Crystallography Open Database

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Searching year of publication is 2022

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1564427 CIFC50 H34 N2P 1 21/n 119.525; 9.546; 20.594
90; 114.38; 90
3496Han, Pengbo; Lin, Chengwei; Wang, Kaojin; Qiu, Yanping; Wu, Haozhong; Qin, Anjun; Ma, Dongge; Tang, Ben Zhong
Aggregation-induced emission luminogen with excellent triplet-triplet upconversion efficiency for highly efficient non-doped blue organic light-emitting diodes.
Materials horizons, 2022, 9, 376-382
1564683 CIFC21 H18P -18.321; 9.678; 9.879
94.541; 96.864; 94.634
784.1Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen
Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.
Materials horizons, 2022, 9, 368-375
1564684 CIFC21 H17 BrP 1 21/c 18.773; 9.273; 20.333
90; 90.317; 90
1654.1Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen
Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.
Materials horizons, 2022, 9, 368-375
1564685 CIFC21 H15 F3P c a 2131.9; 8.761; 5.796
90; 90; 90
1620Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen
Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.
Materials horizons, 2022, 9, 368-375
1564686 CIFC21 H14 Br F3P 1 21/c 113.672; 7.976; 16.909
90; 99.786; 90
1817.1Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen
Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.
Materials horizons, 2022, 9, 368-375
1564687 CIFC21 H16 Br2P 1 21/c 112.88; 8.745; 18.874
90; 121.39; 90
1815Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen
Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.
Materials horizons, 2022, 9, 368-375
1564688 CIFC21 H13 Br2 F3P 1 21/c 116.448; 6.0973; 19.528
90; 105.073; 90
1891.1Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen
Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.
Materials horizons, 2022, 9, 368-375
1564845 CIFC90 H102 Cl2 F2 N8 O2 S5C 1 2/c 126.5046; 23.0448; 31.2654
90; 107.646; 90
18198.1Wang, Lai; An, Qiaoshi; Yan, Lu; Bai, Hai-Rui; Jiang, Mengyun; Mahmood, Asif; Yang, Can; Zhi, Hongfu; Wang, Jin-Liang
Non-fullerene acceptors with hetero-dihalogenated terminals induce significant difference in single crystallography and enable binary organic solar cells with 17.5% efficiency
Energy & Environmental Science, 2022, 15, 320-333
1564846 CIFC90 H102 Br2 F2 N8 O2 S5C 1 2/c 126.7059; 23.0515; 31.3331
90; 107.898; 90
18355.5Wang, Lai; An, Qiaoshi; Yan, Lu; Bai, Hai-Rui; Jiang, Mengyun; Mahmood, Asif; Yang, Can; Zhi, Hongfu; Wang, Jin-Liang
Non-fullerene acceptors with hetero-dihalogenated terminals induce significant difference in single crystallography and enable binary organic solar cells with 17.5% efficiency
Energy & Environmental Science, 2022, 15, 320-333
1564847 CIFC90 H102 Br2 Cl2 N8 O2 S5P -116.0896; 17.7032; 17.9514
107.551; 114.327; 90.288
4392.9Wang, Lai; An, Qiaoshi; Yan, Lu; Bai, Hai-Rui; Jiang, Mengyun; Mahmood, Asif; Yang, Can; Zhi, Hongfu; Wang, Jin-Liang
Non-fullerene acceptors with hetero-dihalogenated terminals induce significant difference in single crystallography and enable binary organic solar cells with 17.5% efficiency
Energy & Environmental Science, 2022, 15, 320-333
1564950 CIFC11 H20 Cu F3 O3 S5P 1 21/n 119.3571; 9.1791; 20.0178
90; 93.921; 90
3548.5Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564951 CIFC14 H24 Cl4 Cu F6 O6 S6P 1 21/n 19.4758; 10.1782; 15.084
90; 99.132; 90
1436.4Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564952 CIFC12 H23 Cl2 Co N S4C 1 2/c 121.553; 8.7583; 9.884
90; 98.733; 90
1844.1Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564953 CIFC12 H23 Cu F6 N P S4P -18.9013; 10.1583; 12.8933
71.697; 70.925; 67.975
996.7Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564954 CIFC16 H26 Co F6 N2 O6 S6P 1 21/c 19.7818; 17.6403; 8.0039
90; 91.436; 90
1380.67Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564955 CIFC78 H50 B2 F48 Fe N2 S4P -112.2236; 12.9921; 14.746
74.5207; 87.2647; 66.8668
2071.09Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564956 CIFC11 H22 Cu F3 N2 O3 S3P 1 21/n 18.7939; 14.9481; 13.6317
90; 102.586; 90
1748.9Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564957 CIFC11 H22 Cl2 Cu F6 P S4C 1 2/c 124.959; 9.584; 20.849
90; 126.366; 90
4015.9Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564958 CIFC16 H29 Fe2 I4 N3 S4P b c a13.5519; 19.3693; 22.7518
90; 90; 90
5972.1Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564959 CIFC28 H52 Fe3 I6 N4 S8P 1 21/c 117.8349; 19.1835; 15.1569
90; 101.373; 90
5083.9Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1564960 CIFC34 H40 B Cu S4P 6110.7164; 10.7164; 47.139
90; 90; 120
4688.2Rotärmel, Thomas; Becker, Jonathan; Schindler, Siegfried
Syntheses and investigation of metal complexes with macrocyclic polythioether ligands.
Faraday discussions, 2022, 234, 70-85
1565020 CIFC83 H89 F4 N9 O3 S2 Se2P -111.7514; 17.3977; 19.925
102.675; 98.649; 99.031
3852.2Qi, Feng; Jones, Leighton O.; Jiang, Kui; Jang, Sei-Hum; Kaminsky, Werner; Oh, Jiyeon; Zhang, Hongna; Cai, Zongwei; Yang, Changduk; Kohlstedt, Kevin L.; Schatz, George C.; Lin, Francis R.; Marks, Tobin J.; Jen, Alex K.-Y.
Regiospecific <i>N</i>-alkyl substitution tunes the molecular packing of high-performance non-fullerene acceptors.
Materials horizons, 2022, 9, 403-410
1565021 CIFC88 H99 F4 N9 O3 S2 Se2C 1 2/c 118.8244; 29.3244; 31.439
90; 95.951; 90
17261.2Qi, Feng; Jones, Leighton O.; Jiang, Kui; Jang, Sei-Hum; Kaminsky, Werner; Oh, Jiyeon; Zhang, Hongna; Cai, Zongwei; Yang, Changduk; Kohlstedt, Kevin L.; Schatz, George C.; Lin, Francis R.; Marks, Tobin J.; Jen, Alex K.-Y.
Regiospecific <i>N</i>-alkyl substitution tunes the molecular packing of high-performance non-fullerene acceptors.
Materials horizons, 2022, 9, 403-410
1565022 CIFC81 H85 F4 N9 O2 S2 Se2P 1 21/c 113.938; 52.166; 31.942
90; 99.927; 90
22877Qi, Feng; Jones, Leighton O.; Jiang, Kui; Jang, Sei-Hum; Kaminsky, Werner; Oh, Jiyeon; Zhang, Hongna; Cai, Zongwei; Yang, Changduk; Kohlstedt, Kevin L.; Schatz, George C.; Lin, Francis R.; Marks, Tobin J.; Jen, Alex K.-Y.
Regiospecific <i>N</i>-alkyl substitution tunes the molecular packing of high-performance non-fullerene acceptors.
Materials horizons, 2022, 9, 403-410
1565122 CIFC30 H28 S2P 16.0023; 8.1084; 24.3715
98.319; 94.455; 92.83
1167.9Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo
Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties.
Materials horizons, 2022, 9, 444-451
1565123 CIFC30 H28 S2P 16.0173; 8.1041; 24.3262
98.542; 94.452; 92.932
1167.2Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo
Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties.
Materials horizons, 2022, 9, 444-451
1565133 CIFC88 H76 Cl2 Fe2 N12 O13P 1 21/c 18.0718; 26.641; 36.191
90; 95.657; 90
7744.6Amanullah, Sk; Saha, Paramita; Dey, Abhishek
O<sub>2</sub> reduction by iron porphyrins with electron withdrawing groups: to scale or not to scale.
Faraday discussions, 2022, 234, 143-158
1565172 CIFC20 H23 Br N4 O2 RuP 1 21/n 17.918; 17.8; 14.7128
90; 95.2089; 90
2065.06Illam, Praseetha Mathoor; Rit, Arnab
Electronically tuneable orthometalated RuII–NHC complexes as efficient catalysts for C–C and C–N bond formations via borrowing hydrogen strategy
Catalysis Science & Technology, 2022, 12, 67-74
1565173 CIFH4 N2 O3P m m n :25.446; 5.7605; 4.9406
90; 90; 90
154.99Nesterova, Oksana V.; Kuznetsov, Maxim L.; Pombeiro, Armando J. L.; Shul'pin, Georgiy B.; Nesterov, Dmytro S.
Homogeneous oxidation of C–H bonds with m-CPBA catalysed by a Co/Fe system: mechanistic insights from the point of view of the oxidant
Catalysis Science & Technology, 2022, 12, 282-299
1565174 CIFC19 H25 Co N2 O6P -317.5321; 17.5321; 10.9885
90; 90; 120
2925.1Nesterova, Oksana V.; Kuznetsov, Maxim L.; Pombeiro, Armando J. L.; Shul'pin, Georgiy B.; Nesterov, Dmytro S.
Homogeneous oxidation of C–H bonds with m-CPBA catalysed by a Co/Fe system: mechanistic insights from the point of view of the oxidant
Catalysis Science & Technology, 2022, 12, 282-299
1565226 CIFC10 H15 N O2 SP 1 21 17.72; 7.7534; 9.0532
90; 94.725; 90
540.05Li, Peng-Fei; Ai, Yong; Zeng, Yu-Ling; Liu, Jun-Chao; Xu, Zhe-Kun; Wang, Zhong-Xia
Highest-Tc single-component homochiral organic ferroelectrics
Chemical Science, 2022, 13, 657-664
1565227 CIFC10 H15 N O2 SP 1 21 17.7253; 7.7557; 9.0549
90; 94.727; 90
540.68Li, Peng-Fei; Ai, Yong; Zeng, Yu-Ling; Liu, Jun-Chao; Xu, Zhe-Kun; Wang, Zhong-Xia
Highest-Tc single-component homochiral organic ferroelectrics
Chemical Science, 2022, 13, 657-664
1565228 CIFC10 H15 N O2 SP 1 21 17.748; 7.6312; 8.9986
90; 95.11; 90
529.941Li, Peng-Fei; Ai, Yong; Zeng, Yu-Ling; Liu, Jun-Chao; Xu, Zhe-Kun; Wang, Zhong-Xia
Highest-Tc single-component homochiral organic ferroelectrics
Chemical Science, 2022, 13, 657-664
1565229 CIFC10 H15 N O2 SP 1 21/m 17.699; 7.6119; 8.9599
90; 94.873; 90
523.188Li, Peng-Fei; Ai, Yong; Zeng, Yu-Ling; Liu, Jun-Chao; Xu, Zhe-Kun; Wang, Zhong-Xia
Highest-Tc single-component homochiral organic ferroelectrics
Chemical Science, 2022, 13, 657-664
1565230 CIFC10 H15 N O2 SP 1 21 17.7527; 7.6368; 8.9989
90; 95.097; 90
530.68Li, Peng-Fei; Ai, Yong; Zeng, Yu-Ling; Liu, Jun-Chao; Xu, Zhe-Kun; Wang, Zhong-Xia
Highest-Tc single-component homochiral organic ferroelectrics
Chemical Science, 2022, 13, 657-664
1565386 CIFAl2.69 B50C m m a12.661; 12.337; 5.0928
90; 90; 90
795.5Zheng, Xu; Yan, Dayu; Yi, Changjiang; Zhu, Jinlong; Zhang, Qinghua; Zhai, Junyi; Ma, Teng; Zhu, Pinwen; Li, Hui; Gu, Lin; Zhao, Yusheng; Yao, Yugui; Shi, Youguo; Yu, Xiaohui; Jin, Changqing
The discovery of a superhard P-type transparent semiconductor: Al<sub>2.69</sub>B<sub>50</sub>.
Materials horizons, 2022, 9, 748-755
1565433 CIFC48 H41 Cl9 N6P -18.1464; 11.8837; 25.5753
83.931; 83.143; 86.209
2440.85He, Jian-Li; Tang, Yukun; Zhang, Kai; Zhao, Yue; Lin, Yu-Ching; Hsu, Chih-Kai; Chen, Chia-Hsun; Chiu, Tien-Lung; Lee, Jiun-Haw; Wang, Chuan-Kui; Wu, Chung-Chih; Fan, Jian
An extended π-backbone for highly efficient near-infrared thermally activated delayed fluorescence with enhanced horizontal molecular orientation.
Materials horizons, 2022, 9, 772-779
1565488 CIFC43 H44 N2 O P2P 21 21 2110.0784; 11.7543; 30.5885
90; 90; 90
3623.65Chakrabortty, Soumyadeep; Konieczny, Katharina; Müller, Bernd H.; Spannenberg, Anke; Kamer, Paul C. J.; de Vries, Johannes G.
Betti base derived P-stereogenic phosphine-diamidophosphite ligands with a single atom spacer and their application in asymmetric catalysis
Catalysis Science & Technology, 2022, 12, 1392-1399
1565568 CIFF4 I3 K3 O12 V2C m c 2111.6074; 8.5215; 15.0981
90; 90; 90
1493.4Chen, Jin; Hu, Chun-Li; Lin, Yi-Lin; Chen, Yan; Chen, Qian-Qian; Mao, Jiang-Gao
K3V2O3F4(IO3)3: a high-performance SHG crystal containing both five and six-coordinated V5+ cations
Chemical Science, 2022, 13, 454-460
1565590 CIFC18 H15 Br Cl F2 N O2P 1 21 111.04668; 5.51936; 14.34857
90; 101.385; 90
857.627Xu, Xiao; Bao, Longzhu; Ran, Lu; Yang, Zhenyan; Yan, Dingce; Wang, Chun-Jiang; Teng, Huailong
Synthesis of bioactive fluoropyrrolidines via copper(i)-catalysed asymmetric 1,3-dipolar cycloaddition of azomethine ylides
Chemical Science, 2022, 13, 1398-1407
1565601 CIFC27 H29 N3 O4P 1 21/c 111.3563; 16.7472; 12.6545
90; 101.483; 90
2358.54Kuhn, Ariel J.; Ehlke, Beatriz; Johnstone, Timothy C.; Oliver, Scott R. J.; Raskatov, Jevgenij A.
A crystal-structural study of Pauling–Corey rippled sheets
Chemical Science, 2022, 13, 671-680
1565602 CIFC40 H52 O2 S2 Si2P -114.2639; 14.5005; 20.4969
105.307; 109.588; 90.479
3830.5Gao, Yunpeng; Feng, Chi; Seo, Tamae; Kubota, Koji; Ito, Hajime
Efficient access to materials-oriented aromatic alkynes via the mechanochemical Sonogashira coupling of solid aryl halides with large polycyclic conjugated systems
Chemical Science, 2022, 13, 430-438
1565603 CIFC42 H52 S5 Si2C 1 2/c 139.5034; 9.2352; 23.1512
90; 96.916; 90
8384.61Gao, Yunpeng; Feng, Chi; Seo, Tamae; Kubota, Koji; Ito, Hajime
Efficient access to materials-oriented aromatic alkynes via the mechanochemical Sonogashira coupling of solid aryl halides with large polycyclic conjugated systems
Chemical Science, 2022, 13, 430-438
1565604 CIFC18 H14 Br N O2P 1 21/c 18.8605; 21.1565; 7.8415
90; 93.025; 90
1467.9Yuan, Da-Fu; Wang, Zi-Chen; Geng, Rui-Sen; Ren, Guang-Yi; Wright, James S.; Ni, Shao-Fei; Li, Ming; Wen, Li-Rong; Zhang, Lin-Bao
Hypervalent iodine promoted the synthesis of cycloheptatrienes and cyclopropanes
Chemical Science, 2022, 13, 478-485
1565605 CIFC20 H16 Br N O2P 1 21/c 17.9559; 6.808; 30.863
90; 91.251; 90
1671.26Yuan, Da-Fu; Wang, Zi-Chen; Geng, Rui-Sen; Ren, Guang-Yi; Wright, James S.; Ni, Shao-Fei; Li, Ming; Wen, Li-Rong; Zhang, Lin-Bao
Hypervalent iodine promoted the synthesis of cycloheptatrienes and cyclopropanes
Chemical Science, 2022, 13, 478-485
1565606 CIFC19 H16 F3 N O2P -19.4212; 10.7629; 18.7421
94.939; 96.779; 110.576
1750.05Yuan, Da-Fu; Wang, Zi-Chen; Geng, Rui-Sen; Ren, Guang-Yi; Wright, James S.; Ni, Shao-Fei; Li, Ming; Wen, Li-Rong; Zhang, Lin-Bao
Hypervalent iodine promoted the synthesis of cycloheptatrienes and cyclopropanes
Chemical Science, 2022, 13, 478-485
1565640 CIFC3 H8 Cl N O4P 1 21/c 18.1; 8.269; 9.997
90; 99.57; 90
660.3Gao, Zhangran; Wu, Yuying; Jiao, Shulin; Tang, Zheng; Sun, Xiaofan; Li, Dong; Cai, Hong-Ling; Wu, X. S.
Large dielectric switch effects induced by an order-disorder transformation in cyclopropylamine perchlorate crystals.
Nanoscale, 2022, 14, 675-679
1565641 CIFC3 H8 Cl N O4P 1 21 14.9117; 8.1838; 8.056
90; 99.683; 90
319.21Gao, Zhangran; Wu, Yuying; Jiao, Shulin; Tang, Zheng; Sun, Xiaofan; Li, Dong; Cai, Hong-Ling; Wu, X. S.
Large dielectric switch effects induced by an order-disorder transformation in cyclopropylamine perchlorate crystals.
Nanoscale, 2022, 14, 675-679
1565662 CIFC34 H68 B Ce O2 Si2P 1 21/c 17.4686; 26.405; 19.52
90; 97.925; 90
3812.7Münzfeld, Luca; Sun, Xiaofei; Schlittenhardt, Sören; Schoo, Christoph; Hauser, Adrian; Gillhuber, Sebastian; Weigend, Florian; Ruben, Mario; Roesky, Peter W.
Introduction of plumbole to f-element chemistry
Chemical Science, 2022, 13, 945-954
1565663 CIFC30 H60 B Er O Si2P n m a15.8956; 24.908; 8.4943
90; 90; 90
3363.1Münzfeld, Luca; Sun, Xiaofei; Schlittenhardt, Sören; Schoo, Christoph; Hauser, Adrian; Gillhuber, Sebastian; Weigend, Florian; Ruben, Mario; Roesky, Peter W.
Introduction of plumbole to f-element chemistry
Chemical Science, 2022, 13, 945-954

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