Crystallography Open Database

Result: there are 246 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching journal of publication like 'Acta Crystallographica Section B' volume of publication is 76

Left arrow Left arrow First | Left arrow Previous 20 | of 13 | Next 20 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Blue down arrow Bibliography
2108566 CIF
HKL
C7 H7.75 N Na O4.875 SP 1 21/n 118.6212; 28.4622; 29.1642
90; 93.4511; 90
15429Rekis, Toms; Schönleber, Andreas; van Smaalen, Sander
On the puzzling case of sodium saccharinate 1.875-hydrate: structure description in (3+1)-dimensional superspace
Acta Crystallographica Section B, 2020, 76
2108653 CIFF120 Ga20 K60I 41/a :219.1124; 19.1124; 34.4165
90; 90; 90
12571.8King, Graham
New examples of non-cooperative octahedral tilting in a double perovskite: phase transitions in K~3~GaF~6~
Acta Crystallographica Section B, 2020, 76
2108657 CIF
HKL
Paper
C260 H264 N24 O40I 4 2 221.91; 21.91; 25.44
90; 90; 90
12212Gilski, Miroslaw; Bernatowicz, Piotr; Sakowicz, Arkadiusz; Szymański, Marek P.; Zalewska, Aldona; Szumna, Agnieszka; Jaskólski, Mariusz
C~60~ in a peptidic cage: a case of symmetry mismatch studied by crystallography and solid-state NMR
Acta Crystallographica Section B, 2020, 76
2108687 CIF
HKL
C128 H85 Co4 N12 O18P 1 21/c 131.055; 23.792; 16.54
90; 94.255; 90
12187Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan
Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties
Acta Crystallographica Section B, 2020, 76
2108645 CIF
HKL
Paper
C21 H16 N2 O4B 1 21 115.5993; 49.062; 15.6099
90; 119.896; 90
10357Nespolo, Massimo; Smaha, Rebecca W.; Parkin, Sean
Zero-obliquity twin lattice quasi-symmetry threefold twinning in 1-{(<i>R</i>)-1-[(3-oxo-2-isoindolinoyl)methyl]-2-propenyl}-5-methyl-2,3-indolinedione
Acta Crystallographica Section B, 2020, 76
2108590 CIF
HKL
Paper
C25 H44 Cl N O10P 21 21 2116.3296; 16.3759; 31.1186
90; 90; 90
8321.5Li, Han-qing; Xu, Jia-yin; Gao, Yuan-yuan; Jin, Liang; Chen, Jian-ming; Chen, Feng-zheng
Supramolecular structure, <i>in vivo</i> biological activities and molecular-docking-based potential cardiotoxic exploration of aconine hydrochloride monohydrate as a novel salt form
Acta Crystallographica Section B, 2020, 76
2108570 CIF
HKL
Paper
Cd86.45 Cu7.147 Ir7.318F -4 3 m19.9445; 19.9445; 19.9445
90; 90; 90
7933.6Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim
Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system
Acta Crystallographica Section B, 2020, 76
2108571 CIF
HKL
Paper
Cd86.366 Cu7.584 Ir6.698F -4 3 m19.922; 19.922; 19.922
90; 90; 90
7907Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim
Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system
Acta Crystallographica Section B, 2020, 76
2108617 CIF
HKL
Ga105.3 Mg69.48 Ni48F d -3 m :219.8621; 19.8621; 19.8621
90; 90; 90
7835.7Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Rozdzynska-Kielbik, Beata; Cichowicz, Grzegorz; Cyranski, Michał K.; Chumak, Ihor; Ehrenberg, Helmut
New cubic cluster phases in the Mg‒Ni‒Ga system
Acta Crystallographica Section B, 2020, 76
2108573 CIF
HKL
Paper
Cd81.64 Cu15.796 Ir5.306F -4 3 m19.8332; 19.8332; 19.8332
90; 90; 90
7801.5Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim
Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system
Acta Crystallographica Section B, 2020, 76
2108572 CIF
HKL
Paper
Cd81.199 Cu15.659 Ir5.873F -4 3 m19.785; 19.785; 19.785
90; 90; 90
7744.8Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim
Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system
Acta Crystallographica Section B, 2020, 76
2108574 CIF
HKL
Paper
Cd80.144 Cu17.218 Ir5.638F -4 3 m19.7041; 19.7041; 19.7041
90; 90; 90
7650.1Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim
Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system
Acta Crystallographica Section B, 2020, 76
2108678 CIF
HKL
C23 H28 F N3 O10P 1 21 116.78184; 15.47624; 19.5982
90; 105.758; 90
4898.74Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J.
Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties
Acta Crystallographica Section B, 2020, 76
2108677 CIF
HKL
C46 H54.5 F2 N6 O17.25P 21 21 230.3989; 16.1024; 9.66944
90; 90; 90
4733.14Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J.
Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties
Acta Crystallographica Section B, 2020, 76
2022012 CIFC41 H77.768 N2 O15.884P 21 21 2111.624; 16.748; 24.018
90; 90; 90
4675.8Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2108606 CIF
HKL
C52 H32 N8 O8 S2 Zn2P 1 21/c 17.8461; 20.359; 29.189
90; 94.612; 90
4647.5Shi, Zhi-Qiang; Ji, Ning-Ning; Hu, Hai-Liang
A new Zn^II^ metallocryptand with unprecedented diflexure helix induced by V-shaped diimidazole building blocks
Acta Crystallographica Section B, 2020, 76
2108721 CIF
HKL
Paper
C25 H34 O2 SP c a 2154.285; 5.5843; 14.8411
90; 90; 90
4499Deptuch, Aleksandra; Jaworska-Gołab, Teresa; Kusz, Joachim; Ksiażek, Maria; Nagao, Keigo; Matsumoto, Takashi; Yamano, Akihito; Ossowska-Chruściel, Mirosława D.; Chruściel, Janusz; Marzec, Monika
Single crystal X-ray structure determination and temperature-dependent structural studies of the smectogenic compound 7OS5
Acta Crystallographica Section B, 2020, 76
2108567 CIF
HKL
C7 H4 N Na O4.875 SC 1 2/n 118.6212; 7.11555; 29.1642
90; 93.4511; 90
3857.25Rekis, Toms; Schönleber, Andreas; van Smaalen, Sander
On the puzzling case of sodium saccharinate 1.875-hydrate: structure description in (3+1)-dimensional superspace
Acta Crystallographica Section B, 2020, 76
2108616 CIF
HKL
Ca2 H14 O23 P2 U3P b c a17.3785; 15.9864; 13.5477
90; 90; 90
3763.8Plášil, Jakub; Kiefer, Boris; Ghazisaeed, Seyedat; Philippo, Simon
Hydrogen bonding in the crystal structure of phurcalite, Ca~2~[(UO~2~)~3~O~2~(PO~4~)~2~]·7H~2~O: single-crystal X-ray study and TORQUE calculations
Acta Crystallographica Section B, 2020, 76
2108667 CIF
HKL
K2.88 Mg4 Mo6 Na1.12 O24R -3 c :H14.4673; 14.4673; 19.9186
90; 90; 120
3610.5Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F.
Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity
Acta Crystallographica Section B, 2020, 76

Left arrow Left arrow First | Left arrow Previous 20 | of 13 | Next 20 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!