Crystallography Open Database
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Searching journal of publication like 'The Journal of Physical Chemistry C' volume of publication is 122
| COD ID: 1554102 | |
| CIF file | Formula: - C26 H26 O4 - Comments: Ivanova, Lena V.; Wang, Denan; Lindeman, Sergey; Ivanov, Maxim V.; Rathore, Rajendra Probing Charge Delocalization in Solid State Polychromophoric Cation Radicals Using X-ray Crystallography and DFT Calculations The Journal of Physical Chemistry C 122(17) (2018) 9339 Space group: P n m a Cell volume: 2160.4 Cell parameters: 9.0071; 15.226; 15.753; 90; 90; 90; |
| COD ID: 1554103 | |
| CIF file | Formula: - C48 H44 Cl6 O4 Sb - Comments: Ivanova, Lena V.; Wang, Denan; Lindeman, Sergey; Ivanov, Maxim V.; Rathore, Rajendra Probing Charge Delocalization in Solid State Polychromophoric Cation Radicals Using X-ray Crystallography and DFT Calculations The Journal of Physical Chemistry C 122(17) (2018) 9339 Space group: P 1 21/c 1 Cell volume: 2150.9 Cell parameters: 8.0069; 15.6265; 17.2565; 90; 95.002; 90; |
| COD ID: 1554104 | |
| CIF file | Formula: - C26.77 H27.55 Cl7.55 O4 Sb - Comments: Ivanova, Lena V.; Wang, Denan; Lindeman, Sergey; Ivanov, Maxim V.; Rathore, Rajendra Probing Charge Delocalization in Solid State Polychromophoric Cation Radicals Using X-ray Crystallography and DFT Calculations The Journal of Physical Chemistry C 122(17) (2018) 9339 Space group: P 1 21/n 1 Cell volume: 9259 Cell parameters: 24.449; 15.41; 26.186; 90; 110.194; 90; |
| COD ID: 1554105 | |
| CIF file | Formula: - C24 H22 O2 - Comments: Ivanova, Lena V.; Wang, Denan; Lindeman, Sergey; Ivanov, Maxim V.; Rathore, Rajendra Probing Charge Delocalization in Solid State Polychromophoric Cation Radicals Using X-ray Crystallography and DFT Calculations The Journal of Physical Chemistry C 122(17) (2018) 9339 Space group: P 1 21/c 1 Cell volume: 1746.2 Cell parameters: 15.3874; 12.9063; 8.8; 90; 92.315; 90; |
| COD ID: 1554106 | |
| CIF file | Formula: - C38 H46 N2 - Comments: Más-Montoya, Miriam; Georgakopoulos, Stamatis; Cerón-Carrasco, José Pedro; Pérez, José; Tárraga, Alberto; Curiel, David Structure–Property Correlation behind the High Mobility of Carbazolocarbazole The Journal of Physical Chemistry C 122(22) (2018) 11736 Space group: P 1 21/c 1 Cell volume: 1485.58 Cell parameters: 17.9035; 4.6373; 17.9058; 90; 92.1361; 90; |
| COD ID: 1554107 | |
| CIF file | Formula: - C60 H62 Cl8 O8 - Comments: Ivanov, Maxim V.; Shukla, Ruchi; Lindeman, Sergey V.; Wang, Denan; Rathore, Rajendra Pyrene-Like HOMO Governs Polaron Delocalization in Model Graphitic Strips: A Combined Experimental and Computational Analysis The Journal of Physical Chemistry C 122(43) (2018) 24527 Space group: P -1 Cell volume: 1423.93 Cell parameters: 7.2423; 13.4771; 16.3116; 110.15; 97.962; 101.905; |
| COD ID: 1554108 | |
| CIF file | Formula: - C62 H66 Cl18 O8 Sb - Comments: Ivanov, Maxim V.; Shukla, Ruchi; Lindeman, Sergey V.; Wang, Denan; Rathore, Rajendra Pyrene-Like HOMO Governs Polaron Delocalization in Model Graphitic Strips: A Combined Experimental and Computational Analysis The Journal of Physical Chemistry C 122(43) (2018) 24527 Space group: P -1 Cell volume: 1779.7 Cell parameters: 9.8693; 13.3894; 14.5898; 102.43; 95.186; 106.663; |
| COD ID: 1554109 | |
| CIF file | Formula: - C48 H38 - Comments: Ivanov, Maxim V.; Shukla, Ruchi; Lindeman, Sergey V.; Wang, Denan; Rathore, Rajendra Pyrene-Like HOMO Governs Polaron Delocalization in Model Graphitic Strips: A Combined Experimental and Computational Analysis The Journal of Physical Chemistry C 122(43) (2018) 24527 Space group: C 1 2 1 Cell volume: 13117.2 Cell parameters: 31.8593; 8.0078; 51.818; 90; 97.15; 90; |
| COD ID: 1554110 | |
| CIF file | Formula: - C50 H42 Cl10 Sb - Comments: Ivanov, Maxim V.; Shukla, Ruchi; Lindeman, Sergey V.; Wang, Denan; Rathore, Rajendra Pyrene-Like HOMO Governs Polaron Delocalization in Model Graphitic Strips: A Combined Experimental and Computational Analysis The Journal of Physical Chemistry C 122(43) (2018) 24527 Space group: P -1 Cell volume: 1161.38 Cell parameters: 9.8602; 10.0886; 14.1215; 71.273; 74.028; 61.981; |
| COD ID: 1554111 | |
| CIF file | Formula: - C6 H7 N3 O S - Comments: Ding, Sheng; Lin, He; Yu, Yuming; Liu, Lang; Deng, Caiming; Zhao, Jianzhang; Jia, Dianzeng Molecular Orbital Delocalization/Localization-Induced Crystal-to-Crystal Photochromism of Schiff Bases without ortho-Hydroxyl Groups The Journal of Physical Chemistry C 122(43) (2018) 24933 Space group: P 1 21/c 1 Cell volume: 788.69 Cell parameters: 11.7088; 5.4866; 12.494; 90; 100.697; 90; |
| COD ID: 1554112 | |
| CIF file | Formula: - C6 H7 N3 O S - Comments: Ding, Sheng; Lin, He; Yu, Yuming; Liu, Lang; Deng, Caiming; Zhao, Jianzhang; Jia, Dianzeng Molecular Orbital Delocalization/Localization-Induced Crystal-to-Crystal Photochromism of Schiff Bases without ortho-Hydroxyl Groups The Journal of Physical Chemistry C 122(43) (2018) 24933 Space group: P 1 21/c 1 Cell volume: 783.3 Cell parameters: 11.708; 5.4645; 12.461; 90; 100.72; 90; |
| COD ID: 1554113 | |
| CIF file | Formula: - C6 H7 N3 S2 - Comments: Ding, Sheng; Lin, He; Yu, Yuming; Liu, Lang; Deng, Caiming; Zhao, Jianzhang; Jia, Dianzeng Molecular Orbital Delocalization/Localization-Induced Crystal-to-Crystal Photochromism of Schiff Bases without ortho-Hydroxyl Groups The Journal of Physical Chemistry C 122(43) (2018) 24933 Space group: P 1 21/n 1 Cell volume: 1679.5 Cell parameters: 13.571; 5.8222; 21.393; 90; 96.499; 90; |
| COD ID: 1554114 | |
| CIF file | Formula: - C6 H7 N3 S2 - Comments: Ding, Sheng; Lin, He; Yu, Yuming; Liu, Lang; Deng, Caiming; Zhao, Jianzhang; Jia, Dianzeng Molecular Orbital Delocalization/Localization-Induced Crystal-to-Crystal Photochromism of Schiff Bases without ortho-Hydroxyl Groups The Journal of Physical Chemistry C 122(43) (2018) 24933 Space group: P 1 21/n 1 Cell volume: 1703.6 Cell parameters: 13.676; 5.846; 21.421; 90; 95.877; 90; |
| COD ID: 1554115 | |
| CIF file | Formula: - C6 H7 N3 S2 - Comments: Ding, Sheng; Lin, He; Yu, Yuming; Liu, Lang; Deng, Caiming; Zhao, Jianzhang; Jia, Dianzeng Molecular Orbital Delocalization/Localization-Induced Crystal-to-Crystal Photochromism of Schiff Bases without ortho-Hydroxyl Groups The Journal of Physical Chemistry C 122(43) (2018) 24933 Space group: P 1 21/n 1 Cell volume: 1679.6 Cell parameters: 13.5702; 5.8215; 21.396; 90; 96.44; 90; |
| COD ID: 1554116 | |
| CIF file | Formula: - C34 H17 N5 S2 - Comments: Peng, Yu-Xin; Gan, Yi-Tao; Shi, Rong-Guang; Huang, Wei; Tao, Tao Construction of a Layered Hydrogen-Bonded Organic Framework Showing High-Contrast Mechanoresponsive Luminescence Turn-On The Journal of Physical Chemistry C 122(51) (2018) 29488 Space group: P -1 Cell volume: 1605.8 Cell parameters: 8.283; 12.815; 16.686; 67.954; 78.039; 84.714; |
| COD ID: 1554117 | |
| CIF file | Formula: - C45 H27 Cl3 N4 S - Comments: Peng, Yu-Xin; Gan, Yi-Tao; Shi, Rong-Guang; Huang, Wei; Tao, Tao Construction of a Layered Hydrogen-Bonded Organic Framework Showing High-Contrast Mechanoresponsive Luminescence Turn-On The Journal of Physical Chemistry C 122(51) (2018) 29488 Space group: P -1 Cell volume: 2001 Cell parameters: 10.649; 11.826; 17.306; 109.939; 100.431; 92.727; |
| COD ID: 1554118 | |
| CIF file | Formula: - C44 H26 N4 S - Comments: Peng, Yu-Xin; Gan, Yi-Tao; Shi, Rong-Guang; Huang, Wei; Tao, Tao Construction of a Layered Hydrogen-Bonded Organic Framework Showing High-Contrast Mechanoresponsive Luminescence Turn-On The Journal of Physical Chemistry C 122(51) (2018) 29488 Space group: P -1 Cell volume: 2169.7 Cell parameters: 10.498; 11.83; 18.204; 105.686; 91.636; 93.649; |
| COD ID: 1554119 | |
| CIF file | Formula: - C34 H17 N5 S2 - Comments: Peng, Yu-Xin; Gan, Yi-Tao; Shi, Rong-Guang; Huang, Wei; Tao, Tao Construction of a Layered Hydrogen-Bonded Organic Framework Showing High-Contrast Mechanoresponsive Luminescence Turn-On The Journal of Physical Chemistry C 122(51) (2018) 29488 Space group: P -1 Cell volume: 1616.5 Cell parameters: 8.248; 12.91; 16.731; 112.308; 97.811; 94.47; |
| COD ID: 1554120 | |
| CIF file | Formula: - C43 H36 N2 O2 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P 21 21 21 Cell volume: 3371.72 Cell parameters: 12.9552; 12.9939; 20.0294; 90; 90; 90; |
| COD ID: 1554121 | |
| CIF file | Formula: - C39 H32 N2 O2 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P 1 21/c 1 Cell volume: 2981.5 Cell parameters: 13.3299; 18.653; 12.4216; 90; 105.127; 90; |
| COD ID: 1554122 | |
| CIF file | Formula: - C39 H32 N2 O2 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P -1 Cell volume: 3039 Cell parameters: 12.4874; 13.7988; 18.8029; 76.4901; 75.159; 83.1146; |
| COD ID: 1554123 | |
| CIF file | Formula: - C41.7 H38.28 Cl0.12 N2 O2 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P b c a Cell volume: 6685.6 Cell parameters: 12.8953; 16.0322; 32.3384; 90; 90; 90; |
| COD ID: 1554124 | |
| CIF file | Formula: - C44 H38 Cl2 N2 O2 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P b c a Cell volume: 7145.2 Cell parameters: 16.8912; 11.396; 37.1194; 90; 90; 90; |
| COD ID: 1554125 | |
| CIF file | Formula: - C44 H38 Cl2 N2 O2 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P b c a Cell volume: 7215.1 Cell parameters: 16.9973; 11.406; 37.216; 90; 90; 90; |
| COD ID: 1554126 | |
| CIF file | Formula: - C46 H42 N2 O3 S - Comments: Kukhta, Nadzeya A.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Importance of Chromophore Rigidity on the Efficiency of Blue Thermally Activated Delayed Fluorescence Emitters The Journal of Physical Chemistry C 122(50) (2018) 28564 Space group: P 1 21/n 1 Cell volume: 3630 Cell parameters: 11.721; 11.304; 27.587; 90; 96.745; 90; |
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