Crystallography Open Database
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Searching journal of publication like 'Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials' volume of publication is 77
COD ID ![]() |
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Cell parameters | Cell volume ![]() |
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2108781 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.0108; 8.627; 8.263 90; 90; 90 | 571 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
2108782 | CIF HKL | C5 H12 O5 | P 21 21 21 | 7.9846; 8.6043; 8.179 90; 90; 90 | 561.9 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
2108783 | CIF HKL Paper | C14 H16 N2 O8 Zn | P -1 | 7.2924; 7.445; 8.0936 97.966; 103.385; 115.659 | 370.76 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
2108784 | CIF HKL Paper | C16 H18 N2 O7 Zn | P -1 | 8.2959; 10.1989; 10.3466 70.187; 82.585; 79.659 | 808.01 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
2108785 | CIF HKL Paper | C16 H22 N2 O9 Zn | C 1 2/c 1 | 10.8962; 10.3334; 16.6916 90; 108.435; 90 | 1782.94 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
2108786 | CIF HKL Paper | C28 H36 N4 O18 Zn2 | P -1 | 7.9237; 8.574; 12.3954 84.248; 74.706; 85.908 | 807.32 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
2108787 | CIF HKL Paper | C72 H52 Fe2 N22 O2 | P 1 21/c 1 | 18.1614; 22.1885; 17.1716 90; 110.894; 90 | 6464.7 | Cvrtila, Ivica; Stilinović, Vladimir Polymorphs of phenazine hexacyanoferrate(II) hydrate: supramolecular isomerism in a 2D hydrogen-bonded network Acta Crystallographica Section B, 2021, 77 |
2108788 | CIF HKL Paper | C72 H52 Fe2 N22 O2 | P -1 | 14.2252; 16.1364; 16.2813 89.859; 67.664; 68.977 | 3187.7 | Cvrtila, Ivica; Stilinović, Vladimir Polymorphs of phenazine hexacyanoferrate(II) hydrate: supramolecular isomerism in a 2D hydrogen-bonded network Acta Crystallographica Section B, 2021, 77 |
2108789 | CIF HKL | Al3 Na6 O20 P5 | C 1 2/c 1 | 18.631; 37.41; 9.272 90; 90.063; 90 | 6462 | Yakubovich, Olga V.; Kiriukhina, Galina V.; Volkov, Anatoliy S.; Dimitrova, Olga V.; Borovikova, Elena Yu. Novel aluminophosphate Na~6~[Al~3~P~5~O~20~] with the original microporous crystal structure established in the study of a pseudomerohedric microtwin Acta Crystallographica Section B, 2021, 77 |
2108790 | CIF HKL | C3 H17 Al N2 O14 S2 | P 1 2/a 1 | 12.0026; 6.7859; 9.1005 90; 88.835; 90 | 741.07 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
2108791 | CIF HKL | C3 H17 Al N2 O14 S2 | P -3 m 1 | 6.8748; 6.8748; 9.155 90; 90; 120 | 374.72 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
2108792 | CIF HKL | C3 H17 Al N2 O14 S2 | P -3 m 1 | 6.868; 6.868; 9.1617 90; 90; 120 | 374.25 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
2108793 | CIF HKL | C16 H19 N3 O2 | P 21 21 21 | 7.7498; 11.794; 17.2849 90; 90; 90 | 1579.86 | Meenatchi, Venkatasamy; Subramanian Siva; Meenakshisundaram, SP; Cheng, Liang Synthesis, crystal growth, characterization and DFT investigation of a nonlinear optically active cuminaldehyde derivative hydrazone Acta Crystallographica Section B, 2021, 77 |
2108794 | CIF HKL Paper | C12 H14 Cu N5 O3 S | P 21 21 21 | 7.905; 12.723; 14.678 90; 90; 90 | 1476.2 | Kowalska, Dorota A.; Kinzhybalo, Vasyl; Slyvka, Yuriy I.; Wołcyrz, Marek Crystal structure and enantiomeric layer disorder of a copper(I) nitrate π-coordination compound Acta Crystallographica Section B, 2021, 77 |
2108795 | CIF HKL | Ba0.08 Ca0.16 Fe0.38 K0.36 Mg0.1 Mn0.18 Na2.77 O18 Si4 Sr1.45 Ti2.52 | C 1 2/m 1 | 19.405; 7.0885; 5.3988 90; 96.739; 90 | 737.49 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
2108796 | CIF HKL | Ba0.87 Ca0.17 Fe0.36 K0.45 Mg0.08 Mn0.24 Na2.46 O18 Si4 Sr0.51 Ti2.86 | C 1 2/m 1 | 19.769; 7.1076; 5.4065 90; 96.731; 90 | 754.43 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
2108797 | CIF HKL | Ba0 Ca0.15 Fe0.13 K0.09 Mg0.05 Mn0.35 Na2.8 O18 Si4 Sr1.5 Ti2.82 | C 1 2/m 1 | 19.2231; 7.0832; 5.3907 90; 96.859; 90 | 728.75 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
2108798 | CIF HKL | Ba1.15 Ca0.17 Fe0.53 K0.41 Mg0.12 Mn0.12 Na2.7 O18 Si4 Sr0.27 Ti2.53 | C 1 2/m 1 | 19.8574; 7.1034; 5.4063 90; 96.611; 90 | 757.52 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
2108799 | CIF HKL | Ba0.05 Ca0.09 Fe0.46 K0.1 Mg0.17 Mn0.17 Na3.1 O18 Si4 Sr1.4 Ti2.43 | C 1 2/m 1 | 19.2616; 7.0663; 5.3735 90; 96.698; 90 | 726.39 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
2108800 | CIF HKL Paper | C15 H10 F I O | P 1 21/c 1 | 22.9802; 4.7448; 12.2026 90; 96.534; 90 | 1321.89 | Hamilton, Victoria; Harris, Connah; Hall, Charlie L.; Potticary, Jason; Cremeens, Matthew E.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Warren, Stephen D.; Pridmore, Natalie E.; Sparkes, Hazel A.; Hall, Simon R. Structural effects of halogen bonding in iodochalcones Acta Crystallographica Section B, 2021, 77 |
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