Crystallography Open Database
Search results
Result: there are 10612 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 |
|---|---|---|---|---|---|---|
| 2101281 | CIF Paper | C7 H10 N2 O2 | P -1 | 7.242; 7.991; 8.38 61.98; 63.4; 82.09 | 381.2 | Suwinska, K. Structure and thermochemical properties of some alkyluracils Acta Crystallographica Section B, 1995, 51, 248-254 |
| 2101282 | CIF Paper | C8 H12 N2 O2 | P 1 21/n 1 | 4.107; 9.806; 20.994 90; 92.97; 90 | 844.4 | Suwinska, K. Structure and thermochemical properties of some alkyluracils Acta Crystallographica Section B, 1995, 51, 248-254 |
| 2101283 | CIF Paper | C9 H14 N2 O2 | P 1 21/c 1 | 10.738; 11.735; 23.056 90; 90.91; 90 | 2904.9 | Suwinska, K. Structure and thermochemical properties of some alkyluracils Acta Crystallographica Section B, 1995, 51, 248-254 |
| 2101284 | CIF Paper | C10 H16 N2 O2 | P 1 21/c 1 | 9.441; 12.086; 18.751 90; 100.53; 90 | 2103.5 | Suwinska, K. Structure and thermochemical properties of some alkyluracils Acta Crystallographica Section B, 1995, 51, 248-254 |
| 2101285 | CIF Paper | C11 H14 N2 O3 | P 1 21 1 | 5.152; 14.79; 7.134 90; 106.14; 90 | 522.18 | Fkyerat, A.; Guelzim, A.; Baert, E.; Paulus, W.; Heger, G.; Zyss, J.; Périgaud, A. Electron density study by X-ray and neutron diffraction of an NLO compound: <i>N</i>-(4-nitrophenyl)-<small>L</small>-prolinol. Description of quadratic hyperpolarizability Acta Crystallographica Section B, 1995, 51, 197-209 |
| 2101286 | CIF Paper | C11 H14 N2 O3 | P 1 21 1 | 5.164; 14.796; 7.108 90; 105.86; 90 | 522.4 | Fkyerat, A.; Guelzim, A.; Baert, E.; Paulus, W.; Heger, G.; Zyss, J.; Périgaud, A. Electron density study by X-ray and neutron diffraction of an NLO compound: <i>N</i>-(4-nitrophenyl)-<small>L</small>-prolinol. Description of quadratic hyperpolarizability Acta Crystallographica Section B, 1995, 51, 197-209 |
| 2101287 | CIF Paper | C11 H14 N2 O3 | P 1 21 1 | 5.152; 14.79; 7.134 90; 106.14; 90 | 522.18 | Fkyerat, A.; Guelzim, A.; Baert, E.; Paulus, W.; Heger, G.; Zyss, J.; Périgaud, A. Electron density study by X-ray and neutron diffraction of an NLO compound: <i>N</i>-(4-nitrophenyl)-<small>L</small>-prolinol. Description of quadratic hyperpolarizability Acta Crystallographica Section B, 1995, 51, 197-209 |
| 2101288 | CIF Paper | C5 H30 Bi2 Cl11 N5 | P 1 1 21 | 12.88; 13.916; 15.059 90; 90; 90.13 | 2699.1 | Carpentier, P.; Lefebvre, J.; Jakubas, R. Structure of pentakis(methylammonium) undecachlorodibismuthate(III), [NH~3~(CH~3~)]~5~Bi~2~Cl~11~, at 130 K and mechanism of the phase transitions Acta Crystallographica Section B, 1995, 51, 167-174 |
| 2101289 | CIF Paper | C56 H88 S4 | P 1 | 23.9; 15.6; 3.8 90; 90; 90 | 1416.79 | Luzny, W. X-ray diffraction and computer modelling study of the structure and conformation of poly(3-decylthiophene) Acta Crystallographica Section B, 1995, 51, 255-260 |
| 2101290 | CIF Paper | C36 H52 Cl6 In N3 O14 | P b c n | 26.639; 16.667; 10.538 90; 90; 90 | 4678.8 | Spengler, R.; Lange, J.; Zimmermann, H.; Burzlaff, H.; Veltsistas, P. G.; Karayannis, M. I. Structure of C~36~H~52~Cl~6~InN~3~O~14~ Acta Crystallographica Section B, 1995, 51, 174-177 |
| 2101291 | CIF Paper | C6 H12 O6 | P 21 21 21 | 5.8999; 7.8433; 15.685 90; 90; 90 | 725.8 | Kouwijzer, M. L. C. E.; van Eijck, B. P.; Kooijman, H.; Kroon, J. An extension of the <i>GROMOS</i> force field for carbohydrates, resulting in improvement of the crystal structure determination of α-<small>D</small>-galactose Acta Crystallographica Section B, 1995, 51, 209-220 |
| 2101292 | CIF Paper | C6 H12 O6 | P 21 21 21 | 6.5949; 9.014; 12.72 90; 90; 90 | 756.2 | Kouwijzer, M. L. C. E.; van Eijck, B. P.; Kooijman, H.; Kroon, J. An extension of the <i>GROMOS</i> force field for carbohydrates, resulting in improvement of the crystal structure determination of α-<small>D</small>-galactose Acta Crystallographica Section B, 1995, 51, 209-220 |
| 2101293 | CIF Paper | Cl6 N2 O2 P2 S | P 1 21/c 1 | 11.843; 7.751; 12.374 90; 95.11; 90 | 1131.4 | Belaj, F. Structure and thermal motion of sulfonylbis(phosphorimidic trichloride), So~2~(NPCl~3~)~2~ at 100 K Acta Crystallographica Section B, 1995, 51, 161-166 |
| 2101294 | CIF Paper | C25 H20 O | P 21 21 21 | 8.358; 13.8976; 15.5915 90; 90; 90 | 1811 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101295 | CIF Paper | C18 H15 N O | P 1 21/c 1 | 8.1899; 14.855; 11.6069 90; 96.344; 90 | 1403.5 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101296 | CIF Paper | C21 H16 O | P 1 21/c 1 | 5.9794; 9.953; 26.42 90; 91.365; 90 | 1571.9 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101297 | CIF Paper | C16 H18 O | P 3 1 c | 13.9232; 13.9232; 12.02 90; 90; 120 | 2018 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101298 | CIF Paper | C13 H2 F10 O | R -3 :H | 26.113; 26.113; 9.788 90; 90; 120 | 5780 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101299 | CIF Paper | C13 H2 F10 O | R -3 :H | 26.006; 26.006; 9.5941 90; 90; 120 | 5619.3 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101300 | CIF Paper | C13 H12 O | P 2 21 21 | 5.13; 18.65; 21.168 90; 90; 90 | 2025.2 | Ferguson, George; Carrol, Christopher D.; Glidewell, Christopher; Zakaria, Choudhury, M.; Lough, Alan, J. Hydrogen bonding in diphenylmethanols, <i>R</i>CPh~2~OH: structures of monomeric (4-biphenyl)diphenylmethanol and diphenyl(2-pyridyl)methanol, dimeric 1,1,3-triphenylpropyn-1-ol, trimeric 2-methyl-1,1-diphenylpropan-1-ol, tetrameric diphenyl(2-thienyl)methanol, hexameric bis(pentafluorophenyl)methanol (at 293 and 173 K) and polymeric diphenylmethanol Acta Crystallographica Section B, 1995, 51, 367-377 |
| 2101301 | CIF Paper | C9 H9 Cl O3 | P 1 21/c 1 | 15.301; 5.7117; 11.2462 90; 110.873; 90 | 918.4 | Larsen, S.; Marthi, K. Structures of racemic halogen-substituted 3-hydroxy-3-phenylpropionic acids; relations between spontaneously resolved and racemic compounds Acta Crystallographica Section B, 1995, 51, 338-346 |
| 2101302 | CIF Paper | C9 H9 Br O3 | P 1 21/c 1 | 15.498; 5.7513; 11.298 90; 111.28; 90 | 938.4 | Larsen, S.; Marthi, K. Structures of racemic halogen-substituted 3-hydroxy-3-phenylpropionic acids; relations between spontaneously resolved and racemic compounds Acta Crystallographica Section B, 1995, 51, 338-346 |
| 2101303 | CIF Paper | C7 H16 N2 O4 | P 1 21 1 | 5.431; 7.546; 12.095 90; 93.42; 90 | 494.8 | Suresh, S.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XXVIII. Recurrence of characteristic aggregation and interaction patterns in the crystal structures of <small>DL</small>- and <small>L</small>-lysine formate Acta Crystallographica Section B, 1995, 51, 353-358 |
| 2101304 | CIF Paper | C7 H16 N2 O4 | P 1 21/c 1 | 10.205; 11.152; 8.481 90; 97.51; 90 | 956.9 | Suresh, S.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XXVIII. Recurrence of characteristic aggregation and interaction patterns in the crystal structures of <small>DL</small>- and <small>L</small>-lysine formate Acta Crystallographica Section B, 1995, 51, 353-358 |
| 2101305 | CIF Paper | C9 H11 N O4 | P 1 21 1 | 13.619; 5.232; 6.062 90; 97.56; 90 | 428.2 | Howard, S. T.; Hursthouse, M. B.; Lehmann, C. W.; Poyner, E. A. Experimental and theoretical determination of electronic properties in <small>L</small>-dopa Acta Crystallographica Section B, 1995, 51, 328-337 |
| 2101306 | CIF Paper | Al2 O4 Pb | A m a 2 | 8.458; 9.234; 5.07 90; 90; 90 | 395.973 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101307 | CIF Paper | Ga2 O4 Pb | A m a 2 | 8.575; 9.424; 5.22 90; 90; 90 | 421.832 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101308 | CIF Paper | C45 H86 Br10 In4 N4 Ni6 O11 | C 1 2/c 1 | 22.869; 13.198; 26.775 90; 107.96; 90 | 7687.58 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101309 | CIF Paper | H9.5 K2.5 O26 Pt W6 | C 1 2/m 1 | 11.427; 19.832; 13.674 89.99; 101.36; 89.99 | 3038.1 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101310 | CIF Paper | C14 H26 Cu N2 O9 | P 43 21 2 | 7.217; 7.217; 34.553 90; 90; 90 | 1799.7 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101311 | CIF Paper | C6 H16 Co N5 O7 | A m a 2 | 12.717; 12.206; 7.717 90; 90; 90 | 1197.86 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101312 | CIF Paper | C6 H10 Cl2 N3 Ni O14 | P n m a | 25.735; 11.124; 11.461 90; 90; 90 | 3281 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101313 | CIF Paper | Ba2 H24 O28 P8 Pt2 | P 1 21/c 1 | 9.5452; 19.459; 7.6611 90; 90.758; 90 | 1422.8 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101314 | CIF Paper | Ba3 P4 Sn2 | P 1 21/c 1 | 7.886; 19.278; 7.869 90; 112.8; 90 | 1102.8 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101315 | CIF Paper | C14 H25 Cu N3 O16 | P -1 | 10.593; 12.454; 7.923 102.64; 107.4; 83.68 | 972.12 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101316 | CIF Paper | Cs6 O36 W11 | R -3 c :H | 7.261; 7.261; 110.58 90; 90; 120 | 5048.94 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101317 | CIF Paper | Cs6 O36 W11 | R -3 cr {rhombohedral axes} | 37.097; 37.097; 37.097 90; 90; 90 | 51052.4 | Marsh, R. E.; Bernal, I. More space-group changes Acta Crystallographica Section B, 1995, 51, 300-307 |
| 2101318 | CIF Paper | K2 O4 S | P m c n | 5.7704; 10.0712; 7.4776 90; 90; 90 | 434.56 | Ojima, K.; Nishihata, Y.; Sawada, A. Structure of potassium sulfate at temperatures from 296 K down to 15 K Acta Crystallographica, Section B: Structural Science, 1995, 51, 287-293 |
| 2101319 | CIF Paper | K2 O4 S | P m c n | 5.7503; 10.0395; 7.4513 90; 90; 90 | 430.16 | Ojima, K.; Nishihata, Y.; Sawada, A. Structure of potassium sulfate at temperatures from 296 K down to 15 K Acta Crystallographica, Section B: Structural Science, 1995, 51, 287-293 |
| 2101320 | CIF Paper | K2 O4 S | P m c n | 5.7303; 10.01; 7.4291 90; 90; 90 | 426.14 | Ojima, K.; Nishihata, Y.; Sawada, A. Structure of potassium sulfate at temperatures from 296 K down to 15 K Acta Crystallographica, Section B: Structural Science, 1995, 51, 287-293 |
| 2101321 | CIF Paper | K2 O4 S | P m c n | 5.7224; 10; 7.4226 90; 90; 90 | 424.73 | Ojima, K.; Nishihata, Y.; Sawada, A. Structure of potassium sulfate at temperatures from 296 K down to 15 K Acta Crystallographica, Section B: Structural Science, 1995, 51, 287-293 |
| 2101322 | CIF Paper | K2 O4 S | P m c n | 5.7226; 9.9985; 7.4218 90; 90; 90 | 424.66 | Ojima, K.; Nishihata, Y.; Sawada, A. Structure of potassium sulfate at temperatures from 296 K down to 15 K Acta Crystallographica, Section B: Structural Science, 1995, 51, 287-293 |
| 2101323 | CIF Paper | C30 H42 Ag N3 O8 | P 1 21/c 1 | 10.479; 15.751; 19.177 90; 110.2; 90 | 2970.6 | Andrianatoandro, H.; Barrans, Y.; Marsau, P.; Desvergne, J.-P.; Fages, F.; Bouas-Laurent, H. Two 9,10-anthracenocryptand silver(I) nitrate complexes. Fluorescence modulated by Ag^+^ as a function of the geometry of the complex Acta Crystallographica Section B, 1995, 51, 293-300 |
| 2101324 | CIF Paper | C32 H45 Ag N3 O7.5 | C 1 2/c 1 | 34.545; 10.035; 38.188 90; 98.83; 90 | 13081.3 | Andrianatoandro, H.; Barrans, Y.; Marsau, P.; Desvergne, J.-P.; Fages, F.; Bouas-Laurent, H. Two 9,10-anthracenocryptand silver(I) nitrate complexes. Fluorescence modulated by Ag^+^ as a function of the geometry of the complex Acta Crystallographica Section B, 1995, 51, 293-300 |
| 2101325 | CIF Paper | C31 H23 Cl O13 | P 21 21 21 | 20.23; 18.921; 8.205 90; 90; 90 | 3140.6 | Prangé, T.; Neuman, A.; Milat, M.-L.; Blein, J. P. The yellow toxins produced by <i>Cercospora beticola</i>. V. Structure of beticolins 2 and 4 Acta Crystallographica Section B, 1995, 51, 308-314 |
| 2101326 | CIF Paper | C31 H23 Cl O14 | P 21 21 21 | 20.585; 18.721; 8.206 90; 90; 90 | 3162.4 | Prangé, T.; Neuman, A.; Milat, M.-L.; Blein, J. P. The yellow toxins produced by <i>Cercospora beticola</i>. V. Structure of beticolins 2 and 4 Acta Crystallographica Section B, 1995, 51, 308-314 |
| 2101327 | CIF Paper | C46 H80 N4 O14 | P 1 | 10.3796; 14.5809; 17.1521 105.225; 96.14; 90.248 | 2489 | Sheldrick, G. M.; Kojić-Prodić, B.; Banić, Z.; Kobrehel, G.; Kujundzić, N. Structure of 9-deoxo-9a-<i>N</i>-[<i>N</i>'-(4-pyridyl)-carbamoyl]-9a-aza-9a-homoerythromycin A and conformational analysis of analogous 9a-aza 15-membered azalides in the solid state Acta Crystallographica Section B, 1995, 51, 358-366 |
| 2101328 | CIF Paper | B17 Be N2 | P 63/m m c | 2.2853; 2.2853; 3.5842 90; 90; 120 | 16.211 | Iversen, B. B.; Larsen, F. K.; Souhassou, M.; Takata, M. Experimental evidence for the existence of non-nuclear maxima in the electron-density distribution of metallic beryllium. A comparative study of the maximum entropy method and the multipole refinement method Acta Crystallographica Section B, 1995, 51, 580-591 |
| 2101329 | CIF Paper | C16 H10 O2 | P 1 21/n 1 | 9.048; 12.6658; 9.6516 90; 94.344; 90 | 1102.9 | Destro, R.; Merati, F. Bond lengths, and beyond Acta Crystallographica Section B, 1995, 51, 559-570 |
| 2101330 | CIF Paper | C16 H24 Br2 N2 O3 | P 21 21 21 | 28.9; 8.747; 7.585 90; 90; 90 | 1917.4 | Stensland, B.; Csöregh, I.; Högberg, T. Conformation of the two potential antipsychotic agents (‒)-(<i>S</i>)-3-bromo-5,6-dimethoxy-<i>N</i>-[(1-ethyl-2-pyrrolidinyl)methyl]benzamide, FLB 457, and its 2-hydroxy analogue, FLB 463 Acta Crystallographica Section B, 1995, 51, 847-856 |
| 2101331 | CIF Paper | C17 H27 Br N2 O7 S | P 1 21 1 | 15.264; 8.087; 8.541 90; 93.44; 90 | 1052.4 | Stensland, B.; Csöregh, I.; Högberg, T. Conformation of the two potential antipsychotic agents (‒)-(<i>S</i>)-3-bromo-5,6-dimethoxy-<i>N</i>-[(1-ethyl-2-pyrrolidinyl)methyl]benzamide, FLB 457, and its 2-hydroxy analogue, FLB 463 Acta Crystallographica Section B, 1995, 51, 847-856 |
| 2101332 | CIF Paper | C7 H7 N O | P 1 21/c 1 | 5.549; 5.033; 21.548 90; 89.22; 90 | 601.7 | Ruble, J. R.; Galvao, A. Electrostatic potentials from charge-density studies of benzamide at 123 K Acta Crystallographica Section B, 1995, 51, 835-838 |
| 2101333 | CIF Paper | C22 H16 Ag N2 O8 S8 | P -1 | 4.0355; 16.7566; 10.2335 82.49; 81.12; 91.1 | 677.3 | Li, R.; Petrícek, V.; Cisarova, I.; Coppens, P. Analysis of the diffraction pattern of a twinned crystal of (3,4;3',4'-bis(ethylenedioxo)-2,2',5,5'-tetrathiafulvalene)~2~.Ag(CN)~2~ Acta Crystallographica Section B, 1995, 51, 798-802 |
| 2101334 | CIF Paper | C26 H19 Cl3 Cu F12 S16 | P n m a | 12.918; 37.899; 8.487 90; 90; 90 | 4155.1 | Geiser, U.; Schlueter, J. A.; Williams, J. M.; Naumann, D.; Roy, T. Anion disorder in the 115–118 K structures of the organic superconductors κ~<i>L~</i>-(BEDT-TTF)~2~Cu(CF~3~)~4~(C~2~H~3~Cl~3~) and κ~<i>L~</i>-(BEDT-TTF)~2~Ag(CF~3~)~4~(C~2~H~3~Cl~3~) [BEDT-TTF=3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene] Acta Crystallographica Section B, 1995, 51, 789-797 |
| 2101335 | CIF Paper | C26 H19 Ag Cl3 F12 S16 | P n m a | 12.936; 37.976; 8.526 90; 90; 90 | 4188.5 | Geiser, U.; Schlueter, J. A.; Williams, J. M.; Naumann, D.; Roy, T. Anion disorder in the 115–118 K structures of the organic superconductors κ~<i>L~</i>-(BEDT-TTF)~2~Cu(CF~3~)~4~(C~2~H~3~Cl~3~) and κ~<i>L~</i>-(BEDT-TTF)~2~Ag(CF~3~)~4~(C~2~H~3~Cl~3~) [BEDT-TTF=3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene] Acta Crystallographica Section B, 1995, 51, 789-797 |
| 2101336 | CIF Paper | C24 H38 I6 N6 | P -1 | 8.226; 8.393; 13.878 85.28; 74.54; 87.96 | 920.3 | Bailey, R. D.; Pennington, W. T. Tetramethylpyrazinium polyiodides Acta Crystallographica Section B, 1995, 51, 810-815 |
| 2101337 | CIF Paper | C30 H40 I6 N4 O4 | P 1 21/n 1 | 7.679; 12.52; 10.774 90; 100.6; 90 | 1018.1 | Bailey, R. D.; Pennington, W. T. Tetramethylpyrazinium polyiodides Acta Crystallographica Section B, 1995, 51, 810-815 |
| 2101338 | CIF Paper | C8 H15 I5 N2 O | P -1 | 8.206; 9.228; 13.936 77.76; 85.23; 65.88 | 941.3 | Bailey, R. D.; Pennington, W. T. Tetramethylpyrazinium polyiodides Acta Crystallographica Section B, 1995, 51, 810-815 |
| 2101339 | CIF Paper | C17 H26 Cl N O3 | P 1 21/n 1 | 16.763; 10.1619; 21.503 90; 97.758; 90 | 3629.4 | Sui, X.; Codding, P. W. Structural and molecular modeling study of mono(pyrrolidiniomethyl)phenylacetate antiarrhythmic agents Acta Crystallographica Section B, 1995, 51, 803-810 |
| 2101340 | CIF Paper | C22 H26 Cl N O5 | P 1 21/c 1 | 15.684; 6.4228; 22.249 90; 109.656; 90 | 2110.7 | Sui, X.; Codding, P. W. Structural and molecular modeling study of mono(pyrrolidiniomethyl)phenylacetate antiarrhythmic agents Acta Crystallographica Section B, 1995, 51, 803-810 |
| 2101341 | CIF Paper | C24 H27 N O8 | P -1 | 8.3651; 25.628; 5.589 95.447; 106.614; 82.653 | 1136.58 | Sui, X.; Codding, P. W. Structural and molecular modeling study of mono(pyrrolidiniomethyl)phenylacetate antiarrhythmic agents Acta Crystallographica Section B, 1995, 51, 803-810 |
| 2101342 | CIF Paper | H3 O4 P | P 1 21/c 1 | 5.779; 4.826; 11.61 90; 95.26; 90 | 322.4 | Moss, G. R.; Souhassou, M.; Blessing, R. H.; Espinosa, E.; Lecomte, C. Computational studies of crystalline H~3~PO~4~ Acta Crystallographica Section B, 1995, 51, 650-660 |
| 2101343 | CIF Paper | H3 O4 P | P 1 21/c 1 | 5.7572; 4.831; 11.574 90; 95.274; 90 | 320.55 | Souhassou, M.; Espinosa, E.; Lecomte, C.; Blessing, R. H. Experimental electron density in crystalline H~3~PO~4~ Acta Crystallographica Section B, 1995, 51, 661-668 |
| 2101344 | CIF Paper | Ca Mg O4 Si | P n m a | 11.1098; 6.3894; 4.8281 90; 90; 90 | 342.72 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Thermal parameters for minerals of the olivine group: their implication on vibrational spectra, thermodynamic functions and transferable force fields Acta Crystallographica Section B, 1995, 51, 721-733 |
| 2101345 | CIF Paper | C38 H31 O5 P | P -1 | 13.501; 14.845; 8.519 102.21; 98.68; 68.7 | 1549.6 | Jones, R.; Liu, Z.; Scheffer, J. R.; Trotter, J. Crystal structures and photochemistry of triphenylphosphine oxide complexes of ethyl hydrogen 9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate Acta Crystallographica Section B, 1995, 51, 888-892 |
| 2101346 | CIF Paper | C41.5 H35 O5 P | P 1 21/n 1 | 8.546; 28.164; 14.368 90; 98.81; 90 | 3417.4 | Jones, R.; Liu, Z.; Scheffer, J. R.; Trotter, J. Crystal structures and photochemistry of triphenylphosphine oxide complexes of ethyl hydrogen 9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate Acta Crystallographica Section B, 1995, 51, 888-892 |
| 2101347 | CIF Paper | Mg O6 Pb2 W | P m c n | 7.944; 5.6866; 11.4059 90; 90; 90 | 515.3 | Baldinozzi, G.; Sciau, Ph.; Pinot, M.; Grebille, D. Crystal structure of the antiferroelectric perovskite Pb~2~MgWO~6~ Acta Crystallographica Section B, 1995, 51, 668-673 |
| 2101348 | CIF Paper | Mg O6 Pb2 W | P m c n | 7.9041; 5.7035; 11.4442 90; 90; 90 | 515.9 | Baldinozzi, G.; Sciau, Ph.; Pinot, M.; Grebille, D. Crystal structure of the antiferroelectric perovskite Pb~2~MgWO~6~ Acta Crystallographica Section B, 1995, 51, 668-673 |
| 2101349 | CIF Paper | Na3 O15 Si6 Y | I b m m | 10.468; 15.247; 8.385 90; 90; 90 | 1338.3 | Haile, S. M.; Maier, J.; Wuensch, B. J.; Laudise, R. A. Structure of Na~3~YSi~6~O~15~ ‒ a unique silicate based on discrete Si~6~O~15~ units, and a possible fast-ion conductor Acta Crystallographica Section B, 1995, 51, 673-680 |
| 2101350 | CIF Paper | C14 H19 I O4 | P 1 21/n 1 | 7.686; 8.113; 24.249 90; 99.96; 90 | 1489.3 | Le Texier, L.; Favre, E.; Godfroid, J.-J.; Halut-Desportes, S. Structure of 5-(3,4,5-trimethoxyphenyl)-2-iodomethyltetrahydrofuran: a precursor of acetylcholinesterase inhibitors with platelet-activating factor antagonistic activity Acta Crystallographica Section B, 1995, 51, 863-867 |
| 2101351 | CIF Paper | Cs3 H4 O12 P S2 | P 1 21/n 1 | 19.546; 7.8798; 9.1854 90; 100.536; 90 | 1390.9 | Haile, S. M.; Kreuer, K.-D.; Maier, J. Structure of Cs~3~(HSO~4~)~2~(H~2~PO~4~) – a new compound with a superprotonic phase transition Acta Crystallographica Section B, 1995, 51, 680-687 |
| 2101352 | CIF Paper | C16 H22 N2 | P 1 21 1 | 8.317; 17.435; 20.011 90; 90.43; 90 | 2901.7 | Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G. Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length Acta Crystallographica Section B, 1995, 51, 823-835 |
| 2101353 | CIF Paper | C17 H24 N2 | P 1 21/c 1 | 9.065; 9.75; 35.191 90; 97.1; 90 | 3086.5 | Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G. Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length Acta Crystallographica Section B, 1995, 51, 823-835 |
| 2101354 | CIF Paper | C18 H26 N2 | P -1 | 6.369; 9.071; 14.682 106.69; 93.69; 93.33 | 808.2 | Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G. Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length Acta Crystallographica Section B, 1995, 51, 823-835 |
| 2101355 | CIF Paper | C19 H28 N2 | P -1 | 11.061; 15.69; 21.641 106.06; 101.27; 100.13 | 3432.6 | Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G. Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length Acta Crystallographica Section B, 1995, 51, 823-835 |
| 2101356 | CIF Paper | C20 H30 N2 | P 1 21/c 1 | 12.331; 11.086; 13.929 90; 102.74; 90 | 1857.2 | Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G. Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length Acta Crystallographica Section B, 1995, 51, 823-835 |
| 2101357 | CIF Paper | C13 H8 Cl2 O | I 1 2/c 1 | 24.62; 6.091; 7.476 90; 100.14; 90 | 1103.6 | Zúñiga, F. J.; Criado, A. Structure at 140 K, lattice dynamics and phase transition of 4,4'-dichlorobenzophenone Acta Crystallographica Section B, 1995, 51, 880-888 |
| 2101358 | CIF Paper | C31 H23 N O2 | P 1 21 1 | 11.64; 9.257; 12.103 90; 114.83; 90 | 1183.6 | Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I. Structure, solid-state photochemistry and reactivity in asymmetric synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide Acta Crystallographica Section B, 1995, 51, 856-863 |
| 2101359 | CIF Paper | C31 H23 N O2 | P b c n | 9.964; 20.181; 11.622 90; 90; 90 | 2337 | Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I. Structure, solid-state photochemistry and reactivity in asymmetric synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide Acta Crystallographica Section B, 1995, 51, 856-863 |
| 2101360 | CIF Paper | C31 H23 N O2 | P 1 21/n 1 | 9.485; 11.014; 22.945 90; 98.62; 90 | 2369.9 | Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I. Structure, solid-state photochemistry and reactivity in asymmetric synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide Acta Crystallographica Section B, 1995, 51, 856-863 |
| 2101361 | CIF Paper | C5 H12 O4 | I -4 | 6.0173; 6.0173; 8.267 90; 90; 90 | 299.33 | Katrusiak, A. High-pressure X-ray diffraction study of pentaerythritol Acta Crystallographica Section B, 1995, 51, 873-879 |
| 2101362 | CIF Paper | C28.5 H13 Cl Co N4 S4 | P -1 | 6.5441; 11.7173; 16.4251 92.092; 95.343; 94.67 | 1248.6 | Lam, E. J. W.; Beurskens, P. T.; Smits, J. M. M.; van Smaalen, S.; de Boer, J. L.; Fan, H.-F. Determination of the incommensurately modulated structure of (perylene)Co(mnt)~2~(CH~2~Cl~2~)~0.5~ by direct methods Acta Crystallographica Section B, 1995, 51, 779-789 |
| 2101363 | CIF Paper | Al2 Be3 H2 Na O19 Si6 | P 6/m c c | 9.278; 9.278; 9.195 90; 90; 120 | 685.5 | Artioli, G.; Rinaldi, R.; Wilson, C. C.; Zanazzi, P. F. Single-crystal pulsed neutron diffraction of a highly hydrous beryl Acta Crystallographica Section B, 1995, 51, 733-737 |
| 2101364 | CIF Paper | Fe5 O12 Y3 | I a -3 d | 12.375; 12.375; 12.375 90; 90; 90 | 1895.1 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101365 | CIF Paper | Fe4 Ga O12 Y3 | I a -3 d | 12.36; 12.36; 12.36 90; 90; 90 | 1888.2 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101366 | CIF Paper | Fe3.4 Ga1.6 O12 Y3 | I a -3 d | 12.351; 12.351; 12.351 90; 90; 90 | 1884.1 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101367 | CIF Paper | Fe3 Ga2 O12 Y3 | I a -3 d | 12.342; 12.342; 12.342 90; 90; 90 | 1880 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101368 | CIF Paper | Fe2.5 Ga2.5 O12 Y3 | I a -3 d | 12.333; 12.333; 12.333 90; 90; 90 | 1875.9 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101369 | CIF Paper | Fe2 Ga3 O12 Y3 | I a -3 d | 12.317; 12.317; 12.317 90; 90; 90 | 1868.6 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101370 | CIF Paper | Fe1.4 Ga3.6 O12 Y3 | I a -3 d | 12.312; 12.312; 12.312 90; 90; 90 | 1866.3 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101371 | CIF Paper | Fe1.2 Ga3.8 O12 Y3 | I a -3 d | 12.302; 12.302; 12.302 90; 90; 90 | 1861.8 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101372 | CIF Paper | Fe0.4 Ga4.6 O12 Y3 | I a -3 d | 12.289; 12.289; 12.289 90; 90; 90 | 1855.9 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101373 | CIF Paper | Ga5 O12 Y3 | I a -3 d | 12.273; 12.273; 12.273 90; 90; 90 | 1848.6 | Nakatsuka, A.; Yoshiasa, A.; Takeno, S. Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure Acta Crystallographica Section B, 1995, 51, 737-745 |
| 2101374 | CIF Paper | C9 H9 Cl3 | P -1 | 7.646; 8.789; 8.827 59.78; 66.03; 72.69 | 465.1 | Tazi, M.; Meinnel, J.; Sanquer, M.; Nusimovici, M.; Tonnard, F.; Carrie, R. Structure of 1,3,5-trichloro-2,4,6-trimethylbenzene at 150 and 297 K, molecular motion and reorientation Acta Crystallographica Section B, 1995, 51, 838-847 |
| 2101375 | CIF Paper | C9 H9 Cl3 | P -1 | 7.738; 8.842; 8.88 59.74; 66.51; 73.06 | 478.1 | Tazi, M.; Meinnel, J.; Sanquer, M.; Nusimovici, M.; Tonnard, F.; Carrie, R. Structure of 1,3,5-trichloro-2,4,6-trimethylbenzene at 150 and 297 K, molecular motion and reorientation Acta Crystallographica Section B, 1995, 51, 838-847 |
| 2101376 | CIF Paper | C22 H20 N2 O | P n a 21 | 8.619; 10.9705; 18.7157 90; 90; 90 | 1769.66 | Olszewski, P. K.; Milart, P.; Stadnicka, K. Structure of (<i>Z</i>,<i>Z</i>)-<i>N</i>-{[2-(4-methylphenyl)-2-(4-methylphenyl)imino]ethylidene}aniline <i>N</i>-oxide: conjugation in systems with the nitrone moiety Acta Crystallographica Section B, 1995, 51, 867-873 |
| 2101377 | CIF Paper | C20 H22 S3 | P 1 21/c 1 | 8.52; 12.434; 18.79 90; 100.91; 90 | 1954.7 | Iwasaki, F.; Sakuratani, M.; Kaneko, H.; Yasui, M.; Kamiya, N.; Iwasaki, H. Structure determination of organic compounds using an in-laboratory rapid X-ray measurement system ‒ comparison with structures determined by a four-circle diffractometer Acta Crystallographica Section B, 1995, 51, 1028-1035 |
| 2101378 | CIF Paper | C20 H22 S3 | P 1 21/c 1 | 8.52; 12.434; 18.79 90; 100.91; 90 | 1954.7 | Iwasaki, F.; Sakuratani, M.; Kaneko, H.; Yasui, M.; Kamiya, N.; Iwasaki, H. Structure determination of organic compounds using an in-laboratory rapid X-ray measurement system ‒ comparison with structures determined by a four-circle diffractometer Acta Crystallographica Section B, 1995, 51, 1028-1035 |
| 2101379 | CIF Paper | C20 H30 O4 | P 1 21/n 1 | 10.885; 10.169; 17.597 90; 104.82; 90 | 1883.1 | Iwasaki, F.; Sakuratani, M.; Kaneko, H.; Yasui, M.; Kamiya, N.; Iwasaki, H. Structure determination of organic compounds using an in-laboratory rapid X-ray measurement system – comparison with structures determined by a four-circle diffractometer Acta Crystallographica Section B, 1995, 51, 1028-1035 |
| 2101380 | CIF Paper | C20 H30 O4 | P 1 21/n 1 | 10.885; 10.169; 17.597 90; 104.82; 90 | 1883.1 | Iwasaki, F.; Sakuratani, M.; Kaneko, H.; Yasui, M.; Kamiya, N.; Iwasaki, H. Structure determination of organic compounds using an in-laboratory rapid X-ray measurement system – comparison with structures determined by a four-circle diffractometer Acta Crystallographica Section B, 1995, 51, 1028-1035 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!