitte Singlet oxygen stimulus for switchable functional organic cages Chemical Science, 2020, 11, 1478-1484 |
1557060 | CIF | C18 H19 N S Si | P -1 | 8.52831; 10.39109; 11.21545 117.584; 92.3119; 95.1854 | 873.5 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557061 | CIF | C17 H13 N O S | C 1 2/c 1 | 20.6204; 9.4103; 16.7239 90; 120.205; 90 | 2804.6 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557062 | CIF | C18 H15 N O S | P b c a | 13.1964; 13.3812; 16.7048 90; 90; 90 | 2949.79 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557063 | CIF | C11 H9 N O S | P 1 21/c 1 | 10.9143; 7.26579; 12.4737 90; 104.425; 90 | 957.99 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557064 | CIF | C16 H21 N S Se Si | P 1 21/c 1 | 10.6588; 8.0663; 20.1272 90; 95.886; 90 | 1721.35 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557065 | CIF | C22 H23 N S | P 1 21/c 1 | 13.9373; 7.7203; 17.0136 90; 105.984; 90 | 1759.89 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557066 | CIF | C21 H20 S | P 1 21/n 1 | 7.5133; 25.6215; 8.2645 90; 100.591; 90 | 1563.83 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557067 | CIF | C10 H7 N S | P -1 | 6.9027; 7.3743; 9.3503 68.861; 73.292; 84.246 | 425.18 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557068 | CIF | C16 H11 N O S | P b c a | 12.2557; 9.5626; 21.5616 90; 90; 90 | 2526.94 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557069 | CIF | C17 H17 N S | P 1 21/c 1 | 11.1885; 11.263; 12.1884 90; 116.756; 90 | 1371.48 | Bürger, Marcel; Loch, Maximilian N.; Jones, Peter G.; Werz, Daniel B. From 1,2-difunctionalisation to cyanide-transfer cascades ‒ Pd-catalysed cyanosulfenylation of internal (oligo)alkynes Chemical Science, 2020, 11, 1912-1917 |
1557075 | CIF | C55 H67 N3 O6 P2 Ru | P 1 21/n 1 | 17.5623; 13.934; 20.8795 90; 92.113; 90 | 5106 | Artús Suàrez, Lluís; Jayarathne, Upul; Balcells, David; Bernskoetter, Wesley H.; Hazari, Nilay; Jaraiz, Martín; Nova, Ainara Rational selection of co-catalysts for the deaminative hydrogenation of amides. Chemical science, 2020, 11, 2225-2230 |
1557079 | CIF | C25 H23 N O3 | P 1 21 1 | 12.77764; 5.95718; 12.86001 90; 100.546; 90 | 962.352 | Di Sanza, Riccardo; Nguyen, Thi Le Nhon; Iqbal, Naeem; Argent, Stephen P.; Lewis, William; Lam, Hon Wai Enantioselective nickel-catalyzed arylative and alkenylative intramolecular 1,2-allylations of tethered allene‒ketones Chemical Science, 2020, 11, 2401-2406 |
1557080 | CIF | C23 H29 N O2 | P 21 21 21 | 10.3193; 10.5258; 18.2046 90; 90; 90 | 1977.36 | Di Sanza, Riccardo; Nguyen, Thi Le Nhon; Iqbal, Naeem; Argent, Stephen P.; Lewis, William; Lam, Hon Wai Enantioselective nickel-catalyzed arylative and alkenylative intramolecular 1,2-allylations of tethered allene‒ketones Chemical Science, 2020, 11, 2401-2406 |
1557081 | CIF | C25 H25 N O3 S | P 21 21 21 | 5.909; 12.8175; 27.4929 90; 90; 90 | 2082.27 | Di Sanza, Riccardo; Nguyen, Thi Le Nhon; Iqbal, Naeem; Argent, Stephen P.; Lewis, William; Lam, Hon Wai Enantioselective nickel-catalyzed arylative and alkenylative intramolecular 1,2-allylations of tethered allene‒ketones Chemical Science, 2020, 11, 2401-2406 |
1557082 | CIF | C24 H18 O3 | C 1 2/c 1 | 21.613; 12.1859; 13.5922 90; 104.043; 90 | 3472.8 | He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science, 2020, 11, 2001-2005 |
1557083 | CIF | C26 H24 O6 | P 1 21/c 1 | 14.145; 7.441; 24.56 90; 96.17; 90 | 2570 | He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science, 2020, 11, 2001-2005 |
1557084 | CIF | C22 H15 Cl O3 | P 1 21/n 1 | 16.2589; 6.7715; 16.4568 90; 106.511; 90 | 1737.14 | He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science, 2020, 11, 2001-2005 |
1557085 | CIF | C25 H24 O7 | P 1 21/n 1 | 12.5579; 5.2167; 35.021 90; 94.917; 90 | 2285.8 | He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science, 2020, 11, 2001-2005 |
1557086 | CIF | C25 H28 O8 | C 1 2/c 1 | 29.9022; 11.0935; 13.4816 90; 99.73; 90 | 4407.8 | He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science, 2020, 11, 2001-2005 |
1557087 | CIF | C39 H34 F6 N3 O P | P 1 21/c 1 | 9.3923; 29.4208; 11.9664 90; 102.511; 90 | 3228.14 | Zheng, Zheng; Liu, Haixiang; Zhai, Shaodong; Zhang, Haoke; Shan, Guogang; Kwok, Ryan T. K.; Ma, Chao; Sung, Herman H. Y.; Williams, Ian D.; Lam, Jacky W. Y.; Wong, Kam Sing; Hu, Xianglong; Tang, Ben Zhong Highly efficient singlet oxygen generation, two-photon photodynamic therapy and melanoma ablation by rationally designed mitochondria-specific near-infrared AIEgens Chemical Science, 2020, 11, 2494-2503 |
1557088 | CIF | C27 H22 N2 O | P 1 21/n 1 | 9.53897; 23.141; 9.5721 90; 107.33; 90 | 2017.04 | Zheng, Zheng; Liu, Haixiang; Zhai, Shaodong; Zhang, Haoke; Shan, Guogang; Kwok, Ryan T. K.; Ma, Chao; Sung, Herman H. Y.; Williams, Ian D.; Lam, Jacky W. Y.; Wong, Kam Sing; Hu, Xianglong; Tang, Ben Zhong Highly efficient singlet oxygen generation, two-photon photodynamic therapy and melanoma ablation by rationally designed mitochondria-specific near-infrared AIEgens Chemical Science, 2020, 11, 2494-2503 |
1557089 | CIF | C78 H190 Dy2 K2 N6 O21 Si12 | C 1 2/c 1 | 25.4899; 18.8304; 25.7453 90; 103.128; 90 | 12034.4 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557090 | CIF | C42 H102 Dy K N3 O12 Si6 | P 1 21/n 1 | 11.0616; 27.199; 21.7721 90; 103.885; 90 | 6359 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557091 | CIF | C78 H190 K2 N6 O21 Si12 Tm2 | C 1 2/c 1 | 25.453; 18.757; 25.744 90; 103.142; 90 | 11969 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557092 | CIF | C42 H102 K N3 O12 Si6 Tm | P 21 21 21 | 21.956; 22.554; 25.737 90; 90; 90 | 12745 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557093 | CIF | C52 H124 Gd2 K2 N4 O16 Si8 | P -1 | 12.6614; 15.5498; 21.205 94.4758; 94.0831; 105.746 | 3987.4 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557094 | CIF | C36 H90 Gd K N5 O6 Si6 | R 3 2 :H | 18.564; 18.564; 18.05 90; 90; 120 | 5387 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557095 | CIF | C42 H102 Er K N3 O12 Si6 | P 1 21/n 1 | 11.064; 27.08; 21.797 90; 103.991; 90 | 6337 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557096 | CIF | C42 H102 Ho K N3 O12 Si6 | P 1 21/n 1 | 11.0476; 27.157; 21.797 90; 103.905; 90 | 6347.9 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
1557097 | CIF | C42 H102 Gd K N3 O12 Si6 | P 1 21/n 1 | 11.1493; 27.059; 21.755 90; 104.007; 90 | 6368.1 | Ryan, Austin J.; Ziller, Joseph W.; Evans, William J. The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions Chemical Science, 2020, 11, 2006-2014 |
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