Crystallography Open Database
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Searching journal of publication like 'Physical chemistry chemical physics : PCCP' volume of publication is 25
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7246773 | CIF | C7 H14 O6 | P 21 21 21 | 7.7218; 8.491; 13.0382 90; 90; 90 | 854.86 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246774 | CIF | C7 H16 O7 | P 21 21 21 | 6.105; 7.4158; 21.1354 90; 90; 90 | 956.87 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246775 | CIF | C7 H14 O6 | P 21 21 21 | 5.2396; 11.2244; 14.6702 90; 90; 90 | 862.77 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246776 | CIF | C7 H14 O6 | P 21 21 21 | 5.2406; 11.2187; 14.6715 90; 90; 90 | 862.58 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246777 | CIF | C14 H30 O13 | P 41 21 2 | 7.3491; 7.3491; 34.1307 90; 90; 90 | 1843.37 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246778 | CIF | C7 H15 O6.5 | P 41 21 2 | 7.3472; 7.3472; 34.1458 90; 90; 90 | 1843.24 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246779 | CIF | C7 H14 O6 | P 21 21 21 | 9.262; 9.3748; 9.9796 90; 90; 90 | 866.52 | Tetrault, Timothy; Meredith, Reagan J.; Yoon, Mi-Kyung; Canizares, Christopher; Oliver, Allen G.; Carmichael, Ian; Serianni, Anthony S. One-bond <sup>13</sup>C-<sup>13</sup>C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state <sup>13</sup>C NMR and X-ray crystallography. Physical chemistry chemical physics : PCCP, 2023, 25, 16048-16059 |
| 7246790 | CIF | C27 H23 Cu0.5 F3 N P1.5 | P -3 c 1 | 19.756; 19.756; 20.2456 90; 90; 120 | 6843.2 | Sanga, Masashi; Nakamura, Kosuke; Iwamura, Munetaka; Nozaki, Koichi; Takeda, Hiroyuki; Monma, Yu; Ishitani, Osamu Structural change dynamics of heteroleptic Cu(I) complexes observed by ultrafast emission spectroscopy. Physical chemistry chemical physics : PCCP, 2023, 25, 15873-15884 |
| 7246810 | CIF | C52 H48 Cd2 N4 O19 | P -1 | 10.116; 10.401; 13.707 92.118; 106.385; 116.737 | 1212.9 | Song, Xiaoming; Dong, Wenzhuo; Hou, Xiufang; Zhao, Qingxia; Zhang, Zhuangzhuang; Ren, Yixia The high fluorescence sensitivity property and quenching mechanism of one-dimensional Cd-HCIA-1 sensor for nitrobenzene. Physical chemistry chemical physics : PCCP, 2023, 25, 14907-14917 |
| 7246847 | CIF | C15 H21 Cl2 N3 O2 | P -1 | 7.0963; 9.7638; 12.7882 111.519; 96.992; 92.865 | 813.85 | Mojzych, Ilona; Zawadzka, Anna; Kaczyńska, Katarzyna; Wojciechowski, Piotr; Zając, Dominika; Chotkowski, Maciej; Wiktorska, Katarzyna; Maurin, Jan K.; Mazur, Maciej A tetrahydroacridine derivative and its conjugate with gold nanoparticles: promising agents for the treatment of Alzheimer's disease. Physical chemistry chemical physics : PCCP, 2023, 25, 16796-16806 |
| 7246848 | CIF | C48 H61 B F4 N2 O | P 1 21 1 | 17.0916; 17.0966; 17.6141 90; 118.3; 90 | 4531.8 | Jones, Rebecca L.; Morris, Louis J.; Collins Rice, Clement G.; Turner, Zoë R; O'Hare, Dermot Hydrogen-bonding and resonance stabilisation effects in cationic bis(iminium) phenoxide diacids. Physical chemistry chemical physics : PCCP, 2023, 25, 15463-15468 |
| 7246849 | CIF | C73.5 H54 B2 Cl3 F30 N3 O | P -1 | 14.6277; 16.6892; 17.0756 112.68; 96.2268; 105.711 | 3594.61 | Jones, Rebecca L.; Morris, Louis J.; Collins Rice, Clement G.; Turner, Zoë R; O'Hare, Dermot Hydrogen-bonding and resonance stabilisation effects in cationic bis(iminium) phenoxide diacids. Physical chemistry chemical physics : PCCP, 2023, 25, 15463-15468 |
| 7246850 | CIF | C28 H34 F3 Fe2 I N2 | P 21 21 21 | 5.7701; 11.1748; 42.916 90; 90; 90 | 2767.2 | Kreienborg, Nora M.; Otte, Felix; Strohmann, Carsten; Merten, Christian Simultaneous observation of halogen-lone pair and halogen-π interactions of ferrocene derivatives under cryogenic conditions. Physical chemistry chemical physics : PCCP, 2023, 25, 15110-15114 |
| 7246944 | CIF | C42 H26 N2 O4 | C 1 2/c 1 | 25.526; 5.3037; 23.743 90; 116.39; 90 | 2879.4 | Sosorev, Andrey Yu; Ponomarev, Igor I.; Dominskiy, Dmitry I.; Lyssenko, Konstantin A.; Parashchuk, Olga D.; Trukhanov, Vasily A.; Konstantinov, Vladislav G.; Dubinets, Nikita O.; Paraschuk, Dmitry Yu Structure and properties of naphthalene-diimide <i>N</i>-functionalized with stilbene. Physical chemistry chemical physics : PCCP, 2023, 25, 19562-19575 |
| 7246960 | CIF | C7 H5 N S | P 1 21/c 1 | 8.8648; 4.5145; 16.948 90; 97.83; 90 | 671.94 | Mandal, Koushik; Hasija, Avantika; Shukla, Rahul; Hathwar, Venkatesha R.; Chopra, Deepak Quantitative evaluation of the electronic features involving "nucleophilic-electrophilic" character in the chalcogen sulfur. Physical chemistry chemical physics : PCCP, 2023, 25, 19427-19434 |
| 7246961 | CIF | C5 H4 O S | P 1 21/n 1 | 7.23; 7.9881; 8.7762 90; 91.799; 90 | 506.61 | Mandal, Koushik; Hasija, Avantika; Shukla, Rahul; Hathwar, Venkatesha R.; Chopra, Deepak Quantitative evaluation of the electronic features involving "nucleophilic-electrophilic" character in the chalcogen sulfur. Physical chemistry chemical physics : PCCP, 2023, 25, 19427-19434 |
| 7246962 | CIF | C5 H4 O S | P 21 21 21 | 5.5255; 5.9089; 16.0342 90; 90; 90 | 523.511 | Mandal, Koushik; Hasija, Avantika; Shukla, Rahul; Hathwar, Venkatesha R.; Chopra, Deepak Quantitative evaluation of the electronic features involving "nucleophilic-electrophilic" character in the chalcogen sulfur. Physical chemistry chemical physics : PCCP, 2023, 25, 19427-19434 |
| 7246963 | CIF | C8 H4 F3 N S | P 1 21/c 1 | 13.2687; 7.8122; 8.0302 90; 91.369; 90 | 832.15 | Mandal, Koushik; Hasija, Avantika; Shukla, Rahul; Hathwar, Venkatesha R.; Chopra, Deepak Quantitative evaluation of the electronic features involving "nucleophilic-electrophilic" character in the chalcogen sulfur. Physical chemistry chemical physics : PCCP, 2023, 25, 19427-19434 |
| 7246964 | CIF | C5 H3 Br O S | P 1 21/c 1 | 4.1013; 8.5014; 17.1726 90; 90.856; 90 | 598.69 | Mandal, Koushik; Hasija, Avantika; Shukla, Rahul; Hathwar, Venkatesha R.; Chopra, Deepak Quantitative evaluation of the electronic features involving "nucleophilic-electrophilic" character in the chalcogen sulfur. Physical chemistry chemical physics : PCCP, 2023, 25, 19427-19434 |
| 7246973 | CIF | C228 H234 Ag10 Cu16 F24 O19 P4 S16 | P 1 21/n 1 | 18.3848; 34.2944; 18.6956 90; 96.282; 90 | 11716.7 | Sun, Xueli; Li, Simin; Tian, Guolong; Gao, Yanli; Wei, Jianyu; Shen, Hui Ag<sub>10</sub>Cu<sub>16</sub> nanoclusters with triple-ligand protection: total structure and electronic structure analysis. Physical chemistry chemical physics : PCCP, 2023, 25, 17901-17906 |
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