Crystallography Open Database
Search results
Result: there are 177 entries in the selection
Switch to the old layout of the pageDownload 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 50
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2101074 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.112; 14.31; 6.2043 90; 90; 90 | 1075.3 | Brożek, Z.; Stadnicka, K. Structure of sodium ammonium (+)-tartrate tetrahydrate at 200, 151 and 120 K Acta Crystallographica Section B, 1994, 50, 59-68 |
| 2101075 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.088; 14.28; 6.192 90; 90; 90 | 1069 | Brożek, Z.; Stadnicka, K. Structure of sodium ammonium (+)-tartrate tetrahydrate at 200, 151 and 120 K Acta Crystallographica Section B, 1994, 50, 59-68 |
| 2101076 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.065; 14.346; 6.182 90; 90; 90 | 1070 | Brożek, Z.; Stadnicka, K. Structure of sodium ammonium (+)-tartrate tetrahydrate at 200, 151 and 120 K Acta Crystallographica Section B, 1994, 50, 59-68 |
| 2101077 | CIF Paper | Cr2 K3 Na O8 | P -3 m 1 | 5.857; 5.857; 7.521 90; 90; 120 | 223.44 | Fábry, J.; Breczewski, T.; Madariaga, G. Structure determination of the ferroelastic phase of K~3~Na(CrO~4~)~2~ at 200 and 230 K and the redetermination of its parent phase at 290 K Acta Crystallographica Section B, 1994, 50, 13-22 |
| 2101078 | CIF Paper | Cr2 K3 Na O8 | C 1 2/c 1 | 10.128; 5.8437; 15.022 90; 89.97; 90 | 889.1 | Fábry, J.; Breczewski, T.; Madariaga, G. Structure determination of the ferroelastic phase of K~3~Na(CrO~4~)~2~ at 200 and 230 K and the redetermination of its parent phase at 290 K Acta Crystallographica Section B, 1994, 50, 13-22 |
| 2101079 | CIF Paper | Cr2 K3 Na O8 | C 1 2/c 1 | 10.117; 5.843; 15.024 90; 89.967; 90 | 888.1 | Fábry, J.; Breczewski, T.; Madariaga, G. Structure determination of the ferroelastic phase of K~3~Na(CrO~4~)~2~ at 200 and 230 K and the redetermination of its parent phase at 290 K Acta Crystallographica Section B, 1994, 50, 13-22 |
| 2101080 | CIF Paper | Cr2 K3 Na O8 | C 1 2/c 1 | 10.117; 5.843; 15.024 90; 89.967; 90 | 888.1 | Fábry, J.; Breczewski, T.; Madariaga, G. Structure determination of the ferroelastic phase of K~3~Na(CrO~4~)~2~ at 200 and 230 K and the redetermination of its parent phase at 290 K Acta Crystallographica Section B, 1994, 50, 13-22 |
| 2101081 | CIF Paper | C23 H16 O | P 21 21 21 | 14.992; 19.124; 5.614 90; 90; 90 | 1609.6 | Mori, Y.; Maeda, K. Structures and photochemical reactions of 1-(9-anthryl)-2-aroylethylenes: competing <i>cis</i>‒<i>trans</i> isomerization and skeletal rearrangement Acta Crystallographica Section B, 1994, 50, 106-112 |
| 2101082 | CIF Paper | C24 H16 O | P 1 21/a 1 | 11.641; 13.914; 10.399 90; 102.71; 90 | 1643.1 | Mori, Y.; Maeda, K. Structures and photochemical reactions of 1-(9-anthryl)-2-aroylethylenes: competing <i>cis</i>‒<i>trans</i> isomerization and skeletal rearrangement Acta Crystallographica Section B, 1994, 50, 106-112 |
| 2101083 | CIF Paper | C25 H18 O | P 1 21/c 1 | 9.106; 25.977; 7.478 90; 96.76; 90 | 1756.6 | Mori, Y.; Maeda, K. Structures and photochemical reactions of 1-(9-anthryl)-2-aroylethylenes: competing <i>cis</i>‒<i>trans</i> isomerization and skeletal rearrangement Acta Crystallographica Section B, 1994, 50, 106-112 |
| 2101084 | CIF Paper | C25 H18 O | P 1 21/c 1 | 12.032; 13.608; 10.829 90; 95.78; 90 | 1764 | Mori, Y.; Maeda, K. Structures and photochemical reactions of 1-(9-anthryl)-2-aroylethylenes: competing <i>cis</i>‒<i>trans</i> isomerization and skeletal rearrangement Acta Crystallographica Section B, 1994, 50, 106-112 |
| 2101085 | CIF Paper | C42 H40 O8 S6 | P -1 | 12.329; 11.229; 8.229 98.42; 106.43; 99.05 | 1057 | Marsh, R. E. On the crystal structures of two inclusion compounds of tris(5-acetyl-3-thienyl)methane Acta Crystallographica Section B, 1994, 50, 112-116 |
| 2101086 | CIF Paper | C40 H38 O7 S6 | P -1 | 12.488; 10.372; 8.335 84.95; 108.74; 98.51 | 1010.2 | Marsh, R. E. On the crystal structures of two inclusion compounds of tris(5-acetyl-3-thienyl)methane Acta Crystallographica Section B, 1994, 50, 112-116 |
| 2101087 | CIF Paper | C12 H12 N2 O3 | P 1 21/c 1 | 10.128; 11.035; 11.198 90; 113.71; 90 | 1145.9 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101088 | CIF Paper | C10 H9 N3 O | P 1 21/a 1 | 9; 9.398; 11.355 90; 110.97; 90 | 896.8 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101089 | CIF Paper | C11 H11 N3 O | P 1 21 1 | 8.017; 7.199; 8.944 90; 98.29; 90 | 510.8 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101090 | CIF Paper | C12 H11 N3 O2 | P 1 21/c 1 | 4.434; 15.267; 17.045 90; 69.42; 90 | 1080.2 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101091 | CIF Paper | C13 H13 N3 O3 | P 1 21/c 1 | 17.048; 9.5; 7.54 90; 90.57; 90 | 1221.1 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101092 | CIF Paper | C10 H9 N3 O | P b c a | 7.36; 7.469; 33.061 90; 90; 90 | 1817.4 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101093 | CIF Paper | C10 H8 N2 O | P 1 21/c 1 | 7.612; 5.765; 19.249 90; 101.3; 90 | 828.3 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101094 | CIF Paper | C10 H11 N3 O | P -1 | 7.47; 11.52; 11.898 112.85; 102.06; 96.57 | 900.7 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101095 | CIF Paper | C14 H15 Br N3 O2 | P 1 21 1 | 10.96; 9.697; 13.5885 90; 98.544; 90 | 1428.1 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101096 | CIF Paper | C17 H35 Cl2 N3 O8 | P 21 21 21 | 7.162; 8.026; 39.96 90; 90; 90 | 2297 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101097 | CIF Paper | C5 H10 N2 O2 | P 21 21 21 | 6.417; 6.892; 15.629 90; 90; 90 | 691.2 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
| 2101098 | CIF Paper | C17 H28 N5 O5 S | P n m a | 10.722; 11.635; 34.105 90; 90; 90 | 4255 | Prout, K.; Burns, K.; Roe, A. M. Structure of the β-blocker/vasodilator agent prizidilol, <small>DL</small>-6-{2-[3-(<i>tert</i>-butylamino)-2-hydroxypropoxy]phenyl}-3-pyridazinylhydrazine hemisulfate monohydrate Acta Crystallographica Section B, 1994, 50, 68-71 |
| 2101099 | CIF Paper | K2 Mg O12 Si5 | I a -3 d | 13.419; 13.419; 13.419 90; 90; 90 | 2416.33 | Bell, A. M. T.; Henderson, C. M. B.; Redfern, S. A. T.; Cernik, R. J.; Champness, P. E.; Fitch, A. N.; Kohn, S. C. Structures of synthetic K~2~MgSi~5~O~12~ leucites by integrated X-ray powder diffraction, electron diffraction and ^29^Si MAS NMR methods Acta Crystallographica Section B, 1994, 50, 31-41 |
| 2101100 | CIF Paper | K2 Mg O12 Si5 | P 1 21/c 1 | 13.168; 13.6518; 13.072 90; 91.69; 90 | 2348 | Bell, A. M. T.; Henderson, C. M. B.; Redfern, S. A. T.; Cernik, R. J.; Champness, P. E.; Fitch, A. N.; Kohn, S. C. Structures of synthetic K~2~MgSi~5~O~12~ leucites by integrated X-ray powder diffraction, electron diffraction and ^29^Si MAS NMR methods Acta Crystallographica Section B, 1994, 50, 31-41 |
| 2101101 | CIF Paper | C24 H20 N2 O4 | P -1 | 8.764; 11.112; 11.323 102.1; 95.44; 109.12 | 1002.6 | Ciechanowicz-Rutkowska, M.; Kieć-Kononowicz, K.; Howard, S. T.; Lieberman, H.; Hursthouse, M. B. Molecular and electronic structures of two (anticonvulsant) diphenylhydantoin derivatives Acta Crystallographica Section B, 1994, 50, 86-96 |
| 2101102 | CIF Paper | C24 H18 Cl2 N2 O4 | P 1 21/n 1 | 8.0392; 9.7237; 26.9768 90; 94.281; 90 | 2102.9 | Ciechanowicz-Rutkowska, M.; Kieć-Kononowicz, K.; Howard, S. T.; Lieberman, H.; Hursthouse, M. B. Molecular and electronic structures of two (anticonvulsant) diphenylhydantoin derivatives Acta Crystallographica Section B, 1994, 50, 86-96 |
| 2101103 | CIF Paper | Al28 Mn11 | P n 21 a | 14.837; 12.457; 12.505 90; 90; 90 | 2311.2 | Shi, N. C.; Li, X. Z.; Ma, Z. S.; Kuo, K. H. Crystalline phases related to a decagonal quasicrystal. I. A single-crystal X-ray diffraction study of the orthorhombic Al~3~Mn phase Acta Crystallographica Section B, 1994, 50, 22-30 |
| 2101104 | CIF Paper | C19 H23 Bi O2 | P 1 21/n 1 | 11.635; 8.837; 18.149 90; 103.17; 90 | 1817 | Yoshida, S.; Yasui, M.; Iwasaki, F.; Yamamoto, Y.; Chen, X.; Akiba, K. Crystal and molecular structures of bismuth compounds of a spiro-σ-sulfurane type Acta Crystallographica Section B, 1994, 50, 151-157 |
| 2101105 | CIF Paper | C18 H21 Bi O2 | C 1 2/c 1 | 19.902; 18.353; 17.303 90; 109.69; 90 | 5950.6 | Yoshida, S.; Yasui, M.; Iwasaki, F.; Yamamoto, Y.; Chen, X.; Akiba, K. Crystal and molecular structures of bismuth compounds of a spiro-σ-sulfurane type Acta Crystallographica Section B, 1994, 50, 151-157 |
| 2101106 | CIF Paper | C26 H30 Bi F12 N O3 | P 1 21/n 1 | 15.547; 15.9; 11.996 90; 90.19; 90 | 2965.4 | Yoshida, S.; Yasui, M.; Iwasaki, F.; Yamamoto, Y.; Chen, X.; Akiba, K. Crystal and molecular structures of bismuth compounds of a spiro-σ-sulfurane type Acta Crystallographica Section B, 1994, 50, 151-157 |
| 2101107 | CIF Paper | H46 K3 Na4 O58 Pr W10 | P 1 21/n 1 | 30.049; 16.055; 11.462 90; 96.36; 90 | 5495.7 | Ozeki, T.; Yamase, T. Effect of lanthanide contraction on the structures of the decatungstolanthanoate anions in K~3~Na~4~H~2~[LnW~10~O~36~].<i>n</i>H~2~O (Ln = Pr, Nd, Sm, Gd, Tb, Dy) crystals Acta Crystallographica Section B, 1994, 50, 128-134 |
| 2101108 | CIF Paper | H46 K3 Na4 Nd O58 W10 | P 1 21/n 1 | 30.057; 16.051; 11.468 90; 96.52; 90 | 5496.9 | Ozeki, T.; Yamase, T. Effect of lanthanide contraction on the structures of the decatungstolanthanoate anions in K~3~Na~4~H~2~[LnW~10~O~36~].<i>n</i>H~2~O (Ln = Pr, Nd, Sm, Gd, Tb, Dy) crystals Acta Crystallographica Section B, 1994, 50, 128-134 |
| 2101109 | CIF Paper | Dy H44 K3 Na4 O57 W10 | P 1 21/n 1 | 29.816; 16.097; 11.443 90; 96.36; 90 | 5458 | Ozeki, T.; Yamase, T. Effect of lanthanide contraction on the structures of the decatungstolanthanoate anions in K~3~Na~4~H~2~[LnW~10~O~36~].<i>n</i>H~2~O (Ln = Pr, Nd, Sm, Gd, Tb, Dy) crystals Acta Crystallographica Section B, 1994, 50, 128-134 |
| 2101110 | CIF Paper | C13 H18 N2 O7 | P 1 | 5.9701; 6.7357; 9.577 77.21; 79.95; 75.45 | 360.62 | Wei, Y.; Barton, R.; Robertson, B. Electron-density and electrostatic potential distributions in nucleoside analogs. I. An experimental study of 3'-<i>O</i>-acetyl-2'-deoxy-5-methoxymethyluridine Acta Crystallographica Section B, 1994, 50, 161-174 |
| 2101111 | CIF Paper | C4 H8 | P 21 21 21 | 12.38; 8.88; 7.56 90; 90; 90 | 831.104 | Dorset, D. L.; McCourt, M. P.; Kopp, S.; Wittmann, J.-C.; Lotz, B. Direct determination of polymer crystal structures by electron crystallography ‒ isotactic poly(1-butene), form (III) Acta Crystallographica Section B, 1994, 50, 201-208 |
| 2101112 | CIF Paper | C12 H12 N4 O8 | P 1 21 1 | 7.073; 11.624; 8.231 90; 96.79; 90 | 671.98 | Ammon, H. L.; Du, Z.; Holden, J. R.; Paquette, L. A. Structure of 1,1,5,5-tetranitro-[4]peristylane. Structure solution from molecular packing analysis Acta Crystallographica Section B, 1994, 50, 216-220 |
| 2101113 | CIF Paper | C21 H27 Br4 N5 O | P -1 | 6.314; 11.192; 19.441 102.47; 92.77; 103.28 | 1298.6 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101114 | CIF Paper | C14 H19 Br N4 O2 | I 1 2/a 1 | 16.359; 10.469; 18.339 90; 90.9; 90 | 3140 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101115 | CIF Paper | C12 H16 Br N5 O S | P -1 | 14.295; 12.447; 9.917 95.77; 113.86; 106.91 | 1495.2 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101116 | CIF Paper | C19 H22 Br N5 O S | P 1 21/c 1 | 36.293; 4.826; 11.528 90; 96.91; 90 | 2004.5 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101117 | CIF Paper | C19 H21 N5 O | P b n a | 7.082; 19.889; 24.899 90; 90; 90 | 3507.1 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101118 | CIF Paper | C19 H23 F N6 O S | P 1 21/n 1 | 6.686; 14.717; 20.85 90; 97.83; 90 | 2032.5 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101119 | CIF Paper | C23 H29 N5 O2 | P 1 21/c 1 | 14.966; 16.075; 9.1608 90; 99.158; 90 | 2175.8 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101120 | CIF Paper | C20 H26 N4 O3 | P 1 21/c 1 | 8.04; 21.279; 11.404 90; 92.08; 90 | 1949.7 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101121 | CIF Paper | C18 H19 N5 O S | P 1 | 8.577; 9.197; 11.83 86.57; 81.88; 69.83 | 867.1 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101122 | CIF Paper | C21 H25 N5 O2 | P 1 21/c 1 | 8.1451; 19.522; 12.564 90; 106.78; 90 | 1912.7 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2101123 | CIF Paper | C50 H104 | C m c 21 | 4.992; 7.503; 67.448 90.02; 90; 89.95 | 2526.3 | Gerson, A. R.; Nyburg, S. C. Structures of two binary <i>n</i>-alkane solid solutions Acta Crystallographica Section B, 1994, 50, 252-256 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!