Crystallography Open Database
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Searching journal of publication like 'CrystEngComm' volume of publication is 28
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7251754 | CIF | C4 H18 Ag N O10 P2 | P 1 21/n 1 | 7.2368; 9.0908; 19.3367 90; 100.219; 90 | 1251.95 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251755 | CIF | C56 H66 N2 O15 P6 | P -1 | 9.4071; 9.7444; 14.7719 89.718; 88.312; 88.213 | 1352.83 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251756 | CIF | C25 H36 N O8 P3 | P -1 | 9.1001; 9.2541; 16.7568 80.04; 76.686; 81.909 | 1345 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251757 | CIF | C28 H44 N O13 P3 | P -1 | 10.0191; 11.5988; 15.451 75.289; 73.302; 82.836 | 1660.86 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251758 | CIF | C24 H40 N O11 P3 | P 1 21/c 1 | 17.3376; 9.8952; 18.6706 90; 116.585; 90 | 2864.45 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251759 | CIF | C23 H30 N O7 P3 | P 1 21/c 1 | 14.8268; 9.2012; 18.5019 90; 106.204; 90 | 2423.84 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251760 | CIF | C34 H53 N2 O16 P5 | P -1 | 9.5185; 13.6577; 17.1463 82.157; 74.606; 76.575 | 2083.67 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251761 | CIF | C24 H32 N O7 P3 | P -1 | 9.588; 9.6811; 13.9927 91.449; 99.36; 98.069 | 1267.32 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251762 | CIF | C31 H39 N2 O8 P3 | P 1 21/c 1 | 19.032; 9.189; 18.6815 90; 100.833; 90 | 3208.89 | Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C. Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations CrystEngComm, 2026, 28, 2151-2163 |
| 7251766 | CIF | C22 H20.55 B2 Cl2 Fe N10 O12.27 | C 1 2/c 1 | 22.6294; 9.8872; 15.745 90; 125.515; 90 | 2867.4 | Zhang, Minghui; Heinemann, Frank W.; Khusniyarov, Marat M. Spin-crossover iron(ii) complexes featuring boronic acid and boronic ester groups: synthesis and magnetic properties CrystEngComm, 2026, 28, 2355-2363 |
| 7251767 | CIF | C48 H76 B2 Cl2 Fe N10 O14 | P 1 21/n 1 | 16.4968; 18.4483; 20.7114 90; 91.181; 90 | 6301.9 | Zhang, Minghui; Heinemann, Frank W.; Khusniyarov, Marat M. Spin-crossover iron(ii) complexes featuring boronic acid and boronic ester groups: synthesis and magnetic properties CrystEngComm, 2026, 28, 2355-2363 |
| 7251768 | CIF | C24 H24 B2 Cl2 Fe N10 O12 | C 1 2/c 1 | 23.6479; 10.1118; 16.0253 90; 126.737; 90 | 3070.9 | Zhang, Minghui; Heinemann, Frank W.; Khusniyarov, Marat M. Spin-crossover iron(ii) complexes featuring boronic acid and boronic ester groups: synthesis and magnetic properties CrystEngComm, 2026, 28, 2355-2363 |
| 7251769 | CIF | C26 H28 B2 Cl2 Fe N10 O12 | C 1 2/c 1 | 25.4259; 10.095; 16.2659 90; 126.226; 90 | 3368 | Zhang, Minghui; Heinemann, Frank W.; Khusniyarov, Marat M. Spin-crossover iron(ii) complexes featuring boronic acid and boronic ester groups: synthesis and magnetic properties CrystEngComm, 2026, 28, 2355-2363 |
| 7251777 | CIF | C114 H60 N6 S36 Zn10 | P -1 | 20.8124; 24.2224; 31.0731 112.136; 92.155; 91.899 | 14480.9 | Qin, Haihan; Hu, Jieying; Li, Jian-Rong; Jiang, Long; Chung, Lai-Hon; He, Jun From 3-fold to 6-fold: tuning interpenetration of Zn-triphenylenehexathiolate MOF through precursor hydration CrystEngComm, 2026, 28, 2305-2310 |
| 7251778 | CIF | C32 H40 S2 | P -1 | 5.7241; 11.0388; 11.8971 116.814; 95.59; 92.275 | 664.76 | Watanabe, Makoto; Miyashita, Masato; Fukuda, Takashi; Oku, Shinya Synthesis of 2,7-dioctylbiphenylenodithiophenes for use as organic semiconducting materials in solution-processed organic thin-film transistors CrystEngComm, 2026, 28, 2234-2242 |
| 7251779 | CIF | C32 H40 S2 | I 1 2/a 1 | 10.9056; 4.7333; 52.478 90; 93.015; 90 | 2705.14 | Watanabe, Makoto; Miyashita, Masato; Fukuda, Takashi; Oku, Shinya Synthesis of 2,7-dioctylbiphenylenodithiophenes for use as organic semiconducting materials in solution-processed organic thin-film transistors CrystEngComm, 2026, 28, 2234-2242 |
| 7251788 | CIF | C32 H23 O P | P 1 21/n 1 | 9.66347; 27.2681; 9.86176 90; 115.374; 90 | 2347.93 | Konno, Ryunosuke; Fujita, Manami; Maekawa, Rima; Masu, Hyuma; Katagiri, Kosuke Preparation of phosphine oxides with anthrylphenyl, pyrenylphenyl, anthrylethynyl, and pyrenylethynyl groups: luminescence properties and conformational polymorphs CrystEngComm, 2026, 28, 2455-2467 |
| 7251789 | CIF | C28 H19 O P | P 1 21/c 1 | 9.88921; 23.15594; 8.93733 90; 92.3493; 90 | 2044.87 | Konno, Ryunosuke; Fujita, Manami; Maekawa, Rima; Masu, Hyuma; Katagiri, Kosuke Preparation of phosphine oxides with anthrylphenyl, pyrenylphenyl, anthrylethynyl, and pyrenylethynyl groups: luminescence properties and conformational polymorphs CrystEngComm, 2026, 28, 2455-2467 |
| 7251790 | CIF | C30 H19 O P | P 1 21/c 1 | 9.90452; 19.8613; 11.16039 90; 100.325; 90 | 2159.89 | Konno, Ryunosuke; Fujita, Manami; Maekawa, Rima; Masu, Hyuma; Katagiri, Kosuke Preparation of phosphine oxides with anthrylphenyl, pyrenylphenyl, anthrylethynyl, and pyrenylethynyl groups: luminescence properties and conformational polymorphs CrystEngComm, 2026, 28, 2455-2467 |
| 7251791 | CIF | C30 H19 O P | P 1 21/c 1 | 8.70743; 11.37805; 21.6228 90; 95.787; 90 | 2131.33 | Konno, Ryunosuke; Fujita, Manami; Maekawa, Rima; Masu, Hyuma; Katagiri, Kosuke Preparation of phosphine oxides with anthrylphenyl, pyrenylphenyl, anthrylethynyl, and pyrenylethynyl groups: luminescence properties and conformational polymorphs CrystEngComm, 2026, 28, 2455-2467 |
| 7251792 | CIF | C28 H19 O P | P -1 | 9.8161; 10.1226; 11.6958 109.508; 99.186; 93.455 | 1073.3 | Konno, Ryunosuke; Fujita, Manami; Maekawa, Rima; Masu, Hyuma; Katagiri, Kosuke Preparation of phosphine oxides with anthrylphenyl, pyrenylphenyl, anthrylethynyl, and pyrenylethynyl groups: luminescence properties and conformational polymorphs CrystEngComm, 2026, 28, 2455-2467 |
| 7251793 | CIF | C34 H23 O P | P 1 21/c 1 | 17.2834; 9.4529; 14.7171 90; 99.788; 90 | 2369.45 | Konno, Ryunosuke; Fujita, Manami; Maekawa, Rima; Masu, Hyuma; Katagiri, Kosuke Preparation of phosphine oxides with anthrylphenyl, pyrenylphenyl, anthrylethynyl, and pyrenylethynyl groups: luminescence properties and conformational polymorphs CrystEngComm, 2026, 28, 2455-2467 |
| 7251795 | CIF | C2 H6 Cd O7 | P -1 | 6.00275; 6.65883; 8.48721 74.6832; 74.3039; 81.0102 | 313.677 | Ahmed, Azaz; Ahmad, Musheer; Thakur, Chandrakant; Kumar, Astakala Anil; Lee, Nohyun; Haq, Nazrul; Siddiqui, Kafeel Ahmad NiS2-integrated Cd-oxalate MOF: a multifunctional platform for selective 2,4-D amine sensing and efficient NR/EBT photodegradation CrystEngComm, 2026, 28, 2333-2354 |
| 7251797 | CIF | C48 H48 N8 O16 Ti4 | P 1 21/n 1 | 12.1789; 34.017; 13.7034 90; 106.976; 90 | 5429.8 | Wang, Qi; Li, Haoran; Jin, Xinuo; Gao, Wendi; Peng, Hui; Cai, Yuqing; Zi, Wenwen; Yin, Wenyu; Hou, Jinle; Sun, Di A family of 2,8-quinolinediol-functionalized titanium-oxo clusters with tunable photoelectric properties CrystEngComm, 2026, 28, 2373-2381 |
| 7251798 | CIF | C45 H95 N O24 Ti7 | P -1 | 11.8028; 14.1791; 21.4908 101.187; 99.125; 97.103 | 3439 | Wang, Qi; Li, Haoran; Jin, Xinuo; Gao, Wendi; Peng, Hui; Cai, Yuqing; Zi, Wenwen; Yin, Wenyu; Hou, Jinle; Sun, Di A family of 2,8-quinolinediol-functionalized titanium-oxo clusters with tunable photoelectric properties CrystEngComm, 2026, 28, 2373-2381 |
| 7251799 | CIF | C44 H44 N4 O18 Ti5 | P -1 | 12.2092; 14.93; 14.963 88.874; 70.367; 72.202 | 2435.5 | Wang, Qi; Li, Haoran; Jin, Xinuo; Gao, Wendi; Peng, Hui; Cai, Yuqing; Zi, Wenwen; Yin, Wenyu; Hou, Jinle; Sun, Di A family of 2,8-quinolinediol-functionalized titanium-oxo clusters with tunable photoelectric properties CrystEngComm, 2026, 28, 2373-2381 |
| 7251800 | CIF | C18 H14 F3 I3 N4 O4 Pd | C 1 2/c 1 | 4.2749; 17.9506; 30.5282 90; 90.086; 90 | 2342.64 | Abulkhaev, Jacob U.; Semenov, Artem V.; Ivanov, Daniil M.; Ignatov, Eugene V.; Baykov, Sergey V.; Bokach, Nadezhda A. Palladium(ii) complexes of 5-acetylmethyl-1,2,4-oxadiazole: versatile ditopic acceptors for halogen bonding CrystEngComm, 2026, 28, 2443-2454 |
| 7251801 | CIF | C28 H18 F4 I2 N4 O4 Pd | P -1 | 6.0196; 10.5726; 11.3896 80.628; 88.278; 76.719 | 696.04 | Abulkhaev, Jacob U.; Semenov, Artem V.; Ivanov, Daniil M.; Ignatov, Eugene V.; Baykov, Sergey V.; Bokach, Nadezhda A. Palladium(ii) complexes of 5-acetylmethyl-1,2,4-oxadiazole: versatile ditopic acceptors for halogen bonding CrystEngComm, 2026, 28, 2443-2454 |
| 7251802 | CIF | C20 H18 F4 I2 N4 O4 Pd | P -1 | 5.2758; 10.394; 11.6124 89.207; 78.929; 75.569 | 604.83 | Abulkhaev, Jacob U.; Semenov, Artem V.; Ivanov, Daniil M.; Ignatov, Eugene V.; Baykov, Sergey V.; Bokach, Nadezhda A. Palladium(ii) complexes of 5-acetylmethyl-1,2,4-oxadiazole: versatile ditopic acceptors for halogen bonding CrystEngComm, 2026, 28, 2443-2454 |
| 7251803 | CIF | C20 H24 Cl2 F4 N6 O8 Zr | P -3 c 1 | 23.2456; 23.2456; 16.2338 90; 90; 120 | 7596.8 | Liu, Yuxin; Shao, Zhen-Wu; Duan, Xiangping; Xiong, Chaozhi; Li, Xiaoting; Liu, Chong Substituent effects in the crystallization of Zr-hydroxamate metal–organic frameworks CrystEngComm, 2026, 28, 2120-2124 |
| 7251804 | CIF | C32 H16 Br8 N8 O16 Zr2 | I 4/m c m | 16.505; 16.505; 15.103 90; 90; 90 | 4114 | Liu, Yuxin; Shao, Zhen-Wu; Duan, Xiangping; Xiong, Chaozhi; Li, Xiaoting; Liu, Chong Substituent effects in the crystallization of Zr-hydroxamate metal–organic frameworks CrystEngComm, 2026, 28, 2120-2124 |
| 7251805 | CIF | C22 H22 Cl6 N6 O10 Zr | I b a m | 15.3299; 17.5645; 14.9948 90; 90; 90 | 4037.5 | Liu, Yuxin; Shao, Zhen-Wu; Duan, Xiangping; Xiong, Chaozhi; Li, Xiaoting; Liu, Chong Substituent effects in the crystallization of Zr-hydroxamate metal–organic frameworks CrystEngComm, 2026, 28, 2120-2124 |
| 7251806 | CIF | C21 H18 N6 O5 S | P -1 | 8.1244; 10.3705; 26.277 80.405; 86.616; 88.202 | 2178.6 | Danks, Jacob; Rainer, Daniel N.; Hamza, Ahmed S.; Coles, Simon J.; Carter, Anthony B.; Benson, Joseph E. G. High-throughput co-former screening and structural elucidation using resonant acoustic mixing and 3D electron diffraction CrystEngComm, 2026, 28, 2018-2022 |
| 7251807 | CIF | C23 H20 N6 O5 S | P 1 2/n 1 | 19.4997; 6.2871; 19.695 90; 106.129; 90 | 2319.5 | Danks, Jacob; Rainer, Daniel N.; Hamza, Ahmed S.; Coles, Simon J.; Carter, Anthony B.; Benson, Joseph E. G. High-throughput co-former screening and structural elucidation using resonant acoustic mixing and 3D electron diffraction CrystEngComm, 2026, 28, 2018-2022 |
| 7251808 | CIF | C24 H42 N2 O8 | P 1 | 6.90572; 7.69426; 12.1634 86.3588; 88.5344; 88.8594 | 644.67 | Ren, Jiaxuan; Wu, Di; Feng, Yaoguang; Zhang, Man; Yuan, Jiahui; Wang, Na; Wang, Ting; Huang, Xin; Hao, Hongxun Synthesis, characterization and structure–activity relationship of novel pregabalin cocrystals with sustained-release performance CrystEngComm, 2026, 28, 2815-2834 |
| 7251809 | CIF | C17 H25 N O4 | P 21 21 21 | 6.3748; 7.7152; 34.3678 90; 90; 90 | 1690.31 | Ren, Jiaxuan; Wu, Di; Feng, Yaoguang; Zhang, Man; Yuan, Jiahui; Wang, Na; Wang, Ting; Huang, Xin; Hao, Hongxun Synthesis, characterization and structure–activity relationship of novel pregabalin cocrystals with sustained-release performance CrystEngComm, 2026, 28, 2815-2834 |
| 7251810 | CIF | C16 H25 N O4 | P 21 21 21 | 6.54204; 7.72068; 31.8964 90; 90; 90 | 1611.06 | Ren, Jiaxuan; Wu, Di; Feng, Yaoguang; Zhang, Man; Yuan, Jiahui; Wang, Na; Wang, Ting; Huang, Xin; Hao, Hongxun Synthesis, characterization and structure–activity relationship of novel pregabalin cocrystals with sustained-release performance CrystEngComm, 2026, 28, 2815-2834 |
| 7251811 | CIF | C18 H18 Cl N O4 S | P 1 21/n 1 | 5.614; 20.5904; 15.3143 90; 91.119; 90 | 1769.9 | Saha, Agantuk; Sunanda,; Choudhury, Angshuman Roy Synthesis and structural characterization of novel salts of ticlopidine with enhanced solubility and dissolution rate CrystEngComm, 2026, 28, 3046-3055 |
| 7251812 | CIF | C22 H22 Cl N O3 S | P 1 21/c 1 | 12.294; 17.3974; 10.2345 90; 104.138; 90 | 2122.7 | Saha, Agantuk; Sunanda,; Choudhury, Angshuman Roy Synthesis and structural characterization of novel salts of ticlopidine with enhanced solubility and dissolution rate CrystEngComm, 2026, 28, 3046-3055 |
| 7251815 | CIF | C15 H18 In N4 O8 | P -1 | 6.7775; 9.2688; 15.8288 104.947; 101.677; 93.152 | 934.77 | Yang, Changmeng; Bai, Yingxiang; Shen, Ruwei; Zhu, Dunru Atom orientation in SBU-induced conformational isomerism in hydroxamate-based In-MOFs CrystEngComm, 2026, 28, 2927-2936 |
| 7251816 | CIF | C16 H16 In N5 O8 | C 1 2/c 1 | 10.9343; 14.2921; 12.3625 90; 107.711; 90 | 1840.37 | Yang, Changmeng; Bai, Yingxiang; Shen, Ruwei; Zhu, Dunru Atom orientation in SBU-induced conformational isomerism in hydroxamate-based In-MOFs CrystEngComm, 2026, 28, 2927-2936 |
| 7251817 | CIF | C12 H17 In N3 O10 | P -1 | 7.085; 11.276; 14.66 69.137; 80.529; 89.638 | 1077.7 | Yang, Changmeng; Bai, Yingxiang; Shen, Ruwei; Zhu, Dunru Atom orientation in SBU-induced conformational isomerism in hydroxamate-based In-MOFs CrystEngComm, 2026, 28, 2927-2936 |
| 7251818 | CIF | C17 H20 N4 O5 | P 1 21/n 1 | 16.736; 4.91439; 21.9254 90; 98.24; 90 | 1784.69 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251819 | CIF | C29 H37 N7 O8 | P 1 21/n 1 | 20.1578; 4.90086; 32.5043 90; 90.875; 90 | 3210.74 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251820 | CIF | C17 H20 N4 O5 | C 1 2/c 1 | 24.8829; 6.1032; 23.3288 90; 100.391; 90 | 3484.7 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251821 | CIF | C15 H16 N4 O5 | P 1 21/n 1 | 12.5882; 5.1749; 23.3666 90; 91.8814; 90 | 1521.34 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251822 | CIF | C20 H26 N4 O5 | P -1 | 6.42159; 12.65205; 13.02701 76.6124; 75.8298; 80.7872 | 992.29 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251823 | CIF | C17 H20 N4 O5 | P -1 | 6.15171; 12.3495; 12.6749 73.875; 79.965; 76.405 | 892.97 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251824 | CIF | C16 H18 N4 O5 | P -1 | 5.8059; 11.8005; 12.9057 73.991; 78.882; 78.277 | 823.35 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
| 7251825 | CIF | C18 H22 N4 O5 | P -1 | 6.21761; 12.5048; 12.7578 79.345; 78.28; 80.4467 | 945.96 | Marasinghe, Aloka A.; Averkiev, Boris B.; Aakeröy, Christer B. Modulating some photophysical properties of cocrystals CrystEngComm, 2026, 28, 2548-2559 |
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