Crystallography Open Database
Search results
Result : There are 18042 entries in the selection
You can download the COD numbers of the selection as a text file
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz, or .txz archive.
We are displaying first 300 results.
Searching year of publication is 2020
| COD ID: 1551255 | |
| CIF file | Formula: - C96 H74 Cd4 N8 O28 P8 Si2 - Comments: Ai, Jing; Tian, Hong-Rui; Min, Xue; Wang, Zi-Chuan; Sun, Zhong-Ming A fast and highly selective Congo red adsorption material based on a cadmium-phosphonate network. Dalton transactions (Cambridge, England : 2003) 49(12) (2020) 3700-3705 Space group: P -1 Cell volume: 4953.8 Cell parameters: 14.0172; 14.593; 25.8504; 105.431; 95.932; 100.167; |
| COD ID: 1552151 | |
| CIF file | Formula: - C48 H45 B N2 - Comments: Zhang, Jing; Li, Aisen; Zou, Hang; Peng, Junhui; Guo, Jiali; Wu, Wenjie; Zhang, Haoke; Zhang, Jun; Gu, Xinggui; Xu, Weiqing; Xu, Shuping; Liu, Sheng Hua; Qin, Anjun; Lam, Jacky W. Y.; Tang, Ben Zhong A “simple” donor‒acceptor AIEgen with multi-stimuli responsive behavior Materials Horizons 7(1) (2020) 135-142 Space group: P 1 21/c 1 Cell volume: 3730.78 Cell parameters: 7.5979; 32.4387; 16.8075; 90; 115.761; 90; |
| COD ID: 1552310 | |
| CIF file | Formula: - C33 H30 N O4 P Pd S2 - Comments: Tan, Chen; Qasim, Muhammad; Pang, Wenmin; Chen, Changle Ligand‒metal secondary interactions in phosphine‒sulfonate palladium and nickel catalyzed ethylene (co)polymerization Polymer Chemistry 11(2) (2020) 411-416 Space group: P -1 Cell volume: 1770.9 Cell parameters: 10.11; 12.7449; 14.2331; 85.456; 75.679; 87.617; |
| COD ID: 1552372 | |
| CIF file | Formula: - C64 H52 Br2 P4 Ru S2 - Comments: Ho, Po-Yuen; Komber, Hartmut; Horatz, Kilian; Tsuda, Takuya; Mannsfeld, Stefan C. B.; Dmitrieva, Evgenia; Blacque, Olivier; Kraft, Ulrike; Sirringhaus, Henning; Lissel, Franziska Synthesis and characterization of a semiconducting and solution-processable ruthenium-based polymetallayne Polymer Chemistry 11(2) (2020) 472-479 Space group: P -1 Cell volume: 1376.31 Cell parameters: 9.3882; 12.9082; 13.5032; 117.037; 96.017; 103.315; |
| COD ID: 1552456 | |
| CIF file | Formula: - C31 H23 F3 N2 O5 - Comments: 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 11(1) (2020) 241-247 Space group: P 21 21 21 Cell volume: 2656.33 Cell parameters: 8.97942; 10.9358; 27.051; 90; 90; 90; |
| COD ID: 1552457 | |
| CIF file | Formula: - C28 H26 F3 N3 O2 - Comments: 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 11(1) (2020) 241-247 Space group: P 1 21/c 1 Cell volume: 2469.98 Cell parameters: 19.7387; 13.4237; 9.3356; 90; 93.107; 90; |
| COD ID: 1552458 | |
| CIF file | Formula: - C28 H26 F3 N3 O2 - Comments: 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 11(1) (2020) 241-247 Space group: P 1 21 1 Cell volume: 6428.06 Cell parameters: 13.5575; 23.9425; 19.8418; 90; 93.584; 90; |
| COD ID: 1552477 | |
| CIF file | Formula: - C51 H58 O14 - Comments: Xu, Xiaowen; Jerca, Florica Adriana; Van Hecke, Kristof; Jerca, Valentin Victor; Hoogenboom, Richard High compression strength single network hydrogels with pillar[5]arene junction points Materials Horizons 7(2) (2020) 566-573 Space group: P -1 Cell volume: 2251.2 Cell parameters: 9.6444; 12.2441; 19.4216; 93.6475; 99.9526; 92.348; |
| COD ID: 1552504 | |
| CIF file | Formula: - C20 H22 B N - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: F d d 2 Cell volume: 13446.6 Cell parameters: 39.763; 37.788; 8.9491; 90; 90; 90; |
| COD ID: 1552505 | |
| CIF file | Formula: - C17 H17 B Cr O3 S - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: P 1 21/c 1 Cell volume: 1618.72 Cell parameters: 11.605; 9.0305; 15.7985; 90; 102.127; 90; |
| COD ID: 1552506 | |
| CIF file | Formula: - C28 H27 B O - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: P -1 Cell volume: 1095.91 Cell parameters: 8.7781; 10.9283; 12.3004; 70.809; 87.538; 79.597; |
| COD ID: 1552507 | |
| CIF file | Formula: - C27 H27 B O - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: C 1 c 1 Cell volume: 4252.4 Cell parameters: 13.441; 13.1854; 24.0772; 90; 94.762; 90; |
| COD ID: 1552508 | |
| CIF file | Formula: - C28 H29 B O - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: P 1 21/n 1 Cell volume: 2206.5 Cell parameters: 14.454; 7.2349; 21.474; 90; 100.708; 90; |
| COD ID: 1552533 | |
| CIF file | Formula: - C88 H76 F24 N14 P4 Ru2 - Comments: 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 11(1) (2020) 70-79 Space group: P -1 Cell volume: 5320.9 Cell parameters: 13.885; 17.841; 22.499; 83.99; 73.932; 85.868; |
| COD ID: 1552713 | |
| CIF file | Formula: - C44 H42 F18 N6 P3 S2 - Comments: 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 11(1) (2020) 107-112 Space group: P b a m Cell volume: 2949.8 Cell parameters: 14.8195; 20.8662; 9.5394; 90; 90; 90; |
| COD ID: 1552714 | |
| CIF file | Formula: - C78 H73 F30 N11 P5 - Comments: 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 11(1) (2020) 107-112 Space group: C m c 21 Cell volume: 8444 Cell parameters: 19.886; 20.698; 20.515; 90; 90; 90; |
| COD ID: 1552715 | |
| CIF file | Formula: - C48 H46 F18 N6 P3 - Comments: 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 11(1) (2020) 107-112 Space group: P b a m Cell volume: 2972.79 Cell parameters: 14.1423; 21.9108; 9.5937; 90; 90; 90; |
| COD ID: 1552716 | |
| CIF file | Formula: - C36 H32 F24 N4 P4 - Comments: 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 11(1) (2020) 107-112 Space group: P 1 21/c 1 Cell volume: 2091.9 Cell parameters: 7.4563; 20.125; 13.948; 90; 91.831; 90; |
| COD ID: 1552717 | |
| CIF file | Formula: - C32 H28 F12 N4 P2 S2 - Comments: 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 11(1) (2020) 107-112 Space group: P b a m Cell volume: 2158.81 Cell parameters: 10.3821; 21.5348; 9.6558; 90; 90; 90; |
| COD ID: 1552718 | |
| CIF file | Formula: - C35 H31 F24 N5 P4 - Comments: 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 11(1) (2020) 107-112 Space group: P -1 Cell volume: 4601.4 Cell parameters: 11.2904; 16.9439; 24.966; 75.157; 86.061; 86.58; |
| COD ID: 1552719 | |
| CIF file | Formula: - C34 H30 F12 N4 P2 S - Comments: 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 11(1) (2020) 107-112 Space group: P b a m Cell volume: 2193 Cell parameters: 10.266; 21.7433; 9.8244; 90; 90; 90; |
| COD ID: 1552720 | |
| CIF file | Formula: - C44 H42 F18 N6 P3 S - Comments: 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 11(1) (2020) 107-112 Space group: P b a m Cell volume: 2993.1 Cell parameters: 14.8597; 21.003; 9.5902; 90; 90; 90; |
| COD ID: 1552721 | |
| CIF file | Formula: - C18 H16.5 F12 N2.5 P2 S0.5 - Comments: 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 11(1) (2020) 107-112 Space group: P -1 Cell volume: 2486.3 Cell parameters: 13.603; 13.8062; 16.0216; 101.314; 111.832; 107.987; |
| COD ID: 1552722 | |
| CIF file | Formula: - C47 H45 F18 N7 P3 - Comments: 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 11(1) (2020) 107-112 Space group: P b a m Cell volume: 2948.8 Cell parameters: 14.1183; 21.8905; 9.5412; 90; 90; 90; |
| COD ID: 1552748 | |
| CIF file | Formula: - C20 H28 Br2 Cu2 N2 O14 S2 - Comments: Qin, Xiu-Ying; Wang, Ya-Nan; Liu, Han-Fu; Luo, Zhao-Hui; Zhang, Pei-Lu; Li-Fang, Huang; Liu, Mei-Rong Anti-cancer activities of metal-based complexes by regulating the VEGF/VEGFR2 signaling pathway and apoptosis-related factors Bcl-2, Bax, and caspase-9 to inhibit angiogenesis and induce apoptosis. Metallomics : integrated biometal science 12(1) (2020) 92-103 Space group: P 1 21/c 1 Cell volume: 1431.6 Cell parameters: 12.248; 7.6422; 15.829; 90; 104.923; 90; |
| COD ID: 1552749 | |
| CIF file | Formula: - C24 H26 Br Co N3 O7 S - Comments: Qin, Xiu-Ying; Wang, Ya-Nan; Liu, Han-Fu; Luo, Zhao-Hui; Zhang, Pei-Lu; Li-Fang, Huang; Liu, Mei-Rong Anti-cancer activities of metal-based complexes by regulating the VEGF/VEGFR2 signaling pathway and apoptosis-related factors Bcl-2, Bax, and caspase-9 to inhibit angiogenesis and induce apoptosis. Metallomics : integrated biometal science 12(1) (2020) 92-103 Space group: I 1 2/a 1 Cell volume: 5282.5 Cell parameters: 15.5234; 19.2687; 19.1761; 90; 112.933; 90; |
| COD ID: 1552750 | |
| CIF file | Formula: - C23 H22 Br Cu N3 O6 S - Comments: Qin, Xiu-Ying; Wang, Ya-Nan; Liu, Han-Fu; Luo, Zhao-Hui; Zhang, Pei-Lu; Li-Fang, Huang; Liu, Mei-Rong Anti-cancer activities of metal-based complexes by regulating the VEGF/VEGFR2 signaling pathway and apoptosis-related factors Bcl-2, Bax, and caspase-9 to inhibit angiogenesis and induce apoptosis. Metallomics : integrated biometal science 12(1) (2020) 92-103 Space group: P 1 21/c 1 Cell volume: 2401.8 Cell parameters: 15.516; 13.3471; 11.7999; 90; 100.625; 90; |
| COD ID: 1552754 | |
| CIF file | Formula: - Al B3 Cs F O6 - Comments: 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 11(3) (2020) 694-698 Space group: P n a 21 Cell volume: 679.2 Cell parameters: 8.064; 11.97; 7.036; 90; 90; 90; |
| COD ID: 1552766 | |
| CIF file | Formula: - C28 H22 N3 P - Comments: 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 11(1) (2020) 97-106 Space group: R 3 :H Cell volume: 5851.3 Cell parameters: 34.841; 34.841; 5.566; 90; 90; 120; |
| COD ID: 1552767 | |
| CIF file | Formula: - C19 H17 N3 O P - Comments: 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 11(1) (2020) 97-106 Space group: P 21 21 21 Cell volume: 1812.1 Cell parameters: 9.0625; 10.9721; 18.2236; 90; 90; 90; |
| COD ID: 1552768 | |
| CIF file | Formula: - C19 H23 O3 P - Comments: 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 11(1) (2020) 97-106 Space group: P 1 21 1 Cell volume: 866.95 Cell parameters: 8.3114; 10.1411; 10.8128; 90; 107.963; 90; |
| COD ID: 1552769 | |
| CIF file | Formula: - C24 H32 N O2 P S - Comments: 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 11(1) (2020) 97-106 Space group: P 1 21 1 Cell volume: 1187.66 Cell parameters: 6.0745; 19.8094; 9.9683; 90; 98.06; 90; |
| COD ID: 1552770 | |
| CIF file | Formula: - C16 H18 Au Cl3 P - Comments: 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 11(1) (2020) 97-106 Space group: P -1 Cell volume: 931.5 Cell parameters: 8.6866; 10.7017; 11.1556; 72.428; 86.595; 70.591; |
| COD ID: 1552771 | |
| CIF file | Formula: - C36 H33 Cl N3 O3 P - Comments: 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 11(1) (2020) 97-106 Space group: P 1 21 1 Cell volume: 1637.8 Cell parameters: 14.421; 7.7894; 16.028; 90; 114.539; 90; |
| COD ID: 1552772 | |
| CIF file | Formula: - C15 H13 O P - Comments: 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 11(1) (2020) 97-106 Space group: P 21 21 21 Cell volume: 1340.43 Cell parameters: 7.6851; 12.5057; 13.9472; 90; 90; 90; |
| COD ID: 1552854 | |
| CIF file | Formula: - C18 H7 F9 - Comments: 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 11(1) (2020) 276-280 Space group: P -1 Cell volume: 739.7 Cell parameters: 7.427; 7.782; 13.74; 89.382; 89.146; 68.679; |
| COD ID: 1552855 | |
| CIF file | Formula: - C24 H32 N2 O3 S Si - Comments: Rej, Supriya; Chatani, Naoto Rh(ii)-catalyzed branch-selective C-H alkylation of aryl sulfonamides with vinylsilanes. Chemical science 11(2) (2020) 389-395 Space group: I 1 2/a 1 Cell volume: 4768.29 Cell parameters: 14.4384; 16.0496; 20.713; 90; 96.573; 90; |
| COD ID: 1552856 | |
| CIF file | Formula: - C38 H36 N4 O12 Rh2 S2 - Comments: Rej, Supriya; Chatani, Naoto Rh(ii)-catalyzed branch-selective C-H alkylation of aryl sulfonamides with vinylsilanes. Chemical science 11(2) (2020) 389-395 Space group: I 1 2/a 1 Cell volume: 4050.6 Cell parameters: 17.4067; 10.6112; 22.164; 90; 98.333; 90; |
| COD ID: 1552858 | |
| CIF file | Formula: - C66 H54 Cl6 N4 O10 - Comments: Dai, Heshuang; Shichibu, Yukatsu; Imai, Yoshitane; Hara, Nobuyuki; Konishi, Katsuaki; Wang, Yue; Song, Zhiyi; Nakano, Tamaki Synthesis and stereochemistry of helical polyurethanes based on 2,2′-dihydroxy-1,1′-binaphthyl and diisocyanatobenzenes Polymer Chemistry 11(6) (2020) 1134-1144 Space group: P 1 21/c 1 Cell volume: 2957.2 Cell parameters: 10.8204; 35.106; 8.2849; 90; 110.005; 90; |
| COD ID: 1552876 | |
| CIF file | Formula: - C39 H45 Au N4 O4 S - Comments: 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 11(2) (2020) 435-446 Space group: P -1 Cell volume: 1736.4 Cell parameters: 10.7063; 13.5187; 13.5554; 71.713; 76.289; 70.466; |
| COD ID: 1552877 | |
| CIF file | Formula: - C41 H52 Au Cl2 N3 - Comments: 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 11(2) (2020) 435-446 Space group: P b c a Cell volume: 7314.59 Cell parameters: 10.4512; 18.0543; 38.7653; 90; 90; 90; |
| COD ID: 1552878 | |
| CIF file | Formula: - C39 H47 Au N2 S - Comments: 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 11(2) (2020) 435-446 Space group: P 1 21/c 1 Cell volume: 3272.5 Cell parameters: 12.6173; 13.9286; 19.607; 90; 108.245; 90; |
| COD ID: 1552879 | |
| CIF file | Formula: - C45 H51 Au N2 - Comments: 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 11(2) (2020) 435-446 Space group: P 1 21/c 1 Cell volume: 3637.6 Cell parameters: 12.6669; 17.4884; 17.3107; 90; 108.451; 90; |
| COD ID: 1552880 | |
| CIF file | Formula: - C40 H49 Au Cl2 N2 O - Comments: 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 11(2) (2020) 435-446 Space group: P b c a Cell volume: 6987.9 Cell parameters: 10.0502; 17.6546; 39.3833; 90; 90; 90; |
| COD ID: 1552881 | |
| CIF file | Formula: - C79 H96 Au2 Cl2 N4 O4 S2 - Comments: 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 11(2) (2020) 435-446 Space group: P 1 21/c 1 Cell volume: 7220.9 Cell parameters: 21.965; 16.1816; 20.6249; 90; 99.929; 90; |
| COD ID: 1552882 | |
| CIF file | Formula: - C42 H53 Au N2 - Comments: 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 11(2) (2020) 435-446 Space group: P b c n Cell volume: 8157.8 Cell parameters: 34.2921; 13.9716; 17.0268; 90; 90; 90; |
| COD ID: 1552883 | |
| CIF file | Formula: - C28 H24 O2 - Comments: 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 11(2) (2020) 494-498 Space group: P -1 Cell volume: 2109.4 Cell parameters: 9.5034; 10.6505; 21.889; 96.945; 102.069; 99.44; |
| COD ID: 1552884 | |
| CIF file | Formula: - C23 H20 O - Comments: 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 11(2) (2020) 494-498 Space group: I 1 2 1 Cell volume: 1698.27 Cell parameters: 17.3724; 5.5677; 18.8919; 90; 111.661; 90; |
| COD ID: 1552885 | |
| CIF file | Formula: - C18 H17 N O2 - Comments: 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 11(2) (2020) 494-498 Space group: P 21 21 21 Cell volume: 1418.9 Cell parameters: 9.0262; 10.7097; 14.6781; 90; 90; 90; |
| COD ID: 1552886 | |
| CIF file | Formula: - C23 H19 N O2 - Comments: 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 11(2) (2020) 494-498 Space group: P 21 21 21 Cell volume: 1695.89 Cell parameters: 5.5431; 17.2727; 17.7127; 90; 90; 90; |
| COD ID: 1552917 | |
| CIF file | Formula: - C34 H31 Au Cl4 F3 N4 O3 S3 - Comments: Yu, Bingqiong; Liu, Yanhong; Peng, Xian; Hua, Siyu; Zhou, Gangcheng; Yan, Kun; Liu, Yi Synthesis, characterization, and antitumor properties of Au(i)-thiourea complexes. Metallomics : integrated biometal science 12(1) (2020) 104-113 Space group: P 21 21 2 Cell volume: 3855.6 Cell parameters: 18.2211; 18.9776; 11.15; 90; 90; 90; |
| COD ID: 1552926 | |
| CIF file | Formula: - C94 H82 N4 O2 S4 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P -1 Cell volume: 3777.2 Cell parameters: 14.9009; 15.5043; 18.1199; 99.309; 101.541; 108.366; |
| COD ID: 1552927 | |
| CIF file | Formula: - C23 H20 N2 O S - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P -1 Cell volume: 933.52 Cell parameters: 7.7145; 10.865; 12.5062; 110.002; 96.063; 104.29; |
| COD ID: 1552928 | |
| CIF file | Formula: - C66 H66 N4 O2 S2 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P -1 Cell volume: 1353.88 Cell parameters: 8.6679; 12.5073; 13.5784; 72.096; 75.545; 88.839; |
| COD ID: 1552929 | |
| CIF file | Formula: - C104 H109 N4 O8 S4 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P 1 21/c 1 Cell volume: 8968.1 Cell parameters: 15.2836; 20.0101; 29.3242; 90; 89.997; 90; |
| COD ID: 1552930 | |
| CIF file | Formula: - C100 H98 Cl6 N4 O6 S4 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P -1 Cell volume: 2251.5 Cell parameters: 8.6526; 16.4878; 18.0435; 114.697; 103.822; 90.89; |
| COD ID: 1552931 | |
| CIF file | Formula: - C58 H60 Cl3 N2 O2 S2 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: C 1 2/c 1 Cell volume: 10410.4 Cell parameters: 21.1745; 35.242; 14.1841; 90; 100.409; 90; |
| COD ID: 1552932 | |
| CIF file | Formula: - C20 H18 S2 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P -1 Cell volume: 823.92 Cell parameters: 8.429; 9.714; 11.076; 82.096; 69.206; 76.828; |
| COD ID: 1552933 | |
| CIF file | Formula: - C27 H22 N2 O S - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P 1 21/n 1 Cell volume: 2085.57 Cell parameters: 4.8299; 24.008; 17.9904; 90; 91.295; 90; |
| COD ID: 1552934 | |
| CIF file | Formula: - C95 H83 Cl3 N4 O2 S4 - Comments: Mondelli, Pierluigi; Boschetto, Gabriele; Horton, Peter N.; Tiwana, Priti; Skylaris, Chris-Kriton; Coles, Simon J.; Krompiec, Michal; Morse, Graham Meta-analysis: the molecular organization of non-fullerene acceptors Materials Horizons 7(4) (2020) 1062-1072 Space group: P -1 Cell volume: 4075.1 Cell parameters: 8.7454; 18.872; 25.2647; 87.77; 88.724; 78.001; |
| COD ID: 1552936 | |
| CIF file | Formula: - C44 H58 N8 O13 - Comments: Tao, Kai; Donnell, Joseph O'; Yuan, Hui; Haq, Ehtsham U.; Guerin, Sarah; Shimon, Linda J. W.; Xue, Bin; Silien, Christophe; Cao, Yi; Thompson, Damien; Yang, Rusen; Tofail, Syed A. M.; Gazit, Ehud Accelerated charge transfer in water-layered peptide assemblies. Energy & environmental science 13(1) (2020) 96-101 Space group: C 1 2 1 Cell volume: 2237.88 Cell parameters: 21.2554; 5.93942; 17.7277; 90; 90.6651; 90; |
| COD ID: 1552937 | |
| CIF file | Formula: - C44 H57 N8 O13 - Comments: Tao, Kai; Donnell, Joseph O'; Yuan, Hui; Haq, Ehtsham U.; Guerin, Sarah; Shimon, Linda J. W.; Xue, Bin; Silien, Christophe; Cao, Yi; Thompson, Damien; Yang, Rusen; Tofail, Syed A. M.; Gazit, Ehud Accelerated charge transfer in water-layered peptide assemblies. Energy & environmental science 13(1) (2020) 96-101 Space group: C 1 2 1 Cell volume: 2231.9 Cell parameters: 21.2; 5.9359; 17.737; 90; 90.692; 90; |
| COD ID: 1552946 | |
| CIF file | Formula: - C23 H31 N O7 Si - Comments: Yu, Haiyong; Zong, Yan; Xu, Tao Total synthesis of (−)-penicimutanin a and related congeners Chemical Science 11(3) (2020) 656-660 Space group: P 1 21 1 Cell volume: 1242.1 Cell parameters: 10.936; 9.071; 12.562; 90; 94.63; 90; |
| COD ID: 1552947 | |
| CIF file | Formula: - C45 H47 N4 O9 - Comments: Yu, Haiyong; Zong, Yan; Xu, Tao Total synthesis of (−)-penicimutanin a and related congeners Chemical Science 11(3) (2020) 656-660 Space group: P 1 21 1 Cell volume: 1958.3 Cell parameters: 8.7818; 21.1435; 10.5555; 90; 92.327; 90; |
| COD ID: 1552948 | |
| CIF file | Formula: - C26 H12 Br2 N2 O6 - Comments: Bao, Xiaoze; Rodriguez, Jean; Bonne, Damien Bidirectional enantioselective synthesis of bis-benzofuran atropisomeric oligoarenes featuring two distal C-C stereogenic axes. Chemical science 11(2) (2020) 403-408 Space group: P 21 21 21 Cell volume: 2348.9 Cell parameters: 7.355; 12.9923; 24.5807; 90; 90; 90; |
| COD ID: 1552949 | |
| CIF file | Formula: - C16.05 H12.45 N O5 - Comments: Bao, Xiaoze; Rodriguez, Jean; Bonne, Damien Bidirectional enantioselective synthesis of bis-benzofuran atropisomeric oligoarenes featuring two distal C-C stereogenic axes. Chemical science 11(2) (2020) 403-408 Space group: I 1 2 1 Cell volume: 1691.83 Cell parameters: 15.0405; 8.4792; 13.8431; 90; 106.602; 90; |
| COD ID: 1552950 | |
| CIF file | Formula: - C66 H50 N2 O4 - Comments: 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 11(2) (2020) 567-576 Space group: P 1 21 1 Cell volume: 5028.7 Cell parameters: 15.2114; 15.0318; 22.042; 90; 93.831; 90; |
| COD ID: 1552951 | |
| CIF file | Formula: - C78 H19 N O S2 - Comments: 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 11(2) (2020) 384-388 Space group: P 1 21/c 1 Cell volume: 4450.9 Cell parameters: 14.2115; 13.2334; 26.4184; 90; 116.384; 90; |
| COD ID: 1552952 | |
| CIF file | Formula: - C18 H23 Cl2 N3 O5 - Comments: Rajak, Aritra; Karan, Chandan Kumar; Theato, Patrick; Das, Anindita Supramolecularly cross-linked amphiphilic block copolymer assembly by the dipolar interaction of a merocyanine dye Polymer Chemistry 11(3) (2020) 695-703 Space group: P 1 21/c 1 Cell volume: 2002.3 Cell parameters: 11.6895; 23.58; 7.2918; 90; 94.989; 90; |
| COD ID: 1556080 | |
| CIF file | Formula: - C35 H38 Cl2 F6 Fe N4 O6 S2 - Comments: 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 11(3) (2020) 684-693 Space group: P 1 21 1 Cell volume: 1965.94 Cell parameters: 11.2529; 12.5689; 14.178; 90; 101.369; 90; |
| COD ID: 1556081 | |
| CIF file | Formula: - C38 H44 Cl4 F6 Fe N4 O6 S2 - Comments: 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 11(3) (2020) 684-693 Space group: P 21 21 21 Cell volume: 4287.9 Cell parameters: 11.265; 16.5488; 23.0009; 90; 90; 90; |
| COD ID: 1556082 | |
| CIF file | Formula: - C24 H26 N3 O - Comments: 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 11(3) (2020) 684-693 Space group: C 1 2 1 Cell volume: 1930.07 Cell parameters: 21.5973; 5.0981; 17.5377; 90; 91.771; 90; |
| COD ID: 1556083 | |
| CIF file | Formula: - C18 H21 N3 O - Comments: 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 11(3) (2020) 684-693 Space group: P 1 21 1 Cell volume: 1543.2 Cell parameters: 8.63; 15.205; 12.2; 90; 105.42; 90; |
| COD ID: 1556084 | |
| CIF file | Formula: - C22 H17 N O6 S - Comments: 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 11(3) (2020) 833-838 Space group: P 21 21 21 Cell volume: 1904.61 Cell parameters: 5.761; 15.9645; 20.7087; 90; 90; 90; |
| COD ID: 1556085 | |
| CIF file | Formula: - C22 H17 N O4 S - Comments: 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 11(3) (2020) 833-838 Space group: P n m a Cell volume: 1900.8 Cell parameters: 6.6807; 19.9408; 14.2683; 90; 90; 90; |
| COD ID: 1556261 | |
| CIF file | Formula: - C13 H7 F6 N S - Comments: 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 11(3) (2020) 737-741 Space group: P 1 21 1 Cell volume: 636.35 Cell parameters: 9.5947; 4.8799; 13.6316; 90; 94.414; 90; |
| COD ID: 1556262 | |
| CIF file | Formula: - C24 H14 F4 N2 S - Comments: 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 11(3) (2020) 737-741 Space group: P 1 21/c 1 Cell volume: 1956.69 Cell parameters: 8.6198; 7.7249; 29.3919; 90; 91.201; 90; |
| COD ID: 1556263 | |
| CIF file | Formula: - C20 H12 N2 O2 S2 - Comments: Li, Tao; Yan, Xiaodong; Liu, Yong; Zhang, Wen-Da; Fu, Qiu-Ting; Zhu, Haiyan; Li, Zaijun; Gu, Zhi-Guo A 2D covalent organic framework involving strong intramolecular hydrogen bonds for advanced supercapacitors Polymer Chemistry 11(1) (2020) 47-52 Space group: P 1 21/c 1 Cell volume: 779.93 Cell parameters: 11.2568; 5.8241; 12.8702; 90; 112.433; 90; |
| COD ID: 1556265 | |
| CIF file | Formula: - C76 H94 Cl6 F6 N6 O10 Pt2 S2 - Comments: 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 11(2) (2020) 499-507 Space group: P -1 Cell volume: 4246.8 Cell parameters: 13.4362; 18.3994; 20.2998; 106.666; 108.577; 103.771; |
| COD ID: 1556406 | |
| CIF file | Formula: - C54 H54 N18 O12 - Comments: 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 11(1) (2020) 37-43 Space group: P 1 21/c 1 Cell volume: 5600 Cell parameters: 16.615; 27.205; 13.426; 90; 112.678; 90; |
| COD ID: 1556409 | |
| CIF file | Formula: - C37 H47 B N3 O P - Comments: 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 11(3) (2020) 862-869 Space group: P 1 21/n 1 Cell volume: 3509.16 Cell parameters: 10.6925; 19.6374; 17.0321; 90; 101.118; 90; |
| COD ID: 1556410 | |
| CIF file | Formula: - C46 H58 B N4 P - Comments: 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 11(3) (2020) 862-869 Space group: P -1 Cell volume: 2101.57 Cell parameters: 10.6744; 13.4621; 14.8146; 82.534; 88.654; 84.679; |
| COD ID: 1556411 | |
| CIF file | Formula: - C31 H45 B N3 P - Comments: 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 11(3) (2020) 862-869 Space group: P 1 21/n 1 Cell volume: 6229.38 Cell parameters: 17.2385; 10.9928; 33.0859; 90; 96.506; 90; |
| COD ID: 1556412 | |
| CIF file | Formula: - C52 H72 B2 N4 P2 - Comments: 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 11(3) (2020) 862-869 Space group: P 1 21/n 1 Cell volume: 2536.47 Cell parameters: 13.0269; 14.1779; 14.8915; 90; 112.746; 90; |
| COD ID: 1556413 | |
| CIF file | Formula: - C36 H47 B N3 P - Comments: 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 11(3) (2020) 862-869 Space group: P 1 21/c 1 Cell volume: 3373.97 Cell parameters: 18.9679; 7.4054; 25.1568; 90; 107.29; 90; |
| COD ID: 1556414 | |
| CIF file | Formula: - C74 H113 B2 N6 O2 P2 - Comments: 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 11(3) (2020) 862-869 Space group: P -1 Cell volume: 3684.82 Cell parameters: 14.0563; 14.7947; 20.1864; 73.781; 76.257; 67.558; |
| COD ID: 1556415 | |
| CIF file | Formula: - C27 H36 B N2 O P - Comments: 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 11(3) (2020) 862-869 Space group: P 1 21/n 1 Cell volume: 2684.98 Cell parameters: 9.3904; 14.2038; 20.3914; 90; 99.177; 90; |
| COD ID: 1556534 | |
| CIF file | Formula: - C34.5 H29 Cl F6 N P - Comments: 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 11(4) (2020) 997-1005 Space group: P 1 21/n 1 Cell volume: 6121.7 Cell parameters: 11.2525; 9.2194; 59.1397; 90; 93.8053; 90; |
| COD ID: 1556535 | |
| CIF file | Formula: - C34 H28 F6 N P - Comments: 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 11(4) (2020) 997-1005 Space group: P 1 21/c 1 Cell volume: 2845.03 Cell parameters: 24.8939; 9.1783; 12.5794; 90; 98.168; 90; |
| COD ID: 1556536 | |
| CIF file | Formula: - C15 H13 N2 O5 Re - Comments: 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 11(5) (2020) 1216-1225 Space group: P 21 21 21 Cell volume: 1550.05 Cell parameters: 6.345; 14.5492; 16.7909; 90; 90; 90; |
| COD ID: 1556537 | |
| CIF file | Formula: - C13 H9 N2 O5 Re - Comments: 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 11(5) (2020) 1216-1225 Space group: P 1 21/c 1 Cell volume: 1328.36 Cell parameters: 9.1929; 13.3161; 11.3352; 90; 106.8; 90; |
| COD ID: 1556538 | |
| CIF file | Formula: - C15 H12 N O4 Re S - Comments: 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 11(5) (2020) 1216-1225 Space group: P 1 21/n 1 Cell volume: 1576.1 Cell parameters: 8.5304; 8.156; 22.7941; 90; 96.365; 90; |
| COD ID: 1556539 | |
| CIF file | Formula: - C20.5 H15 Cl N O5 Re - Comments: 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 11(5) (2020) 1216-1225 Space group: P 1 21/c 1 Cell volume: 1941.8 Cell parameters: 20.753; 7.0352; 13.7941; 90; 105.388; 90; |
| COD ID: 1556540 | |
| CIF file | Formula: - C13 H11 N2 O6 Re - Comments: 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 11(5) (2020) 1216-1225 Space group: P -1 Cell volume: 703.28 Cell parameters: 9.108; 9.5099; 9.7673; 70.669; 80.012; 61.781; |
| COD ID: 1556541 | |
| CIF file | Formula: - C173 H189 Ag28 Mo4 O21 P12 - Comments: Duan, Guang-Xiong; Han, Jun; Yang, Bao-Zhu; Xie, Yun-Peng; Lu, Xing Oxometalate and phosphine ligand co-protected silver nanoclusters: Ag<sub>28</sub>(dppb)<sub>6</sub>(MO<sub>4</sub>)<sub>4</sub> and Ag<sub>32</sub>(dppb)<sub>12</sub>(MO<sub>4</sub>)<sub>4</sub>(NO<sub>3</sub>)<sub>4</sub>. Nanoscale 12(3) (2020) 1617-1622 Space group: C 1 2/c 1 Cell volume: 63684 Cell parameters: 57.47; 33.556; 39.361; 90; 122.967; 90; |
| COD ID: 1556542 | |
| CIF file | Formula: - C337 H339 Ag32 Mo4 N3 O26 P24 - Comments: Duan, Guang-Xiong; Han, Jun; Yang, Bao-Zhu; Xie, Yun-Peng; Lu, Xing Oxometalate and phosphine ligand co-protected silver nanoclusters: Ag<sub>28</sub>(dppb)<sub>6</sub>(MO<sub>4</sub>)<sub>4</sub> and Ag<sub>32</sub>(dppb)<sub>12</sub>(MO<sub>4</sub>)<sub>4</sub>(NO<sub>3</sub>)<sub>4</sub>. Nanoscale 12(3) (2020) 1617-1622 Space group: C 1 2 1 Cell volume: 39530 Cell parameters: 41.161; 24.6172; 40.061; 90; 103.141; 90; |
| COD ID: 1556543 | |
| CIF file | Formula: - C168 H170 Ag28 O17 P12 W4 - Comments: Duan, Guang-Xiong; Han, Jun; Yang, Bao-Zhu; Xie, Yun-Peng; Lu, Xing Oxometalate and phosphine ligand co-protected silver nanoclusters: Ag<sub>28</sub>(dppb)<sub>6</sub>(MO<sub>4</sub>)<sub>4</sub> and Ag<sub>32</sub>(dppb)<sub>12</sub>(MO<sub>4</sub>)<sub>4</sub>(NO<sub>3</sub>)<sub>4</sub>. Nanoscale 12(3) (2020) 1617-1622 Space group: C 1 2/c 1 Cell volume: 63375 Cell parameters: 57.246; 33.4588; 38.553; 90; 120.882; 90; |
| COD ID: 1556544 | |
| CIF file | Formula: - C3 H5 N - Comments: Brand, Helen E. A.; Gu, Qinfen; Kimpton, Justin A.; Auchettl, Rebecca; Ennis, Courtney Crystal structure of propionitrile (CH~3~CH~2~CN) determined using synchrotron powder X-ray diffraction Journal of Synchrotron Radiation 27(1) (2020) 212-216 Space group: P n m a Cell volume: 360.675 Cell parameters: 7.56183; 6.59134; 7.23629; 90; 90; 90; |
| COD ID: 1556576 | |
| CIF file | Formula: - C280 H378 O238 Yb42 - Comments: Shi, Dongliang; Yang, Xiaoping; Xiao, Zhiyin; Liu, Xiaoming; Chen, Hongfen; Ma, Yanan; Schipper, Desmond; Jones, Richard A. A 42-metal Yb(iii) nanowheel with NIR luminescent response to anions. Nanoscale 12(3) (2020) 1384-1388 Space group: P -1 Cell volume: 16034.9 Cell parameters: 16.5526; 32.2692; 32.7633; 103.703; 102.725; 100.939; |
| COD ID: 1556577 | |
| CIF file | Formula: - C2 H5 N O2 - Comments: Broadhurst, Edward T.; Xu, Hongyi; Clabbers, Max T. B.; Lightowler, Molly; Nudelman, Fabio; Zou, Xiaodong; Parsons, Simon Polymorph evolution during crystal growth studied by 3D electron diffraction IUCrJ 7(1) (2020) 5-9 Space group: P 1 21/n 1 Cell volume: 336.99 Cell parameters: 5.223; 12.435; 5.563; 90; 111.14; 90; |
| COD ID: 1556578 | |
| CIF file | Formula: - C2 H5 N O2 - Comments: Broadhurst, Edward T.; Xu, Hongyi; Clabbers, Max T. B.; Lightowler, Molly; Nudelman, Fabio; Zou, Xiaodong; Parsons, Simon Polymorph evolution during crystal growth studied by 3D electron diffraction IUCrJ 7(1) (2020) 5-9 Space group: P 1 21 1 Cell volume: 179.84 Cell parameters: 5.311; 6.454; 5.694; 90; 112.86; 90; |
| COD ID: 1556579 | |
| CIF file | Formula: - C2 H5 N O2 - Comments: Broadhurst, Edward T.; Xu, Hongyi; Clabbers, Max T. B.; Lightowler, Molly; Nudelman, Fabio; Zou, Xiaodong; Parsons, Simon Polymorph evolution during crystal growth studied by 3D electron diffraction IUCrJ 7(1) (2020) 5-9 Space group: P 31 Cell volume: 272.32 Cell parameters: 7.395; 7.395; 5.75; 90; 90; 120; |
| COD ID: 1556599 | |
| CIF file | Formula: - C87.5 H82 Ag2 Fe O7.5 P4 - Comments: Liu, Kuan-Guan; Rouhani, Farzaneh; Gao, Xue-Mei; Abbasi-Azad, Mahsa; Li, Jing-Zhe; Hu, Xiu-De; Wang, Wei; Hu, Mao-Lin; Morsali, Ali Bilateral photocatalytic mechanism of dye degradation by a designed ferrocene-functionalized cluster under natural sunlight Catalysis Science & Technology 10(3) (2020) 757-767 Space group: P 1 21 1 Cell volume: 7540.6 Cell parameters: 13.2313; 30.795; 18.556; 90; 94.183; 90; |
| COD ID: 1556600 | |
| CIF file | Formula: - C122.5 H108.5 Cu2 Fe O7 P6 - Comments: Liu, Kuan-Guan; Rouhani, Farzaneh; Gao, Xue-Mei; Abbasi-Azad, Mahsa; Li, Jing-Zhe; Hu, Xiu-De; Wang, Wei; Hu, Mao-Lin; Morsali, Ali Bilateral photocatalytic mechanism of dye degradation by a designed ferrocene-functionalized cluster under natural sunlight Catalysis Science & Technology 10(3) (2020) 757-767 Space group: P b c a Cell volume: 20172 Cell parameters: 24.582; 20.281; 40.461; 90; 90; 90; |
| COD ID: 1556629 | |
| CIF file | Formula: - C15 H13 F - Comments: Fu, Wai Chung; Kwong, Fuk Yee A denitrogenative palladium-catalyzed cascade for regioselective synthesis of fluorenes Chemical Science 11(5) (2020) 1411-1417 Space group: P 1 21/n 1 Cell volume: 1110.13 Cell parameters: 13.5004; 5.6062; 15.1666; 90; 104.738; 90; |
| COD ID: 1556630 | |
| CIF file | Formula: - C40 H50 Br N5 O5 - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/c 1 Cell volume: 3678.96 Cell parameters: 11.9227; 17.3502; 17.7857; 90; 90.611; 90; |
| COD ID: 1556631 | |
| CIF file | Formula: - C29 H27 Cl N2 O - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/c 1 Cell volume: 2351.26 Cell parameters: 10.8554; 18.2505; 12.2873; 90; 105.01; 90; |
| COD ID: 1556632 | |
| CIF file | Formula: - C46 H42 Br N3 O - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/n 1 Cell volume: 3691.98 Cell parameters: 10.2078; 19.152; 18.9514; 90; 94.804; 90; |
| COD ID: 1556633 | |
| CIF file | Formula: - C28 H29 N3 O - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/c 1 Cell volume: 2344.99 Cell parameters: 9.0448; 14.0503; 18.8685; 90; 102.053; 90; |
| COD ID: 1556634 | |
| CIF file | Formula: - C31 H31 Br N2 O - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/n 1 Cell volume: 2573.07 Cell parameters: 14.485; 10.8239; 16.4134; 90; 90.869; 90; |
| COD ID: 1556635 | |
| CIF file | Formula: - C39 H39 N5 O5 - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/c 1 Cell volume: 6792.46 Cell parameters: 11.80408; 18.74504; 31.2581; 90; 79.1361; 90; |
| COD ID: 1556636 | |
| CIF file | Formula: - C45 H39 Cl2 N3 O - Comments: 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 11(5) (2020) 1418-1424 Space group: P 1 21/n 1 Cell volume: 8055.96 Cell parameters: 13.58053; 20.7753; 29.2921; 90; 102.897; 90; |
| COD ID: 1556642 | |
| CIF file | Formula: - C50 H67 B2 P3 - Comments: Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science 11(5) (2020) 1335-1341 Space group: P -1 Cell volume: 2184.47 Cell parameters: 10.6022; 10.6218; 20.1023; 94.418; 99.288; 100.371; |
| COD ID: 1556643 | |
| CIF file | Formula: - C34 H48 B2 Br P3 - Comments: Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science 11(5) (2020) 1335-1341 Space group: P b c a Cell volume: 6756.3 Cell parameters: 10.5062; 17.5469; 36.649; 90; 90; 90; |
| COD ID: 1556644 | |
| CIF file | Formula: - C34 H48 B2 Br P3 - Comments: Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science 11(5) (2020) 1335-1341 Space group: P 1 21/n 1 Cell volume: 3256.2 Cell parameters: 11.8091; 16.5734; 17.4767; 90; 107.828; 90; |
| COD ID: 1556645 | |
| CIF file | Formula: - C40 H55 B2 Br N2 P2 - Comments: Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science 11(5) (2020) 1335-1341 Space group: F d d 2 Cell volume: 16238.1 Cell parameters: 28.3736; 57.198; 10.0055; 90; 90; 90; |
| COD ID: 1556646 | |
| CIF file | Formula: - C58 H71 B2 N4 P - Comments: Stennett, Tom E.; Jayaraman, Arumugam; Brückner, Tobias; Schneider, Lea; Braunschweig, Holger Hydrophosphination of boron‒boron multiple bonds Chemical Science 11(5) (2020) 1335-1341 Space group: P -1 Cell volume: 2606.41 Cell parameters: 11.3635; 13.09; 19.2394; 89.968; 76.353; 70.181; |
| COD ID: 1556647 | |
| CIF file | Formula: - C26 H18 B F10 N - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P 1 21/c 1 Cell volume: 2341.14 Cell parameters: 16.8585; 9.6751; 15.4623; 90; 111.832; 90; |
| COD ID: 1556648 | |
| CIF file | Formula: - C44 H30 B F10 P - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P -1 Cell volume: 1751.34 Cell parameters: 8.3209; 11.319; 19.7803; 99.399; 98.04; 104.051; |
| COD ID: 1556649 | |
| CIF file | Formula: - C27 H20 B F10 N - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P 21 21 21 Cell volume: 2397.57 Cell parameters: 9.724; 14.9525; 16.4897; 90; 90; 90; |
| COD ID: 1556650 | |
| CIF file | Formula: - C46 H38 B Cl2 F10 P - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P 1 21/c 1 Cell volume: 4074.83 Cell parameters: 11.605; 20.1373; 17.8823; 90; 102.818; 90; |
| COD ID: 1556651 | |
| CIF file | Formula: - C46 H38 B Cl2 F10 P - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P -1 Cell volume: 2009 Cell parameters: 11.1982; 11.5411; 16.5533; 96.789; 96.943; 106.576; |
| COD ID: 1556652 | |
| CIF file | Formula: - C39 H28 B F10 P - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P 1 21/c 1 Cell volume: 3612.5 Cell parameters: 12.2953; 14.3056; 20.8746; 90; 100.3; 90; |
| COD ID: 1556653 | |
| CIF file | Formula: - C27 H21 B F10 - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P 1 21/c 1 Cell volume: 2377.9 Cell parameters: 6.4255; 17.461; 21.2763; 90; 95.037; 90; |
| COD ID: 1556654 | |
| CIF file | Formula: - C40 H30 B F10 P - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P -1 Cell volume: 3650.3 Cell parameters: 12.4783; 15.7635; 20.7617; 102.312; 93.184; 112.263; |
| COD ID: 1556655 | |
| CIF file | Formula: - C43 H24 B2 F20 N2 - Comments: Tao, Xin; Škoch, Karel; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard Borane-induced ring closure reaction of oligomethylene-linked bis-allenes Chemical Science 11(6) (2020) 1542-1548 Space group: P -1 Cell volume: 2022.9 Cell parameters: 9.0564; 10.3497; 21.915; 91.873; 96.63; 96.996; |
| COD ID: 1556673 | |
| CIF file | Formula: - C36 H23 Cu2 F14 N8 O8 P S4 - Comments: 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 11(6) (2020) 1607-1616 Space group: P 1 21/c 1 Cell volume: 4400.83 Cell parameters: 19.7106; 9.9489; 22.7748; 90; 99.808; 90; |
| COD ID: 1556674 | |
| CIF file | Formula: - C42 H34 Cu2 F14 N8 O9 S4 - Comments: 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 11(6) (2020) 1607-1616 Space group: P -1 Cell volume: 2574.23 Cell parameters: 12.5211; 14.8116; 15.6245; 76.518; 67.701; 76.651; |
| COD ID: 1556675 | |
| CIF file | Formula: - C43 H39 Cu2 F14 N8 O9 P S4 - Comments: 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 11(6) (2020) 1607-1616 Space group: P -1 Cell volume: 2774.4 Cell parameters: 12.4499; 12.637; 18.5946; 89.354; 84.84; 72.243; |
| COD ID: 1556676 | |
| CIF file | Formula: - C45 H35 Cu2 F14 N9 O8 S4 - Comments: 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 11(6) (2020) 1607-1616 Space group: P 21 21 21 Cell volume: 5177.4 Cell parameters: 10.918; 20.4455; 23.1939; 90; 90; 90; |
| COD ID: 1556677 | |
| CIF file | Formula: - C45 H35 Cu2 F14 N8 O8 P S4 - Comments: 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 11(6) (2020) 1607-1616 Space group: P 1 21/n 1 Cell volume: 5794.9 Cell parameters: 18.6915; 16.5896; 18.8035; 90; 96.346; 90; |
| COD ID: 1556703 | |
| CIF file | Formula: - C65.25 N4 O8 S2 - Comments: 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 11(6) (2020) 1503-1509 Space group: P -1 Cell volume: 15154.3 Cell parameters: 22.2613; 26.916; 28.2117; 83.387; 73.393; 69.33; |
| COD ID: 1556704 | |
| CIF file | Formula: - C37 N4 O8 S3 - Comments: 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 11(6) (2020) 1503-1509 Space group: P 1 21 1 Cell volume: 15347.2 Cell parameters: 22.0328; 21.2168; 33.589; 90; 102.198; 90; |
| COD ID: 1556719 | |
| CIF file | Formula: - C21 H19 N O S - Comments: 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 11(5) (2020) 1353-1360 Space group: P -1 Cell volume: 814.84 Cell parameters: 7.2702; 8.7819; 13.6782; 98.564; 100.026; 104.633; |
| COD ID: 1556720 | |
| CIF file | Formula: - C18 H13 N O - Comments: 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 11(5) (2020) 1353-1360 Space group: P 1 21/c 1 Cell volume: 2653.64 Cell parameters: 11.42288; 8.41061; 28.0872; 90; 100.454; 90; |
| COD ID: 1556721 | |
| CIF file | Formula: - C24 H19 N O S - Comments: 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 11(5) (2020) 1353-1360 Space group: P 21 21 21 Cell volume: 1848.07 Cell parameters: 5.81156; 17.547; 18.1227; 90; 90; 90; |
| COD ID: 1556722 | |
| CIF file | Formula: - C19 H15 N O - Comments: 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 11(5) (2020) 1353-1360 Space group: P 21 21 21 Cell volume: 1434.57 Cell parameters: 7.4225; 9.90594; 19.5109; 90; 90; 90; |
| COD ID: 1556723 | |
| CIF file | Formula: - C25 H21 N O S - Comments: 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 11(5) (2020) 1353-1360 Space group: P -1 Cell volume: 960.27 Cell parameters: 8.7543; 9.971; 11.6327; 81.846; 74.281; 81.076; |
| COD ID: 1556724 | |
| CIF file | Formula: - C24 Au4 Pt2 S8 - Comments: Hossain, Sakiat; Imai, Yukari; Motohashi, Yuichi; Chen, Zhaoheng; Suzuki, Daiki; Suzuki, Taiyo; Kataoka, Yuki; Hirata, Momoko; Ono, Tasuku; Kurashige, Wataru; Kawawaki, Tokuhisa; Yamamoto, Takahiro; Negishi, Yuichi Understanding and designing one-dimensional assemblies of ligand-protected metal nanoclusters Materials Horizons 7(3) (2020) 796-803 Space group: P 4/n :2 Cell volume: 2046.1 Cell parameters: 12.704; 12.704; 12.678; 90; 90; 90; |
| COD ID: 1556725 | |
| CIF file | Formula: - C98.5 H128 Au4 Pt2 S8 - Comments: Hossain, Sakiat; Imai, Yukari; Motohashi, Yuichi; Chen, Zhaoheng; Suzuki, Daiki; Suzuki, Taiyo; Kataoka, Yuki; Hirata, Momoko; Ono, Tasuku; Kurashige, Wataru; Kawawaki, Tokuhisa; Yamamoto, Takahiro; Negishi, Yuichi Understanding and designing one-dimensional assemblies of ligand-protected metal nanoclusters Materials Horizons 7(3) (2020) 796-803 Space group: C 1 2/c 1 Cell volume: 20009 Cell parameters: 44.07; 14.7091; 31.214; 90; 98.553; 90; |
| COD ID: 1556726 | |
| CIF file | Formula: - C67.5 H76 Au4 Pt2 S8 - Comments: Hossain, Sakiat; Imai, Yukari; Motohashi, Yuichi; Chen, Zhaoheng; Suzuki, Daiki; Suzuki, Taiyo; Kataoka, Yuki; Hirata, Momoko; Ono, Tasuku; Kurashige, Wataru; Kawawaki, Tokuhisa; Yamamoto, Takahiro; Negishi, Yuichi Understanding and designing one-dimensional assemblies of ligand-protected metal nanoclusters Materials Horizons 7(3) (2020) 796-803 Space group: P 1 21/n 1 Cell volume: 13283 Cell parameters: 18.0367; 30.034; 24.6; 90; 94.589; 90; |
| COD ID: 1556727 | |
| CIF file | Formula: - C56 Au4 Cl8 Pt2 S8 - Comments: Hossain, Sakiat; Imai, Yukari; Motohashi, Yuichi; Chen, Zhaoheng; Suzuki, Daiki; Suzuki, Taiyo; Kataoka, Yuki; Hirata, Momoko; Ono, Tasuku; Kurashige, Wataru; Kawawaki, Tokuhisa; Yamamoto, Takahiro; Negishi, Yuichi Understanding and designing one-dimensional assemblies of ligand-protected metal nanoclusters Materials Horizons 7(3) (2020) 796-803 Space group: I 41/a c d :2 Cell volume: 14395 Cell parameters: 30.11; 30.11; 15.878; 90; 90; 90; |
| COD ID: 1556728 | |
| CIF file | Formula: - C80 H104 Au4 Pt2 S8 - Comments: Hossain, Sakiat; Imai, Yukari; Motohashi, Yuichi; Chen, Zhaoheng; Suzuki, Daiki; Suzuki, Taiyo; Kataoka, Yuki; Hirata, Momoko; Ono, Tasuku; Kurashige, Wataru; Kawawaki, Tokuhisa; Yamamoto, Takahiro; Negishi, Yuichi Understanding and designing one-dimensional assemblies of ligand-protected metal nanoclusters Materials Horizons 7(3) (2020) 796-803 Space group: P -1 Cell volume: 2007.8 Cell parameters: 12.5672; 13.4332; 14.366; 110.038; 107.982; 103.327; |
| COD ID: 1556729 | |
| CIF file | Formula: - Ba0.45 Ce1.04 K0.55 Na5.62 O76.74 Si18.76 Ti6 - Comments: Zolotarev, Jr, Andrey A.; Krivovichev, Sergey V.; Cámara, Fernando; Bindi, Luca; Zhitova, Elena S.; Hawthorne, Frank; Sokolova, Elena Extraordinary structural complexity of ilmajokite: a multilevel hierarchical framework structure of natural origin IUCrJ 7(1) (2020) 121-128 Space group: C 1 2/c 1 Cell volume: 32837 Cell parameters: 35.908; 27.784; 33.126; 90; 96.494; 90; |
| COD ID: 1556730 | |
| CIF file | Formula: - C20 H24 O2 - Comments: Fatima, Syeda Saima; Kumar, Rajesh; Choudhary, M. Iqbal; Yousuf, Sammer Crystal engineering of exemestane to obtain a co-crystal with enhanced urease inhibition activity IUCrJ 7(1) (2020) 105-112 Space group: P 21 21 21 Cell volume: 1500.3 Cell parameters: 9.959; 11.731; 12.842; 90; 90; 90; |
| COD ID: 1556731 | |
| CIF file | Formula: - C21 H28 N2 O2 S - Comments: Fatima, Syeda Saima; Kumar, Rajesh; Choudhary, M. Iqbal; Yousuf, Sammer Crystal engineering of exemestane to obtain a co-crystal with enhanced urease inhibition activity IUCrJ 7(1) (2020) 105-112 Space group: P 1 21 1 Cell volume: 897.9 Cell parameters: 10.3797; 8.3706; 10.7275; 90; 105.568; 90; |
| COD ID: 1556844 | |
| CIF file | Formula: - C45 H57 B N2 O2 - Comments: 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 11(7) (2020) 1848-1854 Space group: P -1 Cell volume: 1981.44 Cell parameters: 9.6381; 11.485; 19.0369; 85.238; 75.946; 75.838; |
| COD ID: 1556845 | |
| CIF file | Formula: - C244 H327 Ag31 Cl5 F24 O2 P6 Pt S16 Sb4 - Comments: 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 11(6) (2020) 1691-1697 Space group: P -1 Cell volume: 16625 Cell parameters: 21.515; 24.1156; 35.321; 81.037; 78.006; 68.595; |
| COD ID: 1556846 | |
| CIF file | Formula: - C11 H13 F9 O2 - Comments: 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 11(6) (2020) 1629-1635 Space group: P 21 21 21 Cell volume: 1421.57 Cell parameters: 5.6044; 9.5819; 26.472; 90; 90; 90; |
| COD ID: 1556847 | |
| CIF file | Formula: - C7 H10 F6 O3 - Comments: 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 11(6) (2020) 1629-1635 Space group: P 1 21 1 Cell volume: 513.68 Cell parameters: 4.9029; 9.8824; 10.7838; 90; 100.543; 90; |
| COD ID: 1556849 | |
| CIF file | Formula: - C16 H6 F6 N2 O2 - Comments: Liu, Jingfeng; Meng, Qingjie; Li, Liying; Lu, Gewu; Yuan, Hang; Cui, Lei; Liu, Xia; Mu, Hongliang; Ji, Jingjing; Zhou, Defeng; Wang, Zhen; Yan, Jingling A high-performance polycyanurate network derived from 4,4′-biscyanato-2,2′-trifluoromethylbiphenyl Polymer Chemistry 11(4) (2020) 784-788 Space group: P b c n Cell volume: 1473.8 Cell parameters: 11.7327; 9.6358; 13.0361; 90; 90; 90; |
| COD ID: 1556851 | |
| CIF file | Formula: - C29 H31 N O S2 - Comments: Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Park, Sunhong; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Mechanistic insights into heavy metal ion sensing by NOS<sub>2</sub>-macrocyclic fluorosensors via the structure-function relationship: influences of fluorophores, solvents and anions. The Analyst 145(5) (2020) 1667-1676 Space group: P 1 21/c 1 Cell volume: 2409.7 Cell parameters: 5.512; 27.2877; 16.0208; 90; 90; 90; |
| COD ID: 1556852 | |
| CIF file | Formula: - C21 H24 N2 O S3 - Comments: Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Park, Sunhong; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Mechanistic insights into heavy metal ion sensing by NOS<sub>2</sub>-macrocyclic fluorosensors via the structure-function relationship: influences of fluorophores, solvents and anions. The Analyst 145(5) (2020) 1667-1676 Space group: P -1 Cell volume: 2021.8 Cell parameters: 11.4995; 13.626; 14.631; 79.476; 69.652; 70.613; |
| COD ID: 1556853 | |
| CIF file | Formula: - C174 H186 Ag6 Cl6 N6 O30 S12 - Comments: Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Park, Sunhong; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Mechanistic insights into heavy metal ion sensing by NOS<sub>2</sub>-macrocyclic fluorosensors via the structure-function relationship: influences of fluorophores, solvents and anions. The Analyst 145(5) (2020) 1667-1676 Space group: P a -3 Cell volume: 17246.7 Cell parameters: 25.8366; 25.8366; 25.8366; 90; 90; 90; |
| COD ID: 1556854 | |
| CIF file | Formula: - C22 H26 Ag Cl2 F6 N2 O P S3 - Comments: Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Park, Sunhong; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Mechanistic insights into heavy metal ion sensing by NOS<sub>2</sub>-macrocyclic fluorosensors via the structure-function relationship: influences of fluorophores, solvents and anions. The Analyst 145(5) (2020) 1667-1676 Space group: C 1 2 1 Cell volume: 2991.5 Cell parameters: 27.888; 14.9539; 7.2021; 90; 95.118; 90; |
| COD ID: 1556855 | |
| CIF file | Formula: - C24 H30 Cl2 Hg N2 O10 S3 - Comments: Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Park, Sunhong; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Mechanistic insights into heavy metal ion sensing by NOS<sub>2</sub>-macrocyclic fluorosensors via the structure-function relationship: influences of fluorophores, solvents and anions. The Analyst 145(5) (2020) 1667-1676 Space group: P 1 21/c 1 Cell volume: 2904.5 Cell parameters: 12.902; 21.339; 11.771; 90; 116.33; 90; |
| COD ID: 1556856 | |
| CIF file | Formula: - C21 H24 Hg I2 N2 O S3 - Comments: Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Park, Sunhong; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung Mechanistic insights into heavy metal ion sensing by NOS<sub>2</sub>-macrocyclic fluorosensors via the structure-function relationship: influences of fluorophores, solvents and anions. The Analyst 145(5) (2020) 1667-1676 Space group: C m c 21 Cell volume: 2606.6 Cell parameters: 10.0374; 31.171; 8.3311; 90; 90; 90; |
| COD ID: 1556860 | |
| CIF file | Formula: - C45 H44 Cl F5 N4 Ni - Comments: 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 11(5) (2020) 1260-1268 Space group: P 1 21/c 1 Cell volume: 4362.3 Cell parameters: 19.2423; 10.9261; 21.5899; 90; 106.046; 90; |
| COD ID: 1556861 | |
| CIF file | Formula: - C45 H50 F5 N3 Ni - Comments: 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 11(5) (2020) 1260-1268 Space group: P 1 21/c 1 Cell volume: 4274.5 Cell parameters: 12.0799; 14.6404; 24.1769; 90; 91.408; 90; |
| COD ID: 1556862 | |
| CIF file | Formula: - C44 H45 F5 N3 Ni - Comments: 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 11(5) (2020) 1260-1268 Space group: P -1 Cell volume: 1972.9 Cell parameters: 9.5949; 11.8426; 18.3253; 92.953; 104.293; 100.626; |
| COD ID: 1556863 | |
| CIF file | Formula: - C45 H49 F5 N3 Ni - Comments: 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 11(5) (2020) 1260-1268 Space group: P n a 21 Cell volume: 3716.9 Cell parameters: 14.1294; 16.6197; 15.8282; 90; 90; 90; |
| COD ID: 1556864 | |
| CIF file | Formula: - C40 H39 F5 N3 Ni - Comments: 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 11(5) (2020) 1260-1268 Space group: P 1 21/c 1 Cell volume: 3315.5 Cell parameters: 17.7017; 15.1269; 13.141; 90; 109.571; 90; |
| COD ID: 1556865 | |
| CIF file | Formula: - C12 H8 I2 N2 O7 - Comments: 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 11(4) (2020) 947-953 Space group: P n a 21 Cell volume: 1570.42 Cell parameters: 8.2007; 7.7793; 24.6164; 90; 90; 90; |
| COD ID: 1556866 | |
| CIF file | Formula: - C36 H50 B2 - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: P -1 Cell volume: 1520.32 Cell parameters: 9.035; 12.0924; 14.7514; 92.899; 103.022; 103.134; |
| COD ID: 1556867 | |
| CIF file | Formula: - C32 H35 B O - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: P 1 21/c 1 Cell volume: 2643.98 Cell parameters: 10.6036; 17.5824; 17.446; 90; 125.621; 90; |
| COD ID: 1556868 | |
| CIF file | Formula: - C34 H31 B O - Comments: Su, Xiaojun; Baker, J. J.; Martin, Caleb D. Dimeric boroles: effective sources of monomeric boroles for heterocycle synthesis. Chemical science 11(1) (2020) 126-131 Space group: P b c a Cell volume: 5252.4 Cell parameters: 10.0358; 12.1076; 43.226; 90; 90; 90; |
| COD ID: 1556869 | |
| CIF file | Formula: - C61 H60 Cl2 N4 O2 Ru - Comments: 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 11(8) (2020) 2243-2259 Space group: P 1 21/c 1 Cell volume: 4990.1 Cell parameters: 11.5545; 17.3432; 25.028; 90; 95.757; 90; |
| COD ID: 1556870 | |
| CIF file | Formula: - C64 H52 F4 N4 Os - Comments: 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 11(8) (2020) 2243-2259 Space group: P -1 Cell volume: 1276.53 Cell parameters: 11.0536; 11.1353; 11.8926; 97.46; 108.927; 107.647; |
| COD ID: 1556871 | |
| CIF file | Formula: - C59 H27 F20 Fe N5 - Comments: 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 11(8) (2020) 2243-2259 Space group: P 1 Cell volume: 2522.3 Cell parameters: 10.5317; 14.347; 17.434; 76.71; 80.147; 84.826; |
| COD ID: 1556872 | |
| CIF file | Formula: - C59 H50 Cl3 D Fe N4 - Comments: 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 11(8) (2020) 2243-2259 Space group: P -1 Cell volume: 2384.6 Cell parameters: 11.3588; 13.5043; 16.5422; 85.786; 84.24; 70.986; |
| COD ID: 1556873 | |
| CIF file | Formula: - C65.5 H39.5 F20 N8 Ru - Comments: 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 11(8) (2020) 2243-2259 Space group: C 1 2/c 1 Cell volume: 12268 Cell parameters: 24.815; 20.891; 24.043; 90; 100.174; 90; |
| COD ID: 1556874 | |
| CIF file | Formula: - C48 H54 Cu F12 N6 O2 P2 - Comments: 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 11(4) (2020) 1170-1175 Space group: P 1 21/n 1 Cell volume: 4986 Cell parameters: 21.313; 9.951; 24.687; 90; 107.778; 90; |
| COD ID: 1556875 | |
| CIF file | Formula: - C311.2 H387.9 B90.2 F18 Fe4 N55.5 O36 S6 - Comments: Lu, Zhenpin; Ronson, Tanya K.; Nitschke, Jonathan R. Reversible reduction drives anion ejection and C60 binding within an FeII4L6 cage Chemical Science 11(4) (2020) 1097-1101 Space group: C 1 c 1 Cell volume: 48294.4 Cell parameters: 33.357; 32.3478; 45.8124; 90; 102.32; 90; |
| COD ID: 1556876 | |
| CIF file | Formula: - C26 H42 N2 S8 Sn2 - Comments: 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 11(4) (2020) 1066-1078 Space group: P -1 Cell volume: 914.39 Cell parameters: 7.7711; 10.3961; 12.6341; 113.062; 96.284; 98.114; |
| COD ID: 1556877 | |
| CIF file | Formula: - C120 H88 B2 F48 Fe2 O2 S8 Sn2 - Comments: 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 11(4) (2020) 1066-1078 Space group: P 1 21/c 1 Cell volume: 7115 Cell parameters: 12.734; 31.568; 18.543; 90; 107.358; 90; |
| COD ID: 1556878 | |
| CIF file | Formula: - C57 H53.5 B F24 N0.5 O0.5 S8 Sn2 - Comments: 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 11(4) (2020) 1066-1078 Space group: P 1 21/c 1 Cell volume: 6756.8 Cell parameters: 9.5804; 23.505; 30.294; 90; 97.92; 90; |
| COD ID: 1556879 | |
| CIF file | Formula: - C122 H72 B2 F48 Ni2 P4 S8 - Comments: 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 11(4) (2020) 1066-1078 Space group: C 1 2/c 1 Cell volume: 13045.5 Cell parameters: 40.752; 18.985; 17.7197; 90; 107.903; 90; |
| COD ID: 1556880 | |
| CIF file | Formula: - C90 H60 B F24 Ni2 P4 S8 - Comments: 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 11(4) (2020) 1066-1078 Space group: P -1 Cell volume: 4852.9 Cell parameters: 14.1624; 18.3974; 20.189; 94.073; 103.397; 106.515; |
| COD ID: 1556881 | |
| CIF file | Formula: - C102 H92 B2 F48 O4 S8 Sn2 - Comments: 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 11(4) (2020) 1066-1078 Space group: P -1 Cell volume: 3132.6 Cell parameters: 12.9111; 15.863; 16.368; 88.537; 88.979; 69.195; |
| COD ID: 1556882 | |
| CIF file | Formula: - C106 H68 B F24 Fe2 P4 Pd2 S8 - Comments: 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 11(4) (2020) 1066-1078 Space group: P -1 Cell volume: 7009 Cell parameters: 13.503; 19.054; 28.239; 105.082; 91.975; 90.73; |
| COD ID: 1556883 | |
| CIF file | Formula: - C540 H360 B6 F144 P24 Pd12 S48 - Comments: 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 11(4) (2020) 1066-1078 Space group: P -1 Cell volume: 31897 Cell parameters: 29.421; 31.324; 35.123; 92.011; 91.984; 99.304; |
| COD ID: 1556884 | |
| CIF file | Formula: - C40 H36 F6 N3 O3 P - Comments: 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 11(4) (2020) 1165-1169 Space group: P 1 21 1 Cell volume: 3994.76 Cell parameters: 8.20579; 29.4208; 16.5731; 90; 93.223; 90; |
| COD ID: 1556885 | |
| CIF file | Formula: - C61 H46 F6 N5 O2 P - Comments: 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 11(4) (2020) 1165-1169 Space group: C 1 2/c 1 Cell volume: 9633.6 Cell parameters: 27.6234; 16.7146; 21.7661; 90; 106.545; 90; |
| COD ID: 1556886 | |
| CIF file | Formula: - C95 H78 Cl6 F12 N6 O2 P2 - Comments: 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 11(4) (2020) 1165-1169 Space group: P 1 21/c 1 Cell volume: 4196.4 Cell parameters: 11.678; 12.9347; 27.785; 90; 90.912; 90; |
| COD ID: 1556888 | |
| CIF file | Formula: - C18 H14 F4 N2 O4 S - Comments: Korlyukov, Alexander A.; Malinska, Maura; Vologzhanina, Anna V.; Goizman, Mikhail S.; Trzybinski, Damian; Wozniak, Krzysztof Charge density view on bicalutamide molecular interactions in the monoclinic polymorph and androgen receptor binding pocket IUCrJ 7(1) (2020) 71-82 Space group: P 1 21/c 1 Cell volume: 1786.05 Cell parameters: 14.8945; 12.1188; 10.2846; 90; 105.825; 90; |
| COD ID: 1556889 | |
| CIF file | Formula: - C54 H42 Cu2 N2 O8 - Comments: Yadava, Khushboo; Gallo, Gianpiero; Bette, Sebastian; Mulijanto, Caroline Evania; Karothu, Durga Prasad; Park, In-Hyeok; Medishetty, Raghavender; Naumov, Panče; Dinnebier, Robert E.; Vittal, Jagadese J. Extraordinary anisotropic thermal expansion in photosalient crystals IUCrJ 7(1) (2020) 83-89 Space group: C 1 2/c 1 Cell volume: 4382 Cell parameters: 24.633; 12.093; 15.509; 90; 108.48; 90; |
| COD ID: 1556890 | |
| CIF file | Formula: - C54 H40 Cu2 F2 N2 O8 - Comments: Yadava, Khushboo; Gallo, Gianpiero; Bette, Sebastian; Mulijanto, Caroline Evania; Karothu, Durga Prasad; Park, In-Hyeok; Medishetty, Raghavender; Naumov, Panče; Dinnebier, Robert E.; Vittal, Jagadese J. Extraordinary anisotropic thermal expansion in photosalient crystals IUCrJ 7(1) (2020) 83-89 Space group: C 1 2/c 1 Cell volume: 4426.4 Cell parameters: 24.9699; 12.1074; 15.4675; 90; 108.809; 90; |
| COD ID: 1556891 | |
| CIF file | Formula: - C54 H40 Cu2 F2 N2 O8 - Comments: Yadava, Khushboo; Gallo, Gianpiero; Bette, Sebastian; Mulijanto, Caroline Evania; Karothu, Durga Prasad; Park, In-Hyeok; Medishetty, Raghavender; Naumov, Panče; Dinnebier, Robert E.; Vittal, Jagadese J. Extraordinary anisotropic thermal expansion in photosalient crystals IUCrJ 7(1) (2020) 83-89 Space group: C 1 2/c 1 Cell volume: 4461.7 Cell parameters: 25.1802; 12.0004; 15.5976; 90; 108.802; 90; |
| COD ID: 1556892 | |
| CIF file | Formula: - C54 H40 Cu2 F2 N2 O8 - Comments: Yadava, Khushboo; Gallo, Gianpiero; Bette, Sebastian; Mulijanto, Caroline Evania; Karothu, Durga Prasad; Park, In-Hyeok; Medishetty, Raghavender; Naumov, Panče; Dinnebier, Robert E.; Vittal, Jagadese J. Extraordinary anisotropic thermal expansion in photosalient crystals IUCrJ 7(1) (2020) 83-89 Space group: P -1 Cell volume: 1126.6 Cell parameters: 10.3725; 11.0398; 12.0294; 71.354; 66.229; 65.356; |
| COD ID: 1556893 | |
| CIF file | Formula: - C5 H5 N - Comments: Giordano, Nico; Beavers, Christine M.; Campbell, Branton J.; Eigner, Václav; Gregoryanz, Eugene; Marshall, Willliam G.; Peña-Álvarez, Miriam; Teat, Simon J.; Vennari, Cara E.; Parsons, Simon High-pressure polymorphism in pyridine IUCrJ 7(1) (2020) 58-70 Space group: P 21 21 21 Cell volume: 413.3 Cell parameters: 5.392; 6.806; 11.261; 90; 90; 90; |
| COD ID: 1556894 | |
| CIF file | Formula: - C5 H5 N - Comments: Giordano, Nico; Beavers, Christine M.; Campbell, Branton J.; Eigner, Václav; Gregoryanz, Eugene; Marshall, Willliam G.; Peña-Álvarez, Miriam; Teat, Simon J.; Vennari, Cara E.; Parsons, Simon High-pressure polymorphism in pyridine IUCrJ 7(1) (2020) 58-70 Space group: P 41 21 2 Cell volume: 394 Cell parameters: 5.4053; 5.4053; 13.4853; 90; 90; 90; |
| COD ID: 1556899 | |
| CIF file | Formula: - C144 H300 Ni6 S12 - Comments: Zhuang, Zhihua; Chen, Wei One-step rapid synthesis of Ni<sub>6</sub>(C<sub>12</sub>H<sub>25</sub>S)<sub>12</sub> nanoclusters for electrochemical sensing of ascorbic acid. The Analyst 145(7) (2020) 2621-2630 Space group: P -1 Cell volume: 4117.5 Cell parameters: 13.0353; 18.6391; 19.8731; 108.331; 108.152; 101.306; |
| COD ID: 1556900 | |
| CIF file | Formula: - C62 H79 Cl2 N5 O6 Pt S - Comments: 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 11(7) (2020) 1839-1847 Space group: I 1 2/a 1 Cell volume: 12501.4 Cell parameters: 26.7934; 12.4321; 39.1414; 90; 106.494; 90; |
| COD ID: 1556901 | |
| CIF file | Formula: - C67 H79 B2 F8 N7 O6 Pt - Comments: 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 11(7) (2020) 1839-1847 Space group: P -1 Cell volume: 3439.2 Cell parameters: 10.1982; 18.2063; 19.7708; 105.665; 99.693; 96.105; |
| COD ID: 1556902 | |
| CIF file | Formula: - C65 H76 F6 N6 O6 Pt Sb - Comments: 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 11(7) (2020) 1839-1847 Space group: P -1 Cell volume: 3769.49 Cell parameters: 11.78747; 15.5279; 22.4447; 101.252; 102.144; 103.723; |
| COD ID: 1556903 | |
| CIF file | Formula: - C66 H77 B F4 N8 O5 Pt - Comments: 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 11(7) (2020) 1839-1847 Space group: P 1 21/n 1 Cell volume: 6773.5 Cell parameters: 21.738; 14.9289; 21.8888; 90; 107.531; 90; |
| COD ID: 1556904 | |
| CIF file | Formula: - C69 H85 Ag F12 N6 O6 Pt Sb2 - Comments: 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 11(7) (2020) 1839-1847 Space group: P 1 21/n 1 Cell volume: 7726.1 Cell parameters: 18.7462; 15.4022; 27.6759; 90; 104.791; 90; |
| COD ID: 1556905 | |
| CIF file | Formula: - C60 H72 B F4 N5 O5 Pt - Comments: 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 11(7) (2020) 1839-1847 Space group: P -1 Cell volume: 3041.7 Cell parameters: 12.2375; 14.6363; 18.2789; 81.118; 76.017; 74.098; |
| COD ID: 1556906 | |
| CIF file | Formula: - C67 H77 Ag F15 N7 O5 Pt Sb2.5 - Comments: 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 11(7) (2020) 1839-1847 Space group: P -1 Cell volume: 4398.8 Cell parameters: 13.0371; 18.3984; 18.4639; 88.81; 89.789; 83.438; |
| COD ID: 1556907 | |
| CIF file | Formula: - C23 H24 N2 O5 S - Comments: 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 11(6) (2020) 1636-1642 Space group: P 21 21 2 Cell volume: 2172.11 Cell parameters: 30.4605; 11.6596; 6.1159; 90; 90; 90; |
| COD ID: 1556908 | |
| CIF file | Formula: - C20 H23 N3 O3 - Comments: 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 11(6) (2020) 1636-1642 Space group: P 21 21 21 Cell volume: 1812.52 Cell parameters: 7.191; 13.5045; 18.6644; 90; 90; 90; |
| COD ID: 1556909 | |
| CIF file | Formula: - C20 H25 N3 O2 - Comments: 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 11(6) (2020) 1636-1642 Space group: P 1 21/n 1 Cell volume: 1805.9 Cell parameters: 6.8118; 17.5495; 15.1113; 90; 91.427; 90; |
| COD ID: 1556910 | |
| CIF file | Formula: - C22 H21.25 N3 O2.125 - Comments: 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 11(6) (2020) 1636-1642 Space group: P 1 21 1 Cell volume: 1860.1 Cell parameters: 10.18405; 9.71457; 18.82762; 90; 93.0169; 90; |
| COD ID: 1556911 | |
| CIF file | Formula: - C24 H21 F3 N2 O4 S - Comments: 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 11(6) (2020) 1636-1642 Space group: P 21 21 21 Cell volume: 2232.16 Cell parameters: 32.8358; 11.60538; 5.85758; 90; 90; 90; |
| COD ID: 1556912 | |
| CIF file | Formula: - C22 H25 N3 O2 - Comments: 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 11(6) (2020) 1636-1642 Space group: P 1 21 1 Cell volume: 2005.95 Cell parameters: 12.4713; 9.02632; 17.84198; 90; 92.8702; 90; |
| COD ID: 1556913 | |
| CIF file | Formula: - C20 H19 N3 O - Comments: 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 11(6) (2020) 1636-1642 Space group: P 1 21 1 Cell volume: 807.53 Cell parameters: 10.10659; 5.94958; 13.62038; 90; 99.5974; 90; |
| COD ID: 1556914 | |
| CIF file | Formula: - C28 H30 N2 O2 - Comments: 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 11(6) (2020) 1636-1642 Space group: P 21 21 21 Cell volume: 2348.65 Cell parameters: 8.33247; 15.71709; 17.93381; 90; 90; 90; |
| COD ID: 1556915 | |
| CIF file | Formula: - C24 H24 N2 O4 S - Comments: 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 11(6) (2020) 1636-1642 Space group: P 21 21 21 Cell volume: 2163.2 Cell parameters: 6.0985; 11.5023; 30.8387; 90; 90; 90; |
| COD ID: 1556927 | |
| CIF file | Formula: - C9 H19 I2 N3 Pd - Comments: Khazipov, Oleg V.; Shevchenko, Maxim A.; Pasyukov, Dmitry V.; Chernenko, Andrey Yu.; Astakhov, Alexander V.; Tafeenko, Victor A.; Chernyshev, Victor M.; Ananikov, Valentine P. Preventing Pd‒NHC bond cleavage and switching from nano-scale to molecular catalytic systems: amines and temperature as catalyst activators Catalysis Science & Technology 10(5) (2020) 1228-1247 Space group: C 1 2/c 1 Cell volume: 3145.5 Cell parameters: 14.7908; 7.8079; 27.592; 90; 99.197; 90; |
| COD ID: 1556928 | |
| CIF file | Formula: - C13 H21 I2 N3 Pd - Comments: Khazipov, Oleg V.; Shevchenko, Maxim A.; Pasyukov, Dmitry V.; Chernenko, Andrey Yu.; Astakhov, Alexander V.; Tafeenko, Victor A.; Chernyshev, Victor M.; Ananikov, Valentine P. Preventing Pd‒NHC bond cleavage and switching from nano-scale to molecular catalytic systems: amines and temperature as catalyst activators Catalysis Science & Technology 10(5) (2020) 1228-1247 Space group: P 1 21/c 1 Cell volume: 1848.27 Cell parameters: 17.5721; 12.5994; 8.4655; 90; 99.55; 90; |
| COD ID: 1556929 | |
| CIF file | Formula: - C15 H17 I2 N3 Pd - Comments: Khazipov, Oleg V.; Shevchenko, Maxim A.; Pasyukov, Dmitry V.; Chernenko, Andrey Yu.; Astakhov, Alexander V.; Tafeenko, Victor A.; Chernyshev, Victor M.; Ananikov, Valentine P. Preventing Pd‒NHC bond cleavage and switching from nano-scale to molecular catalytic systems: amines and temperature as catalyst activators Catalysis Science & Technology 10(5) (2020) 1228-1247 Space group: C 1 2/c 1 Cell volume: 3763.8 Cell parameters: 21.6545; 8.657; 20.1671; 90; 95.408; 90; |
| COD ID: 1556930 | |
| CIF file | Formula: - C16 H19 I2 N3 Pd - Comments: Khazipov, Oleg V.; Shevchenko, Maxim A.; Pasyukov, Dmitry V.; Chernenko, Andrey Yu.; Astakhov, Alexander V.; Tafeenko, Victor A.; Chernyshev, Victor M.; Ananikov, Valentine P. Preventing Pd‒NHC bond cleavage and switching from nano-scale to molecular catalytic systems: amines and temperature as catalyst activators Catalysis Science & Technology 10(5) (2020) 1228-1247 Space group: P -1 Cell volume: 976.59 Cell parameters: 9.5333; 10.964; 11.3716; 62.48; 79.571; 67.896; |
| COD ID: 1556981 | |
| CIF file | Formula: - La3 Li6.5 Nb0.5 O12 Zr1.5 - Comments: Kataoka, K. Oxide single crystals with high lithium-ion conductivity as solid electrolytes for all-solid-state lithium secondary battery applications Journal of the Ceramic Society of Japan 128 (2020) 7-18 Space group: I a -3 d Cell volume: 2153.2 Cell parameters: 12.913; 12.913; 12.913; 90; 90; 90; |
| COD ID: 1556982 | |
| CIF file | Formula: - La3 Li6.5 O12 Ta0.5 Zr1.5 - Comments: Kataoka, K. Oxide single crystals with high lithium-ion conductivity as solid electrolytes for all-solid-state lithium secondary battery applications Journal of the Ceramic Society of Japan 128 (2020) 7-18 Space group: I a -3 d Cell volume: 2168.98 Cell parameters: 12.9445; 12.9445; 12.9445; 90; 90; 90; |
| COD ID: 1556983 | |
| CIF file | Formula: - C23 H19.35 N5 O4.18 - Comments: Lin, Shuang; Yu, Huimin; Yang, Beiye; Li, Fengli; Chen, Xia; Li, Huaqiang; Zhang, Sitian; Wang, Jianping; Hu, Youcai; Hu, Zhengxi; Zhang, Yonghui Reisolation and Configurational Reinvestigation of Cottoquinazolines E-G from an Arthropod-Derived Strain of the Fungus <i>Neosartorya fischeri</i>. Journal of natural products 83(1) (2020) 169-173 Space group: P 21 21 21 Cell volume: 4097.64 Cell parameters: 7.4338; 19.1874; 28.7281; 90; 90; 90; |
| COD ID: 1556984 | |
| CIF file | Formula: - C25 H25 N5 O5 - Comments: Lin, Shuang; Yu, Huimin; Yang, Beiye; Li, Fengli; Chen, Xia; Li, Huaqiang; Zhang, Sitian; Wang, Jianping; Hu, Youcai; Hu, Zhengxi; Zhang, Yonghui Reisolation and Configurational Reinvestigation of Cottoquinazolines E-G from an Arthropod-Derived Strain of the Fungus <i>Neosartorya fischeri</i>. Journal of natural products 83(1) (2020) 169-173 Space group: P 61 Cell volume: 3500.6 Cell parameters: 13.718; 13.718; 21.48; 90; 90; 120; |
| COD ID: 1556985 | |
| CIF file | Formula: - C6 H12 N4 O8 P2 S2 - Comments: Yuan, Guohao; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Highly Proton-Conducting Mixed Proton-Transferred [(H2PO4‒)(H3PO4)]∞Networks Supported by 2,2′-Diaminobithiazolium in Crystals The Journal of Physical Chemistry C (2020) Space group: P 1 21/c 1 Cell volume: 699.628 Cell parameters: 4.6777; 8.716; 17.1651; 90; 91.394; 90; |
| COD ID: 1556986 | |
| CIF file | Formula: - C6 H20 N4 O16 P4 S2 - Comments: Yuan, Guohao; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Highly Proton-Conducting Mixed Proton-Transferred [(H2PO4‒)(H3PO4)]∞Networks Supported by 2,2′-Diaminobithiazolium in Crystals The Journal of Physical Chemistry C (2020) Space group: P 1 21/n 1 Cell volume: 1014.26 Cell parameters: 11.0254; 7.0847; 13.0691; 90; 96.516; 90; |
| COD ID: 1556987 | |
| CIF file | Formula: - C3 H6 N2 O4 P S - Comments: Yuan, Guohao; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Highly Proton-Conducting Mixed Proton-Transferred [(H2PO4‒)(H3PO4)]∞Networks Supported by 2,2′-Diaminobithiazolium in Crystals The Journal of Physical Chemistry C (2020) Space group: P -1 Cell volume: 333.08 Cell parameters: 5.40917; 7.805; 8.856; 63.995; 84.123; 83.101; |
| COD ID: 1556988 | |
| CIF file | Formula: - C3 H9 N2 O8 P2 S - Comments: Yuan, Guohao; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Highly Proton-Conducting Mixed Proton-Transferred [(H2PO4‒)(H3PO4)]∞Networks Supported by 2,2′-Diaminobithiazolium in Crystals The Journal of Physical Chemistry C (2020) Space group: P -1 Cell volume: 496.242 Cell parameters: 5.26221; 8.96277; 10.8217; 97.609; 95.9417; 98.5964; |
| COD ID: 1556989 | |
| CIF file | Formula: - C6 H9 N4 O4 P S2 - Comments: Yuan, Guohao; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Highly Proton-Conducting Mixed Proton-Transferred [(H2PO4‒)(H3PO4)]∞Networks Supported by 2,2′-Diaminobithiazolium in Crystals The Journal of Physical Chemistry C (2020) Space group: P 1 21/c 1 Cell volume: 1124.63 Cell parameters: 13.8433; 10.0451; 8.1208; 90; 95.19; 90; |
| COD ID: 1556992 | |
| CIF file | Formula: - C18 H16 O4 - Comments: 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 11(8) (2020) 2130-2135 Space group: P b c n Cell volume: 2883.2 Cell parameters: 9.7263; 11.8883; 24.935; 90; 90; 90; |
| COD ID: 1556993 | |
| CIF file | Formula: - C26 H24 N2 O2 S - Comments: 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 11(6) (2020) 1672-1676 Space group: P -1 Cell volume: 1236.26 Cell parameters: 10.6565; 11.1408; 12.3; 69.374; 76.912; 65.303; |
| COD ID: 1556994 | |
| CIF file | Formula: - C28 H26 N2 - Comments: 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 11(6) (2020) 1672-1676 Space group: P 21 21 21 Cell volume: 2136.4 Cell parameters: 9.072; 9.846; 23.918; 90; 90; 90; |
| COD ID: 1556995 | |
| CIF file | Formula: - C54 H31.2 F0.8 O8 Zn2 - Comments: 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 11(7) (2020) 1814-1824 Space group: C 1 2/c 1 Cell volume: 13533.1 Cell parameters: 37.1066; 31.0733; 11.8903; 90; 99.208; 90; |
| COD ID: 1557016 | |
| CIF file | Formula: - C22 H30 O2 - Comments: Shu, Zhibin; Zhang, Qing; Zhang, Pan; Qin, Zhengsheng; Liu, Dan; Gao, Xiong; Guan, Bo; Qi, Haoyuan; Xiao, Mengqi; Wei, Zhongming; Dong, Huanli; Hu, Wenping Preparing two-dimensional crystalline conjugated polymer films by synergetic polymerization and self-assembly at air/water interface Polymer Chemistry 11(9) (2020) 1572-1579 Space group: P 1 21/n 1 Cell volume: 972.3 Cell parameters: 9.223; 6.718; 15.694; 90; 90.983; 90; |
| COD ID: 1557022 | |
| CIF file | Formula: - C4 H18 Br5 N3 Pb S2 - Comments: Bakthavatsalam, Rangarajan; Haris, Muhammed P. U.; Shaikh, Samir R.; Lohar, Amruta; Mohanty, Ashutosh; Moghe, Dhanashree; Sharma, Shivani; Biswas, Chinmoy; Raavi, Sai Santhosh Kumar; Gonnade, Rajesh G.; Kundu, Janardan Ligand Structure Directed Dimensionality Reduction (2D →1D) in Lead Bromide Perovskite The Journal of Physical Chemistry C (2020) Space group: P 1 21 1 Cell volume: 900.8 Cell parameters: 10.066; 8.4068; 10.9787; 90; 104.155; 90; |
| COD ID: 1557023 | |
| CIF file | Formula: - C3 H11 Br4 N3 Pb S - Comments: Bakthavatsalam, Rangarajan; Haris, Muhammed P. U.; Shaikh, Samir R.; Lohar, Amruta; Mohanty, Ashutosh; Moghe, Dhanashree; Sharma, Shivani; Biswas, Chinmoy; Raavi, Sai Santhosh Kumar; Gonnade, Rajesh G.; Kundu, Janardan Ligand Structure Directed Dimensionality Reduction (2D →1D) in Lead Bromide Perovskite The Journal of Physical Chemistry C (2020) Space group: P 1 21/c 1 Cell volume: 1375.31 Cell parameters: 13.3113; 8.5838; 12.0368; 90; 90.406; 90; |
| COD ID: 1557024 | |
| CIF file | Formula: - C38 H34 S4 - Comments: 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 11(7) (2020) 1825-1831 Space group: C 1 2/c 1 Cell volume: 3008.8 Cell parameters: 41.708; 5.7563; 12.67; 90; 98.46; 90; |
| COD ID: 1557025 | |
| CIF file | Formula: - C42 H42 S4 - Comments: 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 11(7) (2020) 1825-1831 Space group: P 1 21/c 1 Cell volume: 1685 Cell parameters: 23.82; 5.837; 12.5; 90; 104.133; 90; |
| COD ID: 1557026 | |
| CIF file | Formula: - C42 H42 S4 - Comments: 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 11(7) (2020) 1825-1831 Space group: P 1 21/c 1 Cell volume: 1659.6 Cell parameters: 22.15; 5.7413; 13.1188; 90; 95.85; 90; |
| COD ID: 1557027 | |
| CIF file | Formula: - C66 H30 Al3 Ba F89 O9 - Comments: 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 11(8) (2020) 2068-2076 Space group: P 1 c 1 Cell volume: 9468.1 Cell parameters: 28.173; 16.4313; 20.453; 90; 90.107; 90; |
| COD ID: 1557028 | |
| CIF file | Formula: - C52 H26 Al2 Ca F68 O7 - Comments: 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 11(8) (2020) 2068-2076 Space group: P 1 21 1 Cell volume: 7340 Cell parameters: 17.765; 20.654; 20.031; 90; 93.018; 90; |
| COD ID: 1557029 | |
| CIF file | Formula: - C36 H18 Al2 F55 In O6 - Comments: 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 11(8) (2020) 2068-2076 Space group: P -1 Cell volume: 5537.2 Cell parameters: 10.6319; 22.3961; 24.4869; 79.144; 79.696; 77.759; |
| COD ID: 1557030 | |
| CIF file | Formula: - C50 H22 Al2 F74 Mg N6 O8 - Comments: 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 11(8) (2020) 2068-2076 Space group: P 1 Cell volume: 5895.1 Cell parameters: 14.3953; 18.2606; 25.8315; 73.784; 74.37; 66.821; |
| COD ID: 1557031 | |
| CIF file | Formula: - C84 H34 Al4 F118 O12 Sr - Comments: 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 11(8) (2020) 2068-2076 Space group: P -1 Cell volume: 6278.6 Cell parameters: 13.8661; 20.2883; 23.0336; 80.031; 85.985; 79.942; |
| COD ID: 1557032 | |
| CIF file | Formula: - C84 H34 Al4 Ca F118 O12 - Comments: 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 11(8) (2020) 2068-2076 Space group: P -1 Cell volume: 6296.8 Cell parameters: 13.9542; 20.3286; 22.9128; 80.085; 84.743; 80.239; |
| COD ID: 1557033 | |
| CIF file | Formula: - C60 H26 Al3 Ca F87 O9 - Comments: 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 11(8) (2020) 2068-2076 Space group: P 1 21/c 1 Cell volume: 8773.4 Cell parameters: 23.429; 18.9075; 22.4874; 90; 118.27; 90; |
| COD ID: 1557034 | |
| CIF file | Formula: - C66 H30 Al3 F89 O9 Sr - Comments: 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 11(8) (2020) 2068-2076 Space group: P -1 Cell volume: 9387.7 Cell parameters: 13.5412; 25.3825; 27.3385; 90.017; 90.111; 92.474; |
| COD ID: 1557040 | |
| CIF file | Formula: - C17 H10 Br2 N2 O - Comments: Sala, Samuele; Nealon, Gareth L.; Sobolev, Alexandre N.; Fromont, Jane; Gomez, Oliver; Flematti, Gavin R. Structure Reassignment of Echinosulfone A and the Echinosulfonic Acids A-D Supported by Single-Crystal X-ray Diffraction and Density Functional Theory Analysis. Journal of natural products 83(1) (2020) 105-110 Space group: P 1 21/n 1 Cell volume: 1467.2 Cell parameters: 10.0349; 8.3874; 17.4347; 90; 91.005; 90; |
| COD ID: 1557041 | |
| CIF file | Formula: - C40 H49 Br N2 O - Comments: Rottschäfer, Dennis; Glodde, Timo; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. A crystalline C5-protonated 1,3-imidazol-4-ylidene. Chemical communications (Cambridge, England) 56(13) (2020) 2027-2030 Space group: P 1 21/n 1 Cell volume: 3559.32 Cell parameters: 11.1088; 21.1979; 15.9518; 90; 108.641; 90; |
| COD ID: 1557042 | |
| CIF file | Formula: - C42 H44 N2 Ni O3 - Comments: Rottschäfer, Dennis; Glodde, Timo; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. A crystalline C5-protonated 1,3-imidazol-4-ylidene. Chemical communications (Cambridge, England) 56(13) (2020) 2027-2030 Space group: P -1 Cell volume: 1831.63 Cell parameters: 10.35522; 11.18263; 16.4194; 100.307; 95.6535; 99.0466; |
| COD ID: 1557043 | |
| CIF file | Formula: - C46 H52 Au Cl N2 - Comments: Rottschäfer, Dennis; Glodde, Timo; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. A crystalline C5-protonated 1,3-imidazol-4-ylidene. Chemical communications (Cambridge, England) 56(13) (2020) 2027-2030 Space group: P 1 21/c 1 Cell volume: 3973.7 Cell parameters: 12.2795; 16.812; 19.2885; 90; 93.6946; 90; |
| COD ID: 1557044 | |
| CIF file | Formula: - C39 H44 N2 - Comments: Rottschäfer, Dennis; Glodde, Timo; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. A crystalline C5-protonated 1,3-imidazol-4-ylidene. Chemical communications (Cambridge, England) 56(13) (2020) 2027-2030 Space group: I 41/a :2 Cell volume: 14172.4 Cell parameters: 38.4682; 38.4682; 9.5772; 90; 90; 90; |
| COD ID: 1557045 | |
| CIF file | Formula: - C17 H14 Cl N O2 - Comments: 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 11(8) (2020) 2121-2129 Space group: P 21 21 21 Cell volume: 1394.63 Cell parameters: 5.3182; 10.94; 23.9705; 90; 90; 90; |
| COD ID: 1557052 | |
| CIF file | Formula: - C22 H28 N - Comments: Mongin, Cédric; Ardoy, Alejandro Mendez; Méreau, Raphaël; Bassani, Dario M.; Bibal, Brigitte Singlet oxygen stimulus for switchable functional organic cages Chemical Science 11(6) (2020) 1478-1484 Space group: P -1 Cell volume: 897.7 Cell parameters: 5.899; 7.547; 20.535; 83.465; 84.681; 82.512; |
| COD ID: 1557053 | |
| CIF file | Formula: - C28 H18 O2 - Comments: Mongin, Cédric; Ardoy, Alejandro Mendez; Méreau, Raphaël; Bassani, Dario M.; Bibal, Brigitte Singlet oxygen stimulus for switchable functional organic cages Chemical Science 11(6) (2020) 1478-1484 Space group: P 1 21/c 1 Cell volume: 973.06 Cell parameters: 13.0175; 9.329; 8.3512; 90; 106.37; 90; |
| COD ID: 1557054 | |
| CIF file | Formula: - C20 H14 I N - Comments: Martinez, Thibaut; Alahyen, Ismail; Lemière, Gilles; Mouriès-Mansuy, Virginie; Fensterbank, Louis Straightforward Access to 2-Iodoindolizines via Iodine-Mediated Cyclization of 2-Pyridylallenes Organic Process Research & Development (2020) Space group: P c c n Cell volume: 3261.2 Cell parameters: 16.5305; 18.7386; 10.5281; 90; 90; 90; |
| COD ID: 1557055 | |
| CIF file | Formula: - C20 H21 B Cl2 O2 - Comments: Rami, Fabian; Bächtle, Franziska; Plietker, Bernd Hydroboration of internal alkynes catalyzed by FeH(CO)(NO)(PPh3)2: a case of boron-source controlled regioselectivity Catalysis Science & Technology 10(5) (2020) 1492-1497 Space group: C 1 2/c 1 Cell volume: 3922 Cell parameters: 27.001; 6.0841; 25.1455; 90; 108.298; 90; |
| COD ID: 1557056 | |
| CIF file | Formula: - C22 H27 B O2 - Comments: Rami, Fabian; Bächtle, Franziska; Plietker, Bernd Hydroboration of internal alkynes catalyzed by FeH(CO)(NO)(PPh3)2: a case of boron-source controlled regioselectivity Catalysis Science & Technology 10(5) (2020) 1492-1497 Space group: C 1 2/c 1 Cell volume: 3926.8 Cell parameters: 35.07; 6.2286; 20.596; 90; 119.212; 90; |
| COD ID: 1557057 | |
| CIF file | Formula: - C22 H27 B O2 - Comments: Rami, Fabian; Bächtle, Franziska; Plietker, Bernd Hydroboration of internal alkynes catalyzed by FeH(CO)(NO)(PPh3)2: a case of boron-source controlled regioselectivity Catalysis Science & Technology 10(5) (2020) 1492-1497 Space group: P c a 21 Cell volume: 3942.7 Cell parameters: 25.447; 6.3811; 24.281; 90; 90; 90; |
| COD ID: 1557058 | |
| CIF file | Formula: - C36.5 H57 B Cl F4 N4 P4 Rh - Comments: Cunillera, Anton; de los Bernardos, Miriam Díaz; Urrutigoïty, Martine; Claver, Carmen; Ruiz, Aurora; Godard, Cyril Efficient synthesis of chiral γ-aminobutyric esters via direct rhodium-catalysed enantioselective hydroaminomethylation of acrylates Catalysis Science & Technology 10(3) (2020) 630-634 Space group: P 31 2 1 Cell volume: 6635 Cell parameters: 13.824; 13.824; 40.089; 90; 90; 120; |
| COD ID: 1557059 | |
| CIF file | Formula: - C27 H42 B Cl2 F4 N2 P2 Rh - Comments: Cunillera, Anton; de los Bernardos, Miriam Díaz; Urrutigoïty, Martine; Claver, Carmen; Ruiz, Aurora; Godard, Cyril Efficient synthesis of chiral γ-aminobutyric esters via direct rhodium-catalysed enantioselective hydroaminomethylation of acrylates Catalysis Science & Technology 10(3) (2020) 630-634 Space group: P 1 21 1 Cell volume: 1561.44 Cell parameters: 9.7105; 14.3281; 11.2851; 90; 96.031; 90; |
| COD ID: 1557060 | |
| CIF file | Formula: - C18 H19 N S Si - Comments: 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 11(7) (2020) 1912-1917 Space group: P -1 Cell volume: 873.5 Cell parameters: 8.52831; 10.39109; 11.21545; 117.584; 92.3119; 95.1854; |
| COD ID: 1557061 | |
| CIF file | Formula: - C17 H13 N O S - Comments: 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 11(7) (2020) 1912-1917 Space group: C 1 2/c 1 Cell volume: 2804.6 Cell parameters: 20.6204; 9.4103; 16.7239; 90; 120.205; 90; |
| COD ID: 1557062 | |
| CIF file | Formula: - C18 H15 N O S - Comments: 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 11(7) (2020) 1912-1917 Space group: P b c a Cell volume: 2949.79 Cell parameters: 13.1964; 13.3812; 16.7048; 90; 90; 90; |
| COD ID: 1557063 | |
| CIF file | Formula: - C11 H9 N O S - Comments: 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 11(7) (2020) 1912-1917 Space group: P 1 21/c 1 Cell volume: 957.99 Cell parameters: 10.9143; 7.26579; 12.4737; 90; 104.425; 90; |
| COD ID: 1557064 | |
| CIF file | Formula: - C16 H21 N S Se Si - Comments: 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 11(7) (2020) 1912-1917 Space group: P 1 21/c 1 Cell volume: 1721.35 Cell parameters: 10.6588; 8.0663; 20.1272; 90; 95.886; 90; |
| COD ID: 1557065 | |
| CIF file | Formula: - C22 H23 N S - Comments: 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 11(7) (2020) 1912-1917 Space group: P 1 21/c 1 Cell volume: 1759.89 Cell parameters: 13.9373; 7.7203; 17.0136; 90; 105.984; 90; |
| COD ID: 1557066 | |
| CIF file | Formula: - C21 H20 S - Comments: 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 11(7) (2020) 1912-1917 Space group: P 1 21/n 1 Cell volume: 1563.83 Cell parameters: 7.5133; 25.6215; 8.2645; 90; 100.591; 90; |
| COD ID: 1557067 | |
| CIF file | Formula: - C10 H7 N S - Comments: 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 11(7) (2020) 1912-1917 Space group: P -1 Cell volume: 425.18 Cell parameters: 6.9027; 7.3743; 9.3503; 68.861; 73.292; 84.246; |
| COD ID: 1557068 | |
| CIF file | Formula: - C16 H11 N O S - Comments: 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 11(7) (2020) 1912-1917 Space group: P b c a Cell volume: 2526.94 Cell parameters: 12.2557; 9.5626; 21.5616; 90; 90; 90; |
| COD ID: 1557069 | |
| CIF file | Formula: - C17 H17 N S - Comments: 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 11(7) (2020) 1912-1917 Space group: P 1 21/c 1 Cell volume: 1371.48 Cell parameters: 11.1885; 11.263; 12.1884; 90; 116.756; 90; |
| COD ID: 1557075 | |
| CIF file | Formula: - C55 H67 N3 O6 P2 Ru - Comments: 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 11(8) (2020) 2225-2230 Space group: P 1 21/n 1 Cell volume: 5106 Cell parameters: 17.5623; 13.934; 20.8795; 90; 92.113; 90; |
| COD ID: 1557079 | |
| CIF file | Formula: - C25 H23 N O3 - Comments: 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 11(9) (2020) 2401-2406 Space group: P 1 21 1 Cell volume: 962.352 Cell parameters: 12.77764; 5.95718; 12.86001; 90; 100.546; 90; |
| COD ID: 1557080 | |
| CIF file | Formula: - C23 H29 N O2 - Comments: 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 11(9) (2020) 2401-2406 Space group: P 21 21 21 Cell volume: 1977.36 Cell parameters: 10.3193; 10.5258; 18.2046; 90; 90; 90; |
| COD ID: 1557081 | |
| CIF file | Formula: - C25 H25 N O3 S - Comments: 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 11(9) (2020) 2401-2406 Space group: P 21 21 21 Cell volume: 2082.27 Cell parameters: 5.909; 12.8175; 27.4929; 90; 90; 90; |
| COD ID: 1557082 | |
| CIF file | Formula: - C24 H18 O3 - Comments: He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science 11(7) (2020) 2001-2005 Space group: C 1 2/c 1 Cell volume: 3472.8 Cell parameters: 21.613; 12.1859; 13.5922; 90; 104.043; 90; |
| COD ID: 1557083 | |
| CIF file | Formula: - C26 H24 O6 - Comments: He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science 11(7) (2020) 2001-2005 Space group: P 1 21/c 1 Cell volume: 2570 Cell parameters: 14.145; 7.441; 24.56; 90; 96.17; 90; |
| COD ID: 1557084 | |
| CIF file | Formula: - C22 H15 Cl O3 - Comments: He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science 11(7) (2020) 2001-2005 Space group: P 1 21/n 1 Cell volume: 1737.14 Cell parameters: 16.2589; 6.7715; 16.4568; 90; 106.511; 90; |
| COD ID: 1557085 | |
| CIF file | Formula: - C25 H24 O7 - Comments: He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science 11(7) (2020) 2001-2005 Space group: P 1 21/n 1 Cell volume: 2285.8 Cell parameters: 12.5579; 5.2167; 35.021; 90; 94.917; 90; |
| COD ID: 1557086 | |
| CIF file | Formula: - C25 H28 O8 - Comments: He, Zhen; Perry, Gregory J. P.; Procter, David J. Sulfoxide-mediated oxidative cross-coupling of phenols Chemical Science 11(7) (2020) 2001-2005 Space group: C 1 2/c 1 Cell volume: 4407.8 Cell parameters: 29.9022; 11.0935; 13.4816; 90; 99.73; 90; |
| COD ID: 1557087 | |
| CIF file | Formula: - C39 H34 F6 N3 O P - Comments: 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 11(9) (2020) 2494-2503 Space group: P 1 21/c 1 Cell volume: 3228.14 Cell parameters: 9.3923; 29.4208; 11.9664; 90; 102.511; 90; |
| COD ID: 1557088 | |
| CIF file | Formula: - C27 H22 N2 O - Comments: 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 11(9) (2020) 2494-2503 Space group: P 1 21/n 1 Cell volume: 2017.04 Cell parameters: 9.53897; 23.141; 9.5721; 90; 107.33; 90; |
| COD ID: 1557089 | |
| CIF file | Formula: - C78 H190 Dy2 K2 N6 O21 Si12 - Comments: 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 11(7) (2020) 2006-2014 Space group: C 1 2/c 1 Cell volume: 12034.4 Cell parameters: 25.4899; 18.8304; 25.7453; 90; 103.128; 90; |
| COD ID: 1557090 | |
| CIF file | Formula: - C42 H102 Dy K N3 O12 Si6 - Comments: 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 11(7) (2020) 2006-2014 Space group: P 1 21/n 1 Cell volume: 6359 Cell parameters: 11.0616; 27.199; 21.7721; 90; 103.885; 90; |
| COD ID: 1557091 | |
| CIF file | Formula: - C78 H190 K2 N6 O21 Si12 Tm2 - Comments: 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 11(7) (2020) 2006-2014 Space group: C 1 2/c 1 Cell volume: 11969 Cell parameters: 25.453; 18.757; 25.744; 90; 103.142; 90; |
| COD ID: 1557092 | |
| CIF file | Formula: - C42 H102 K N3 O12 Si6 Tm - Comments: 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 11(7) (2020) 2006-2014 Space group: P 21 21 21 Cell volume: 12745 Cell parameters: 21.956; 22.554; 25.737; 90; 90; 90; |
| COD ID: 1557093 | |
| CIF file | Formula: - C52 H124 Gd2 K2 N4 O16 Si8 - Comments: 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 11(7) (2020) 2006-2014 Space group: P -1 Cell volume: 3987.4 Cell parameters: 12.6614; 15.5498; 21.205; 94.4758; 94.0831; 105.746; |
| COD ID: 1557094 | |
| CIF file | Formula: - C36 H90 Gd K N5 O6 Si6 - Comments: 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 11(7) (2020) 2006-2014 Space group: R 3 2 :H Cell volume: 5387 Cell parameters: 18.564; 18.564; 18.05; 90; 90; 120; |
| COD ID: 1557095 | |
| CIF file | Formula: - C42 H102 Er K N3 O12 Si6 - Comments: 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 11(7) (2020) 2006-2014 Space group: P 1 21/n 1 Cell volume: 6337 Cell parameters: 11.064; 27.08; 21.797; 90; 103.991; 90; |
| COD ID: 1557096 | |
| CIF file | Formula: - C42 H102 Ho K N3 O12 Si6 - Comments: 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 11(7) (2020) 2006-2014 Space group: P 1 21/n 1 Cell volume: 6347.9 Cell parameters: 11.0476; 27.157; 21.797; 90; 103.905; 90; |
| COD ID: 1557097 | |
| CIF file | Formula: - C42 H102 Gd K N3 O12 Si6 - Comments: 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 11(7) (2020) 2006-2014 Space group: P 1 21/n 1 Cell volume: 6368.1 Cell parameters: 11.1493; 27.059; 21.755; 90; 104.007; 90; |
| COD ID: 1557098 | |
| CIF file | Formula: - C42 H102 K N3 O12 Si6 Tb - Comments: 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 11(7) (2020) 2006-2014 Space group: P 1 21/n 1 Cell volume: 6371.8 Cell parameters: 11.1324; 27.081; 21.775; 90; 103.924; 90; |
| COD ID: 1557099 | |
| CIF file | Formula: - C78 H190 Gd2 K2 N6 O21 Si12 - Comments: 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 11(7) (2020) 2006-2014 Space group: C 1 2/c 1 Cell volume: 12014 Cell parameters: 25.507; 18.806; 25.726; 90; 103.21; 90; |
| COD ID: 1557100 | |
| CIF file | Formula: - C42 H102 K N3 O12 Si6 Y - Comments: 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 11(7) (2020) 2006-2014 Space group: P 1 21/n 1 Cell volume: 6346.5 Cell parameters: 11.0774; 27.0905; 21.7959; 90; 104; 90; |
| COD ID: 1557101 | |
| CIF file | Formula: - C78 H190 Ho2 K2 N6 O21 Si12 - Comments: 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 11(7) (2020) 2006-2014 Space group: C 1 2/c 1 Cell volume: 12009 Cell parameters: 25.514; 18.8; 25.712; 90; 103.167; 90; |
| COD ID: 1557105 | |
| CIF file | Formula: - C104 H96 B4 F16 N8 O4 Pd2 - Comments: Lewis, James E. M.; Tarzia, Andrew; White, Andrew J. P.; Jelfs, Kim E. Conformational control of Pd2L4 assemblies with unsymmetrical ligands Chemical Science 11(3) (2020) 677-683 Space group: I 1 2/a 1 Cell volume: 9660.2 Cell parameters: 28.36; 12.35285; 27.666; 90; 94.6541; 90; |
| COD ID: 1557106 | |
| CIF file | Formula: - C123 H119 B4 F16 N17 O9 Pd2 - Comments: Lewis, James E. M.; Tarzia, Andrew; White, Andrew J. P.; Jelfs, Kim E. Conformational control of Pd2L4 assemblies with unsymmetrical ligands Chemical Science 11(3) (2020) 677-683 Space group: C 1 2/c 1 Cell volume: 13222.3 Cell parameters: 23.2193; 15.8896; 38.7298; 90; 112.281; 90; |
| COD ID: 1557107 | |
| CIF file | Formula: - C16 H19 I N2 - Comments: Guo, Lifang; Li, Chuanya; Shang, Hai; Zhang, Ruoyao; Li, Xuechen; Lu, Qing; Cheng, Xiao; Liu, Zhiqiang; Sun, Jing Zhi; Yu, Xiaoqiang A side-chain engineering strategy for constructing fluorescent dyes with direct and ultrafast self-delivery to living cells Chemical Science 11(3) (2020) 661-670 Space group: P 1 21/c 1 Cell volume: 1534.73 Cell parameters: 6.29025; 7.62301; 32.0065; 90; 90.1584; 90; |
| COD ID: 1557108 | |
| CIF file | Formula: - C64 H87 I3 N5 O2 - Comments: Guo, Lifang; Li, Chuanya; Shang, Hai; Zhang, Ruoyao; Li, Xuechen; Lu, Qing; Cheng, Xiao; Liu, Zhiqiang; Sun, Jing Zhi; Yu, Xiaoqiang A side-chain engineering strategy for constructing fluorescent dyes with direct and ultrafast self-delivery to living cells Chemical Science 11(3) (2020) 661-670 Space group: P -1 Cell volume: 3222.3 Cell parameters: 14.6729; 15.6807; 16.4518; 85.945; 73.88; 62.636; |
| COD ID: 1557109 | |
| CIF file | Formula: - C17 H18 I N2 - Comments: Guo, Lifang; Li, Chuanya; Shang, Hai; Zhang, Ruoyao; Li, Xuechen; Lu, Qing; Cheng, Xiao; Liu, Zhiqiang; Sun, Jing Zhi; Yu, Xiaoqiang A side-chain engineering strategy for constructing fluorescent dyes with direct and ultrafast self-delivery to living cells Chemical Science 11(3) (2020) 661-670 Space group: P 21 21 21 Cell volume: 1651.98 Cell parameters: 6.9063; 7.9318; 30.157; 90; 90; 90; |
| COD ID: 1557110 | |
| CIF file | Formula: - C73 H92 N5 O2 U - Comments: Yadav, Munendra; Metta-Magaña, Alejandro; Fortier, Skye Intra- and intermolecular interception of a photochemically generated terminal uranium nitride Chemical Science 11(9) (2020) 2381-2387 Space group: P -1 Cell volume: 3230.4 Cell parameters: 13.2857; 13.9411; 20.5686; 103.573; 95.666; 116.252; |
| COD ID: 1557111 | |
| CIF file | Formula: - C75 H88 N8 U - Comments: Yadav, Munendra; Metta-Magaña, Alejandro; Fortier, Skye Intra- and intermolecular interception of a photochemically generated terminal uranium nitride Chemical Science 11(9) (2020) 2381-2387 Space group: P -1 Cell volume: 3230.5 Cell parameters: 13.1219; 13.5561; 20.3099; 78.109; 76.264; 68.201; |
| COD ID: 1557112 | |
| CIF file | Formula: - C76 H99 N6 O P U - Comments: Yadav, Munendra; Metta-Magaña, Alejandro; Fortier, Skye Intra- and intermolecular interception of a photochemically generated terminal uranium nitride Chemical Science 11(9) (2020) 2381-2387 Space group: P 1 21/c 1 Cell volume: 7197 Cell parameters: 25.884; 13.889; 21.315; 90; 110.09; 90; |
| COD ID: 1557113 | |
| CIF file | Formula: - C75 H96 N6 U - Comments: Yadav, Munendra; Metta-Magaña, Alejandro; Fortier, Skye Intra- and intermolecular interception of a photochemically generated terminal uranium nitride Chemical Science 11(9) (2020) 2381-2387 Space group: P 1 21/n 1 Cell volume: 6994.8 Cell parameters: 14.7113; 12.979; 36.748; 90; 94.521; 90; |
| COD ID: 1557114 | |
| CIF file | Formula: - C82 H101 N7 O U - Comments: Yadav, Munendra; Metta-Magaña, Alejandro; Fortier, Skye Intra- and intermolecular interception of a photochemically generated terminal uranium nitride Chemical Science 11(9) (2020) 2381-2387 Space group: P -1 Cell volume: 3692.6 Cell parameters: 13.1812; 15.8571; 19.6743; 110.71; 90.48; 105.002; |
| COD ID: 1557115 | |
| CIF file | Formula: - C33 H26 O2 - Comments: Liu, Xihong; Zhang, Jingying; Bai, Lutao; Wang, Linqing; Yang, Dongxu; Wang, Rui Catalytic asymmetric multiple dearomatizations of phenols enabled by a cascade 1,8-addition and Diels‒Alder reaction Chemical Science 11(3) (2020) 671-676 Space group: P 21 21 21 Cell volume: 2430.58 Cell parameters: 11.3659; 11.9259; 17.9314; 90; 90; 90; |
| COD ID: 1557116 | |
| CIF file | Formula: - C64 H88 - Comments: Storey, Caroline M.; Kalpokas, Audrius; Gyton, Matthew R.; Krämer, Tobias; Chaplin, Adrian B. A shape changing tandem Rh(CNC) catalyst: preparation of bicyclo[4.2.0]octa-1,5,7-trienes from terminal aryl alkynes. Chemical science 11(8) (2020) 2051-2057 Space group: P -1 Cell volume: 5396.2 Cell parameters: 14.635; 18.1373; 22.0161; 79.631; 75.201; 74.12; |
| COD ID: 1557117 | |
| CIF file | Formula: - C61 H39 B F24 N7 Rh - Comments: Storey, Caroline M.; Kalpokas, Audrius; Gyton, Matthew R.; Krämer, Tobias; Chaplin, Adrian B. A shape changing tandem Rh(CNC) catalyst: preparation of bicyclo[4.2.0]octa-1,5,7-trienes from terminal aryl alkynes. Chemical science 11(8) (2020) 2051-2057 Space group: P -1 Cell volume: 3512.7 Cell parameters: 12.9083; 14.2464; 20.148; 74.898; 79.351; 89.459; |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!