Crystallography Open Database

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1562366 CIFC40.5 H34 F6 N7 O4.5 P RuP 1 21/c 18.431; 35.524; 13.404
90; 99.315; 90
3962Shiga, Takuya; Tachibana, Minami; Oshio, Hiroki; Nihei, Masayuki
Synthesis of a Ru(II) Complex with a Naphthoquinone-Annelated Imidazole Ligand Exhibiting Proton-Responsive Redox and Luminescent Behavior
Inorganics, 2021, 9, 24
1563173 CIFC16 H22 Cl2 N4 RuP 1 21/n 19.3972; 17.3629; 12.9511
90; 97.019; 90
2097.3Matveevskaya, Vladislava V.; Pavlov, Dmitry I.; Samsonenko, Denis G.; Ermakova, Ekaterina A.; Klyushova, Lyubov S.; Baykov, Sergey V.; Boyarskiy, Vadim P.; Potapov, Andrei S.
Synthesis and Structural Characterization of Half-Sandwich Arene‒Ruthenium(II) Complexes with Bis(imidazol-1-yl)methane, Imidazole and Benzimidazole
Inorganics, 2021, 9, 34
1563174 CIFC36 H52 Cl4 N8 O2 Ru2P 1 21/c 111.7136; 10.34; 17.0882
90; 101.06; 90
2031.26Matveevskaya, Vladislava V.; Pavlov, Dmitry I.; Samsonenko, Denis G.; Ermakova, Ekaterina A.; Klyushova, Lyubov S.; Baykov, Sergey V.; Boyarskiy, Vadim P.; Potapov, Andrei S.
Synthesis and Structural Characterization of Half-Sandwich Arene‒Ruthenium(II) Complexes with Bis(imidazol-1-yl)methane, Imidazole and Benzimidazole
Inorganics, 2021, 9, 34
1563175 CIFC17 H20 Cl2 N2 RuP n a 216.832; 18.2051; 13.6361
90; 90; 90
1696.02Matveevskaya, Vladislava V.; Pavlov, Dmitry I.; Samsonenko, Denis G.; Ermakova, Ekaterina A.; Klyushova, Lyubov S.; Baykov, Sergey V.; Boyarskiy, Vadim P.; Potapov, Andrei S.
Synthesis and Structural Characterization of Half-Sandwich Arene‒Ruthenium(II) Complexes with Bis(imidazol-1-yl)methane, Imidazole and Benzimidazole
Inorganics, 2021, 9, 34
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
1564545 CIFC19 H24 N3 O7 VP -110.8226; 10.9399; 17.3389
79.412; 78.905; 86.861
1979.82Sahu, Gurunath; Tiekink, Edward R. T.; Dinda, Rupam
Study of DNA Interaction and Cytotoxicity Activity of Oxidovanadium(V) Complexes with ONO Donor Schiff Base Ligands
Inorganics, 2021, 9, 66
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
1564848 CIFC17 H22 Cu N4 O10 S2C m c 2123.4161; 13.2985; 7.2391
90; 90; 90
2254.25Toikka, Yulia N.; Spiridonova, Dar’ya V.; Novikov, Alexander S.; Bokach, Nadezhda A.
Copper(II) Prevents the Saccarine-Dialkylcyanamide Coupling by Forming Mononuclear (Saccharinate)(Dialkylcyanamide)copper(II) Complexes
Inorganics, 2021, 9, 69
1564849 CIFC22 H24 Cu N2 O8 S2I 1 2/a 111.5109; 21.0713; 20.3473
90; 98.719; 90
4878.2Toikka, Yulia N.; Spiridonova, Dar’ya V.; Novikov, Alexander S.; Bokach, Nadezhda A.
Copper(II) Prevents the Saccarine-Dialkylcyanamide Coupling by Forming Mononuclear (Saccharinate)(Dialkylcyanamide)copper(II) Complexes
Inorganics, 2021, 9, 69
1564850 CIFC14 H20 Cu N2 O12 S2P 1 21/c 18.3226; 16.3127; 7.228
90; 100.912; 90
963.56Toikka, Yulia N.; Spiridonova, Dar’ya V.; Novikov, Alexander S.; Bokach, Nadezhda A.
Copper(II) Prevents the Saccarine-Dialkylcyanamide Coupling by Forming Mononuclear (Saccharinate)(Dialkylcyanamide)copper(II) Complexes
Inorganics, 2021, 9, 69
1564851 CIFC17 H18 Cu N4 O8 S2P n m a7.141; 23.8599; 12.48922
90; 90; 90
2127.96Toikka, Yulia N.; Spiridonova, Dar’ya V.; Novikov, Alexander S.; Bokach, Nadezhda A.
Copper(II) Prevents the Saccarine-Dialkylcyanamide Coupling by Forming Mononuclear (Saccharinate)(Dialkylcyanamide)copper(II) Complexes
Inorganics, 2021, 9, 69
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
1565099 CIFBi0.875 Cr0.875 O3 Pb0.125 V0.125C 1 2/c 19.531; 5.495; 9.53
90; 108.848; 90
472.4Yamamoto, H.; Aizawa, H.; Yamada, I.; Toda, K.; Tanaka, A.; Azuma, M.; Sakai, Y.; Nishikubo, T.; Kimura, H.
Crystal structures and electronic states of high-pressure synthesized (1-x)PbVO3-xBiCrO3 solid solutions : 7/8BiCrO3-1/8PbVO3 monoclinic phase at room temperature
Journal of Asian Ceramic Societies, 2021, 9, 1147-1153
1565100 CIFBi0.125 Cr0.125 O3 Pb0.875 V0.875P m -3 m3.9387; 3.9387; 3.9387
90; 90; 90
61.102Yamamoto, H.; Aizawa, H.; Yamada, I.; Toda, K.; Tanaka, A.; Azuma, M.; Sakai, Y.; Nishikubo, T.; Kimura, H.
Crystal structures and electronic states of high-pressure synthesized (1-x)PbVO3-xBiCrO3 solid solutions : 7/8PbVO3-1/8BiCrO3 cubic phase at 700 C
Journal of Asian Ceramic Societies, 2021, 9, 1147-1153
1565101 CIFBi0.125 Cr0.125 O3 Pb0.875 V0.875P 4 m m3.8484; 3.8484; 4.48551
90; 90; 90
66.431Yamamoto, H.; Aizawa, H.; Yamada, I.; Toda, K.; Tanaka, A.; Azuma, M.; Sakai, Y.; Nishikubo, T.; Kimura, H.
Crystal structures and electronic states of high-pressure synthesized (1-x)PbVO3-xBiCrO3 solid solutions : 7/8PbVO3-1/8BiCrO3 tetragonal phase at 700 C
Journal of Asian Ceramic Societies, 2021, 9, 1147-1153
1565102 CIFBi0.125 Cr0.125 O3 Pb0.875 V0.875P 4 m m3.83568; 3.83568; 4.449
90; 90; 90
65.4557Yamamoto, H.; Aizawa, H.; Yamada, I.; Toda, K.; Tanaka, A.; Azuma, M.; Sakai, Y.; Nishikubo, T.; Kimura, H.
Crystal structures and electronic states of high-pressure synthesized (1-x)PbVO3-xBiCrO3 solid solutions : 7/8PbVO3-1/8BiCrO3 tetragonal phase at room temperature
Journal of Asian Ceramic Societies, 2021, 9, 1147-1153
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
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
1565826 CIFK2 Mg2 O12 S3P 21 39.91895; 9.91895; 9.91895
90; 90; 90
975.882Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof
Tracing electron density changes in langbeinite under pressure
IUCrJ, 2022, 9, 146-162
1565827 CIFK2 Mg2 O12 S3P 21 39.91895; 9.91895; 9.91895
90; 90; 90
975.882Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof
Tracing electron density changes in langbeinite under pressure
IUCrJ, 2022, 9, 146-162
1565828 CIFK2 Mg2 O12 S3P 21 39.91977; 9.91977; 9.91977
90; 90; 90
976.124Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof
Tracing electron density changes in langbeinite under pressure
IUCrJ, 2022, 9, 146-162
1565829 CIFK2 Mg2 O12 S3P 21 39.91977; 9.91977; 9.91977
90; 90; 90
976.124Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof
Tracing electron density changes in langbeinite under pressure
IUCrJ, 2022, 9, 146-162
1565830 CIFK2 Mg2 O12 S3P 21 39.9045; 9.9045; 9.9045
90; 90; 90
971.623Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof
Tracing electron density changes in langbeinite under pressure
IUCrJ, 2022, 9, 146-162
1565831 CIFK2 Mg2 O12 S3P 21 39.9045; 9.9045; 9.9045
90; 90; 90
971.623Gajda, Roman; Zhang, Dongzhou; Parafiniuk, Jan; Dera, Przemysław; Woźniak, Krzysztof
Tracing electron density changes in langbeinite under pressure
IUCrJ, 2022, 9, 146-162
1565832 CIFC30 H14 N4 S2P -17.3775; 9.3783; 9.4318
61.214; 89.717; 73.611
542Jiang, Hui; Ye, Jun; Hu, Peng; Zhu, Shengli; Liang, Yanqin; Cui, Zhenduo; Kloc, Christian; Hu, Wenping
Growth direction dependent separate-channel charge transport in the organic weak charge-transfer co-crystal of anthracene-DTTCNQ.
Materials horizons, 2022, 9, 1057-1067
1565846 CIF
Paper
C54 H58 Cl3 O11 RbP -113.44; 14.3933; 14.8036
84.073; 76.728; 62.777
2478.47Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung; Park, In-Hyeok
Regioisomers of singly bridged calix[6]crown-6 and their heavy alkali metal complexes: a molecular baseball glove for caesium(I)
IUCrJ, 2022, 9, 43-48
1565847 CIFC55 H53 Cl9 Cs O10P 1 21/n 113.1773; 20.344; 22.581
90; 106.172; 90
5814Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung; Park, In-Hyeok
Regioisomers of singly bridged calix[6]crown-6 and their heavy alkali metal complexes: a molecular baseball glove for caesium(I)
IUCrJ, 2022, 9, 43-48
1565848 CIFC53 H55 Cl3 Cs2 O11P 1 21/c 113.166; 31.338; 14.278
90; 117.28; 90
5236Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung; Park, In-Hyeok
Regioisomers of singly bridged calix[6]crown-6 and their heavy alkali metal complexes: a molecular baseball glove for caesium(I)
IUCrJ, 2022, 9, 43-48
1565849 CIF
Paper
Cu H10 O9 SP -15.9523; 6.1001; 10.647
77.308; 82.353; 72.64
359.02Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J.
Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate
IUCrJ, 2022, 9, 73-85
1565850 CIFCu H10 O9 SP -15.9523; 6.1001; 10.647
77.308; 82.353; 72.64
359.02Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J.
Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate
IUCrJ, 2022, 9, 73-85
1565851 CIFCu H10 O9 SP -15.9523; 6.1001; 10.647
77.308; 82.353; 72.64
359.016Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J.
Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate
IUCrJ, 2022, 9, 73-85
1565852 CIFCu H10 O9 SP -15.9523; 6.1001; 10.647
77.308; 82.353; 72.64
359.016Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J.
Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate
IUCrJ, 2022, 9, 73-85
1565853 CIF
Paper
C73 H100 O6P 1 21/c 116.252; 23.5373; 17.2102
90; 101.773; 90
6444.9Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565854 CIF
Paper
C66 H84 O6P -19.59; 18.199; 18.547
114.31; 91.36; 91.7
2946Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565855 CIF
Paper
C70 H92 Cl8 O6P -113.8727; 16.0717; 17.6177
77.127; 66.915; 76.404
3474.5Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565856 CIF
Paper
C68 H88 Cl4 O6P -112.261; 17.2425; 17.417
118.625; 92.647; 98.062
3172.8Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565857 CIF
Paper
C84 H102 O6P -113.5391; 14.7702; 19.045
80.68; 72.393; 78.191
3532.8Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565858 CIF
Paper
C69 H90 Cl6 O6P 1 21/c 117.8792; 19.6559; 18.9669
90; 96.732; 90
6619.6Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565859 CIF
Paper
C72 H96 O6P 1 21/n 117.2109; 18.2986; 19.6172
90; 94.521; 90
6158.9Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565860 CIF
Paper
C73 H92 O6P 1 21/n 117.1817; 18.7393; 19.4157
90; 95.843; 90
6218.9Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64
1565861 CIF
Paper
C69 H90 O8P 1 21/n 117.0366; 18.4996; 19.762
90; 94.288; 90
6210.96Malinska, Maura
Insights into molecular recognition from the crystal structures of <i>p-tert</i>-butylcalix[6]arene complexed with different solvents
IUCrJ, 2022, 9, 55-64

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