Crystallography Open Database
Search results
Result: there are 10718 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
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 2101042 | CIF Paper | C14 H12 N2 S2 | P -1 | 8.833; 9.419; 9.52 106.77; 93.14; 109.61 | 704.2 | Dastidar, P.; Guru Row, T. N.; Venkatesan, K. Structural studies of `push–pull' butadienes Acta Crystallographica Section B, 1993, 49, 900-905 |
| 2101043 | CIF Paper | C16 H18 N2 O2 | C 1 2/c 1 | 17.468; 13.75; 15.218 90; 125.49; 90 | 2976 | Dastidar, P.; Guru Row, T. N.; Venkatesan, K. Structural studies of `push–pull' butadienes Acta Crystallographica Section B, 1993, 49, 900-905 |
| 2101044 | CIF Paper | C15 H15 N3 S | P 1 21/n 1 | 9.951; 10.04; 14.764 90; 98.67; 90 | 1458.2 | Dastidar, P.; Guru Row, T. N.; Venkatesan, K. Structural studies of `push–pull' butadienes Acta Crystallographica Section B, 1993, 49, 900-905 |
| 2101045 | CIF Paper | K O16 Ti8 | I 4/m | 10.1776; 10.1776; 2.9614 90; 90; 90 | 306.75 | Sasaki, T.; Watanabe, M.; Fujiki, Y. Structure of K~1.0~Ti~8~O~16~ and K~0.0~Ti~8~O~16~ Acta Crystallographica Section B, 1993, 49, 838-841 |
| 2101046 | CIF Paper | K0 O16 Ti8 | I 4/m | 10.164; 10.164; 2.9631 90; 90; 90 | 306.11 | Sasaki, T.; Watanabe, M.; Fujiki, Y. Structure of K~1.0~Ti~8~O~16~ and K~0.0~Ti~8~O~16~ Acta Crystallographica Section B, 1993, 49, 838-841 |
| 2101047 | CIF Paper | Al12 Cs H44 N11 O96 Si36 | I -4 3 m | 14.4803; 14.4803; 14.4803 90; 90; 90 | 3036.22 | Bieniok, A.; Baur, W. H. Phase transition of zeolite NH~4~-Rho to a high-temperature but low-volume form Acta Crystallographica Section B, 1993, 49, 817-822 |
| 2101048 | CIF Paper | Al12 Cs H44 N11 O96 Si36 | I -4 3 m | 14.8168; 14.8168; 14.8168 90; 90; 90 | 3252.84 | Bieniok, A.; Baur, W. H. Phase transition of zeolite NH~4~-Rho to a high-temperature but low-volume form Acta Crystallographica Section B, 1993, 49, 817-822 |
| 2101049 | CIF Paper | O8 W3 | C 2 2 2 | 6.386; 10.43; 3.798 90; 90; 90 | 252.97 | Sundberg, M.; Zakharov, N. D.; Zibrov, I. P.; Barabanenkov, Yu. A.; Filonenko, V. P.; Werner, P. Two high-pressure tungsten oxide structures of W~3~O~8~ stoichiometry deduced from high-resolution electron microscopy images Acta Crystallographica Section B, 1993, 49, 951-958 |
| 2101050 | CIF Paper | O8 W3 | P 21 21 2 | 10.35; 13.99; 3.774 90; 90; 90 | 546.462 | Sundberg, M.; Zakharov, N. D.; Zibrov, I. P.; Barabanenkov, Yu. A.; Filonenko, V. P.; Werner, P. Two high-pressure tungsten oxide structures of W~3~O~8~ stoichiometry deduced from high-resolution electron microscopy images Acta Crystallographica Section B, 1993, 49, 951-958 |
| 2101051 | CIF Paper | C12 H8 Cl2 O2 S | I 1 2/a 1 | 20.2; 4.91; 12.054 90; 90.02; 90 | 1195.5 | Zúñiga, F. J.; Pérez-Mato, J. M.; Breczewski, T. Structure of the incommensurate phase of 4,4'-dichlorobiphenyl sulfone at 90 K Acta Crystallographica Section B, 1993, 49, 1060-1068 |
| 2101052 | CIF Paper | Al2 O3 | R -3 c :H | 4.754; 4.754; 12.982 90; 90; 120 | 254.09 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.; Satow, Y. Synchrotron X-ray study of the electron density in α-Al~2~O~3~ Acta Crystallographica Section B, 1993, 49, 973-980 |
| 2101053 | CIF Paper | Al2 O3 | R -3 c :H | 4.754; 4.754; 12.982 90; 90; 120 | 254.09 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.; Satow, Y. Synchrotron X-ray study of the electron density in α-Al~2~O~3~ Acta Crystallographica Section B, 1993, 49, 973-980 |
| 2101054 | CIF Paper | Al2 O3 | R -3 c :H | 4.754; 4.754; 12.982 90; 90; 120 | 254.09 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.; Satow, Y. Synchrotron X-ray study of the electron density in α-Al~2~O~3~ Acta Crystallographica Section B, 1993, 49, 973-980 |
| 2101055 | CIF Paper | Al2 O3 | R -3 c :H | 4.754; 4.754; 12.982 90; 90; 120 | 254.09 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.; Satow, Y. Synchrotron X-ray study of the electron density in α-Al~2~O~3~ Acta Crystallographica Section B, 1993, 49, 973-980 |
| 2101056 | CIF Paper | Al2 O3 | R -3 c :H | 4.754; 4.754; 12.982 90; 90; 120 | 254.09 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.; Satow, Y. Synchrotron X-ray study of the electron density in α-Al~2~O~3~ Acta Crystallographica Section B, 1993, 49, 973-980 |
| 2101057 | CIF Paper | C Mg O3 | R -3 c :H | 4.635; 4.635; 15.023 90; 90; 120 | 279.5 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R. X-ray study of the electron density in magnesite MgCO~3~ Acta Crystallographica Section B, 1993, 49, 980-984 |
| 2101058 | CIF Paper | C6 H4 N2 O4 | P 1 21/n 1 | 10.941; 5.3813; 5.6684 90; 92.116; 90 | 333.51 | Tonogaki, M.; Kawata, T.; Ohba, S.; Iwata, Y.; Shibuya, I. Electron-density distribution in crystals of <i>p</i>-nitrobenzene derivatives Acta Crystallographica Section B, 1993, 49, 1031-1039 |
| 2101059 | CIF Paper | C7 H5 N O4 | A 1 2/a 1 | 12.857; 5.0272; 20.997 90; 97.072; 90 | 1346.81 | Tonogaki, M.; Kawata, T.; Ohba, S.; Iwata, Y.; Shibuya, I. Electron-density distribution in crystals of <i>p</i>-nitrobenzene derivatives Acta Crystallographica Section B, 1993, 49, 1031-1039 |
| 2101060 | CIF Paper | C7 H6 N2 O3 | P 1 21/c 1 | 7.393; 6.8005; 13.814 90; 90.88; 90 | 694.4 | Tonogaki, M.; Kawata, T.; Ohba, S.; Iwata, Y.; Shibuya, I. Electron-density distribution in crystals of <i>p</i>-nitrobenzene derivatives Acta Crystallographica Section B, 1993, 49, 1031-1039 |
| 2101061 | CIF Paper | C7 H5 N2 O3 | P 1 21/c 1 | 6.2336; 4.8377; 24.352 90; 94.87; 90 | 731.71 | Tonogaki, M.; Kawata, T.; Ohba, S.; Iwata, Y.; Shibuya, I. Electron-density distribution in crystals of <i>p</i>-nitrobenzene derivatives Acta Crystallographica Section B, 1993, 49, 1031-1039 |
| 2101062 | CIF Paper | C6 H6 N2 O2 | P 1 21/n 1 | 12.122; 6.0276; 8.487 90; 92.72; 90 | 619.42 | Tonogaki, M.; Kawata, T.; Ohba, S.; Iwata, Y.; Shibuya, I. Electron-density distribution in crystals of <i>p</i>-nitrobenzene derivatives Acta Crystallographica Section B, 1993, 49, 1031-1039 |
| 2101063 | CIF Paper | C15 H27 Co N6 O4 | P 1 | 11.723; 15.658; 11.118 98.71; 90.17; 98.52 | 1994.3 | Takenaka, Y.; Ohashi, Y.; Tamura, T.; Uchida, A.; Sasada, Y. Three polymorphs of (<i>rac</i>-1-cyanoethyl)(pyrrolidine)cobaloxime Acta Crystallographica Section B, 1993, 49, 1015-1020 |
| 2101064 | CIF Paper | C24 H36 Co N6 O4 | P 1 21/a 1 | 16.621; 18.803; 9.155 90; 105.03; 90 | 2763.3 | Takenaka, Y.; Ohashi, Y.; Tamura, T.; Uchida, A.; Sasada, Y. Three polymorphs of (<i>rac</i>-1-cyanoethyl)(pyrrolidine)cobaloxime Acta Crystallographica Section B, 1993, 49, 1015-1020 |
| 2101065 | CIF Paper | C22 H34 Co N5 O8 | P 1 21 1 | 9.125; 15.82; 9.348 90; 102.57; 90 | 1317.1 | Sakai, Y.; Ohashi, Y.; Yamanaka, M.; Kobayashi, Y.; Arai, Y.; Ohgo, Y. Crystalline-state reaction of cobaloxime complexes. 17. Requirements for racemization of the bulky dimethoxycarbonylethyl group Acta Crystallographica Section B, 1993, 49, 1010-1014 |
| 2101066 | CIF Paper | C18 H36 Co N5 O9 | P 1 21 1 | 9.803; 15.554; 9.267 90; 117.24; 90 | 1256.3 | Sakai, Y.; Ohashi, Y.; Yamanaka, M.; Kobayashi, Y.; Arai, Y.; Ohgo, Y. Crystalline-state reaction of cobaloxime complexes. 17. Requirements for racemization of the bulky dimethoxycarbonylethyl group Acta Crystallographica Section B, 1993, 49, 1010-1014 |
| 2101067 | CIF Paper | C12 H10 O6 P2 Zr | C 1 2/c 1 | 9.0985; 5.4154; 30.235 90; 101.233; 90 | 1461.2 | Poojary, M. D.; Hu, H.-L.; Campbell, III, F. L.; Clearfield, A. Determination of crystal structures from limited powder data sets: crystal structure of zirconium phenylphosphonate Acta Crystallographica Section B, 1993, 49, 996-1001 |
| 2101068 | CIF Paper | C21 H18 O4 | P n a 21 | 18.364; 10.485; 9.031 90; 90; 90 | 1738.9 | Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J. Cyclooctatetraene formation in the photolyses of dibenzobarrelene diesters Acta Crystallographica Section B, 1993, 49, 1049-1052 |
| 2101069 | CIF Paper | C22 H20 O4 | P 1 21/n 1 | 9.121; 20.486; 10.028 90; 100.91; 90 | 1839.9 | Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J. Cyclooctatetraene formation in the photolyses of dibenzobarrelene diesters Acta Crystallographica Section B, 1993, 49, 1049-1052 |
| 2101070 | CIF Paper | Au Ce Cu5 | P n m a | 8.2455; 5.0866; 10.3659 90; 90; 90 | 434.76 | Ruck, M.; Portisch, G.; Schlager, H. G.; Sieck, M.; Löhneysen, H. v. Structure and electrical resistivity of the heavy fermion compound CeCu~5~Au Acta Crystallographica Section B, 1993, 49, 936-941 |
| 2101071 | CIF Paper | C8 H18 P6 S5 | P 1 21/c 1 | 12.255; 12.866; 12.522 90; 100.53; 90 | 1941 | Blachnik, R.; Lönnecke, P.; Engelen, B.; Boldt, K. P~6~S~5~(C~4~H~9~)~2~, the first organophosphorus chalcogen molecule with a brexane skeleton Acta Crystallographica Section B, 1993, 49, 1053-1055 |
| 2101072 | CIF Paper | C18 H10 Cl2 N2 O2 | P -1 | 3.785; 6.845; 14.485 100.79; 97.6; 80.91 | 361.97 | Mizuguchi, J.; Grubenmann, A.; Rihs, G. Structures of 3,6-bis(3-chlorophenyl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione and 3,6-bis(4-chlorophenyl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 1993, 49, 1056-1060 |
| 2101073 | CIF Paper | C18 H10 Cl2 N2 O2 | P 1 21/n 1 | 5.658; 23.099; 5.585 90; 99.07; 90 | 720.8 | Mizuguchi, J.; Grubenmann, A.; Rihs, G. Structures of 3,6-bis(3-chlorophenyl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione and 3,6-bis(4-chlorophenyl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 1993, 49, 1056-1060 |
| 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 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

