Crystallography Open Database
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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 |
|---|---|---|---|---|---|---|
| 2102482 | CIF Paper | C12 H10 O | F d d 2 | 12.882; 23.533; 5.7815 90; 90; 90 | 1752.7 | Parkin, Sean; Hao, Xiang; Brock, Carolyn Pratt 2-Biphenylol revisited Acta Crystallographica Section B, 2004, 60, 197-203 |
| 2102483 | CIF Paper | C12 H10 O | F d d 2 | 12.875; 23.416; 5.75 90; 90; 90 | 1733.5 | Parkin, Sean; Hao, Xiang; Brock, Carolyn Pratt 2-Biphenylol revisited Acta Crystallographica Section B, 2004, 60, 197-203 |
| 2102484 | CIF HKL Paper | Be F4 H8 N2 | 7.5284; 5.8848; 10.436 90; 90; 90 | 462.35 | Palatinus, Lukáš; Amami, Mongi; van Smaalen, Sander Structure of incommensurate ammonium tetrafluoroberyllate studied by structure refinements and the maximum entropy method Acta Crystallographica Section B, 2004, 60, 127-137 | |
| 2102485 | CIF HKL Paper | C28 H27 N2 O3 P S | P -1 | 9.951; 12.201; 11.844 100.4; 102.9; 102.9 | 1325.6 | Chęcińska, Lilianna; Fábián, László; Kudzin, Zbigniew H. Structural studies of (<i>N</i>-phenylthioureidoalkyl- and -aryl)phosphonates Acta Crystallographica Section B, 2004, 60, 211-218 |
| 2102486 | CIF HKL Paper | C26 H23 N2 O3 P S | P -1 | 9.953; 10.046; 12.701 96.66; 104.45; 99.84 | 1194.8 | Chęcińska, Lilianna; Fábián, László; Kudzin, Zbigniew H. Structural studies of (<i>N</i>-phenylthioureidoalkyl- and -aryl)phosphonates Acta Crystallographica Section B, 2004, 60, 211-218 |
| 2102487 | CIF HKL Paper | C24 H27 N2 O3 P S | P 1 21/c 1 | 10.688; 9.888; 22.961 90; 97.79; 90 | 2404.2 | Chęcińska, Lilianna; Fábián, László; Kudzin, Zbigniew H. Structural studies of (<i>N</i>-phenylthioureidoalkyl- and -aryl)phosphonates Acta Crystallographica Section B, 2004, 60, 211-218 |
| 2102488 | CIF HKL Paper | C12 H14 N2 O4 | P 21 21 21 | 5.2951; 8.1213; 27.256 90; 90; 90 | 1172.09 | Scheins, Stephan; Dittrich, Birger; Messerschmidt, Marc; Luger, Peter; Paulmann, Carsten Atomic volumes and charges in a system with a strong hydrogen bond: <small>L</small>-tryptophan formic acid Acta Crystallographica Section B, 2004, 60, 184-190 |
| 2102489 | CIF Paper | H18 O12 S | C 1 c 1 | 10.56; 10.56; 11.952 90; 116.216; 90 | 1195.7 | Hirsch, Tomas K.; Ojamäe, Lars An investigation of H-atom positions in sulfuric acid crystal structures Acta Crystallographica Section B, 2004, 60, 179-183 |
| 2102490 | CIF Paper | H18 O12 S | C 1 c 1 | 10.56; 10.56; 11.952 90; 116.216; 90 | 1195.7 | Hirsch, Tomas K.; Ojamäe, Lars An investigation of H-atom positions in sulfuric acid crystal structures Acta Crystallographica Section B, 2004, 60, 179-183 |
| 2102491 | CIF Paper | H15 O10.5 S | I 1 m 1 | 6.8182; 26.876; 5.936 90; 121.42; 90 | 928.2 | Hirsch, Tomas K.; Ojamäe, Lars An investigation of H-atom positions in sulfuric acid crystal structures Acta Crystallographica Section B, 2004, 60, 179-183 |
| 2102492 | CIF Paper | H15 O10.5 S | I 1 m 1 | 6.8182; 26.876; 5.936 90; 121.42; 90 | 928.2 | Hirsch, Tomas K.; Ojamäe, Lars An investigation of H-atom positions in sulfuric acid crystal structures Acta Crystallographica Section B, 2004, 60, 179-183 |
| 2102493 | CIF Paper | C78 H76 N2 O4 Si4 | P -1 | 15.2124; 18.958; 23.3561 86.713; 85.727; 81.563 | 6637 | Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds Acta Crystallographica Section B, 2004, 60, 238-248 |
| 2102494 | CIF Paper | C84 H74 N2 O4 Si4 | P -1 | 8.6418; 14.1263; 16.3149 64.5048; 84.1339; 79.7744 | 1768.42 | Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds Acta Crystallographica Section B, 2004, 60, 238-248 |
| 2102495 | CIF Paper | C42 H46 N2 O2 Si2 | P 1 21/c 1 | 14.6528; 8.1361; 16.7852 90; 117.868; 90 | 1769 | Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds Acta Crystallographica Section B, 2004, 60, 238-248 |
| 2102496 | CIF Paper | C48 H46 N2 O3 Si2 | P -1 | 8.7793; 14.3503; 16.8948 76.612; 88.287; 83.816 | 2058.58 | Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds Acta Crystallographica Section B, 2004, 60, 238-248 |
| 2102497 | CIF Paper | C46 H44 N2 O4 Si2 | P -1 | 8.9058; 13.9098; 16.9083 75.053; 88.509; 86.951 | 2020.67 | Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds Acta Crystallographica Section B, 2004, 60, 238-248 |
| 2102498 | CIF Paper | Ir Mg | C m c e | 18.46948; 16.1745; 16.82131 90; 90; 90 | 5025.11 | Cerný, Radovan; Renaudin, Guillaume; Favre-Nicolin, Vincent; Hlukhyy, Viktor; Pöttgen, Rainer Mg~1+<i>x~</i>Ir~1{-~<i>x</i>} (<i>x</i> = 0, 0.037 and 0.054), a binary intermetallic compound with a new orthorhombic structure type determined from powder and single-crystal X-ray diffraction Acta Crystallographica Section B, 2004, 60, 272-281 |
| 2102499 | CIF Paper | Cu2 Se | F 2 3 | 5.8164; 5.8164; 5.8164 90; 90; 90 | 196.772 | Machado, K. D.; de Lima, J. C.; Grandi, T. A.; Campos, C. E. M.; Maurmann, C. E.; Gasperini, A. A. M.; Souza, S. M.; Pimenta, A. F. Structural study of Cu~2{-~<i>x</i>}Se alloys produced by mechanical alloying Acta Crystallographica Section B, 2004, 60, 282-286 |
| 2102500 | CIF Paper | Cu1.8 Se | F m -3 m | 5.7762; 5.7762; 5.7762 90; 90; 90 | 192.72 | Machado, K. D.; de Lima, J. C.; Grandi, T. A.; Campos, C. E. M.; Maurmann, C. E.; Gasperini, A. A. M.; Souza, S. M.; Pimenta, A. F. Structural study of Cu~2{-~<i>x</i>}Se alloys produced by mechanical alloying Acta Crystallographica Section B, 2004, 60, 282-286 |
| 2102501 | CIF Paper | C10 H8 Br N3 O2 | P 1 21/m 1 | 7.0281; 6.9388; 11.5612 90; 106.735; 90 | 539.92 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102502 | CIF Paper | C10 H8 Br N3 O2 | P 1 21/m 1 | 7.018; 6.916; 11.546 90; 106.41; 90 | 537.57 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102503 | CIF Paper | C10 H8 Br N3 O2 | P 1 21/c 1 | 6.9955; 6.8657; 22.99 90; 106.356; 90 | 1059.5 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102504 | CIF Paper | C10 H8 Br N3 O2 | P 1 21/c 1 | 6.9854; 6.8362; 22.945 90; 106.466; 90 | 1050.8 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102505 | CIF Paper | C10 H8 Br N3 O2 | P 1 21/c 1 | 6.9723; 6.8169; 22.9 90; 106.478; 90 | 1043.72 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102506 | CIF Paper | C10 H8 Br N3 O2 | P -1 | 6.9654; 6.8215; 11.3983 92.683; 106.506; 90.277 | 518.6 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102507 | CIF Paper | C10 H8 Br N3 O2 | P 1 21/c 1 | 6.9923; 6.8497; 22.9702 90; 106.419; 90 | 1055.3 | Kubicki, Maciej Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole Acta Crystallographica Section B, 2004, 60, 333-342 |
| 2102508 | CIF Paper | Cl2 H14 N4 O10 Pt2 | P 21 21 21 | 7.3422; 12.9876; 13.9429 90; 90; 90 | 1329.56 | Sakai, Ken; Konno, Yosuke; Takayama, Noboru; Takahashi, Satoru First bent form for the hydroxo-bridged <i>cis</i>-diammineplatinum(II) dimer [Pt~2~(NH~3~)~4~(μ-OH)~2~](ClO~4~)~2~ Acta Crystallographica Section B, 2004, 60, 255-262 |
| 2102509 | CIF Paper | C10 H12 Cu N2 O6 S | I 1 2/a 1 | 6.963; 12.4686; 14.854 90; 101.01; 90 | 1265.9 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102510 | CIF Paper | C8 H22 Cl Co N6 O5 | C m c 21 | 9.515; 11.909; 13.003 90; 90; 90 | 1473.4 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102511 | CIF Paper | C23 H39 N5 O4 Si2 | C 2 2 21 | 13.1422; 12.1676; 34.638 90; 90; 90 | 5538.9 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102512 | CIF Paper | C20 H30 O2 | I 1 2/a 1 | 27.869; 5.771; 11.758 90; 91.43; 90 | 1890.5 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102513 | CIF Paper | C23 H34 Cl2 Cu N4 O | I 1 2/a 1 | 18.63; 16.61; 16.972 90; 108.02; 90 | 4994.3 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102514 | CIF Paper | C32 H38 Ca N4 O12 S2 | C 2 2 21 | 19.036; 6.508; 29.178 90; 90; 90 | 3615 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102515 | CIF Paper | C21 H18 M N10 O2 | C m c 21 | 15.151; 22.13; 6.874 90; 90; 90 | 2305 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102516 | CIF Paper | C13 H12 Cl N O4 | C m c a | 6.707; 17.023; 22.938 90; 90; 90 | 2618.9 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102517 | CIF Paper | C10 H33 N4 O18.5 P | C 2 2 21 | 23.1914; 8.65; 21.9 90; 90; 90 | 4393.3 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102518 | CIF Paper | C18 H22 N2 O8 Zn2 | P 1 21/n 1 | 8.626; 28.871; 8.868 90; 99.02; 90 | 2181.2 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102519 | CIF Paper | C14 H24 Fe N2 O8 | I 1 2/m 1 | 11.78; 9.734; 8.401 90; 104.05; 90 | 934.5 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102520 | CIF Paper | C10 H24 F6 N4 O2 P Re | I 1 2/a 1 | 17.257; 5.533; 18.053 90; 98.14; 90 | 1706.4 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102521 | CIF Paper | C60 H120 Fe6 N12 O24 | C c c a :2 | 20.939; 25.243; 16.048 90; 90; 90 | 8482.4 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102522 | CIF Paper | C120 H104 P4 Pd | C 2 2 21 | 29.327; 16.743; 19.458 90; 90; 90 | 9554 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102523 | CIF Paper | C19 H22 Cl2 Cu N6 O5 S4 | I 1 2/a 1 | 30.123; 7.564; 11.044 90; 91.27; 90 | 2516 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102524 | CIF Paper | C14 H18 Cd N2 O7 | C 1 2/c 1 | 15.2963; 6.2028; 17.815 90; 106.196; 90 | 1623.2 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102525 | CIF Paper | C20 H15 Fe N O2 | P 1 21/n 1 | 10.391; 7.252; 20.662 90; 97.47; 90 | 1543.8 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102526 | CIF Paper | C20 H44 Cl6 Mg3 O14 | P m n a | 13.303; 7.835; 18.169 90; 90; 90 | 1893.7 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102527 | CIF Paper | C12 N6 O12 Re3 | P n m a | 20.639; 16.657; 6.705 90; 90; 90 | 2305.1 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102528 | CIF Paper | C10 H7 N3 S2 | P 1 21/m 1 | 5.628; 7.207; 13.126 90; 100.12; 90 | 524.1 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102529 | CIF Paper | C2 Cl4 O2 Pt2 | P 42/m | 11.183; 11.183; 3.525 90; 90; 90 | 440.8 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102530 | CIF Paper | C7 H9 N O2 | P 1 21/m 1 | 7.11; 6.993; 7.678 90; 117.04; 90 | 340 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102531 | CIF Paper | C38 H33 Cl2 N2 P2 Re S2 | C 1 2/c 1 | 17.514; 10.639; 20.106 90; 102.29; 90 | 3660.5 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102532 | CIF Paper | C12 H19 Cr O4 | C m c a | 16.409; 10.506; 7.825 90; 90; 90 | 1349 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102533 | CIF Paper | C12 H23 Cl3 N P2 Re | C m c m | 11.0341; 16.814; 10.844 90; 90; 90 | 2011.9 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102534 | CIF Paper | C12 H13 Ir3 | C m c m | 11.2624; 9.711; 25.998 90; 90; 90 | 2843.38 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102535 | CIF Paper | C48 H36 Cl6 | P 1 21/n 1 | 15.592; 8.642; 16.677 90; 114.773; 90 | 2040.4 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102536 | CIF Paper | C18 H18 N6 O4 Tc2 | P n n a | 13.869; 10.851; 12.799 90; 90; 90 | 1926.2 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102537 | CIF Paper | C6 H18 Cl2 N2 Pd | C 1 2/m 1 | 8.929; 8.437; 7.542 90; 92.65; 90 | 567.6 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102538 | CIF Paper | C15 H21 F9 O2 | P -1 | 11.253; 13.75; 29.289 78.01; 89.72; 81.16 | 4378.6 | Lehmler, Hans-Joachim; Parkin, Sean; Brock, Carolyn Pratt Packing conflicts in the <i>Z</i>' = 5 structure of CF~3~(CF~2~)~3~(CH~2~)~10~COOH Acta Crystallographica Section B, 2004, 60, 325-332 |
| 2102539 | CIF HKL Paper | C17 H12 N4 O4 | P n a 21 | 14.0059; 5.1399; 41.9853 90; 90; 90 | 3022.48 | Ohashi, Yuji Packing-dependent photochromism: the case of photoinduced intramolecular proton transfer in 6-(2',4'-dinitrobenzyl)-2,2'-bipyridine Acta Crystallographica Section B, 2004, 60, 343-349 |
| 2102540 | CIF HKL Paper | C17 H12 N4 O4 | P 1 21/c 1 | 20.836; 5.2746; 14.0971 90; 104.457; 90 | 1500.24 | Ohashi, Yuji Packing-dependent photochromism: the case of photoinduced intramolecular proton transfer in 6-(2',4'-dinitrobenzyl)-2,2'-bipyridine Acta Crystallographica Section B, 2004, 60, 343-349 |
| 2102541 | CIF HKL Paper | C11 H12 O3 | P -1 | 8.7336; 10.959; 17.2709 91.232; 92.703; 109.472 | 1555.53 | Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism Acta Crystallographica Section B, 2004, 60, 300-314 |
| 2102542 | CIF HKL Paper | C11 H12 O3 | P -1 | 8.7373; 11.0167; 17.295 91.187; 92.775; 108.938 | 1571.62 | Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism Acta Crystallographica Section B, 2004, 60, 300-314 |
| 2102543 | CIF HKL Paper | C11 H12 O3 | P -1 | 8.6759; 11.0003; 17.299 92.552; 92.347; 111.155 | 1535.3 | Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism Acta Crystallographica Section B, 2004, 60, 300-314 |
| 2102544 | CIF HKL Paper | C11 H12 O3 | P -1 | 8.6452; 10.8577; 17.262 92.47; 92.102; 112.563 | 1492.4 | Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism Acta Crystallographica Section B, 2004, 60, 300-314 |
| 2102545 | CIF Paper | C11 H12 O3 | P -1 | 8.6452; 10.8577; 17.262 92.47; 92.102; 112.563 | 1492.4 | Fernandes, Manuel A.; Levendis, D. C. Photodimerization of the α'-polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid in the solid state. I. Monitoring the reaction at 293K Acta Crystallographica Section B, 2004, 60, 315-324 |
| 2102546 | CIF Paper | C11 H12 O3 | P -1 | 8.6164; 10.8765; 17.292 93.157; 92.001; 112.657 | 1490.4 | Fernandes, Manuel A.; Levendis, D. C. Photodimerization of the α'-polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid in the solid state. I. Monitoring the reaction at 293K Acta Crystallographica Section B, 2004, 60, 315-324 |
| 2102547 | CIF Paper | C11 H12 O3 | P -1 | 8.4919; 10.9148; 17.372 96.027; 91.772; 111.956 | 1480.8 | Fernandes, Manuel A.; Levendis, D. C. Photodimerization of the α'-polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid in the solid state. I. Monitoring the reaction at 293K Acta Crystallographica Section B, 2004, 60, 315-324 |
| 2102548 | CIF Paper | C11 H12 O3 | P -1 | 8.3863; 10.9711; 17.427 98.323; 91.809; 111.336 | 1471.6 | Fernandes, Manuel A.; Levendis, D. C. Photodimerization of the α'-polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid in the solid state. I. Monitoring the reaction at 293K Acta Crystallographica Section B, 2004, 60, 315-324 |
| 2102549 | CIF Paper | C33 H36 O9 | P -1 | 8.3099; 11.0026; 17.471 99.768; 91.912; 110.392 | 1468.2 | Fernandes, Manuel A.; Levendis, D. C. Photodimerization of the α'-polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid in the solid state. I. Monitoring the reaction at 293K Acta Crystallographica Section B, 2004, 60, 315-324 |
| 2102550 | CIF Paper | N4 Si3 | P 63/m | 7.6044; 7.6044; 2.9063 90; 90; 120 | 145.546 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102551 | CIF Paper | N4 Si3 | P 63 | 7.6044; 7.6044; 2.9063 90; 90; 120 | 145.546 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102552 | CIF Paper | N4 Si3 | P 63/m | 7.6015; 7.6015; 2.9061 90; 90; 120 | 145.425 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102553 | CIF Paper | N4 Si3 | P 63 | 7.6015; 7.6015; 2.9061 90; 90; 120 | 145.425 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102554 | CIF Paper | N4 Si3 | P 63/m | 7.602; 7.602; 2.906 90; 90; 120 | 145.439 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102555 | CIF Paper | N4 Si3 | P 63 | 7.602; 7.602; 2.906 90; 90; 120 | 145.439 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102556 | CIF Paper | Li3 O13 V6 | C 1 2/m 1 | 11.792; 3.9214; 10.189 90; 100.596; 90 | 463.12 | Höwing, Jonas; Gustafsson, Torbjörn; Thomas, John O. Li~3+{δ~}V~6~O~13~: a short-range-ordered lithium insertion mechanism Acta Crystallographica Section B, 2004, 60, 382-387 |
| 2102557 | CIF Paper | Li3.25 O13 V6 | C 1 2/m 1 | 11.7236; 3.9155; 10.1521 90; 100.592; 90 | 458.08 | Höwing, Jonas; Gustafsson, Torbjörn; Thomas, John O. Li~3+{δ~}V~6~O~13~: a short-range-ordered lithium insertion mechanism Acta Crystallographica Section B, 2004, 60, 382-387 |
| 2102558 | CIF Paper | C16 H24 Cl2 O2 S5 | P 1 21/n 1 | 11.6666; 8.1343; 23.8366 90; 99.6985; 90 | 2229.75 | Rae, David; Linden, Anthony; Majchrzak, Agnieszka; Mloston, Grzegorz; Heimgartner, Heinz Bis(1-chloro-2,2,4,4-tetramethyl-3-oxocyclobutan-1-yl)pentasulfane: an Occupancy Modulated Structure Acta Crystallographica, Section B, 2004, 60, 416-423 |
| 2102559 | CIF Paper | C16 H24 Cl2 O2 S5 | P 1 21/n 1 | 11.6666; 8.1343; 23.8366 90; 99.6985; 90 | 2229.75 | Rae, David; Linden, Anthony; Majchrzak, Agnieszka; Mloston, Grzegorz; Heimgartner, Heinz Bis(1-chloro-2,2,4,4-tetramethyl-3-oxocyclobutan-1-yl)pentasulfane: an Occupancy Modulated Structure Acta Crystallographica, Section B, 2004, 60, 416-423 |
| 2102560 | CIF Paper | F3 K Mn | P m -3 m | 4.185; 4.185; 4.185 90; 90; 90 | 73.3 | Ivanov, Yury; Tanaka, Kiyoaki Electron density and electrostatic potential of KMnF~3~: A phase transition study Acta Crystallographica, Section B, 2004, 60, 359-368 |
| 2102561 | CIF Paper | F3 K Mn | P m -3 m | 4.1869; 4.1869; 4.1869 90; 90; 90 | 73.4 | Ivanov, Yury; Tanaka, Kiyoaki Electron density and electrostatic potential of KMnF~3~: A phase transition study Acta Crystallographica, Section B, 2004, 60, 359-368 |
| 2102562 | CIF Paper | F3 K Mn | P m -3 m | 4.1893; 4.1893; 4.1893 90; 90; 90 | 73.52 | Ivanov, Yury; Tanaka, Kiyoaki Electron density and electrostatic potential of KMnF~3~: A phase transition study Acta Crystallographica, Section B, 2004, 60, 359-368 |
| 2102563 | CIF Paper | C12 H22 O11 | P 1 21 1 | 7.7795; 19.6931; 4.90643 90; 103.691; 90 | 730.32 | Cyril Platteau; Jacques Lefebvre; Frederic Affouard; Patrick Derollez <i>Ab initio</i> structure determination of the hygroscopic anhydrous form of α-lactose by powder X-ray diffraction Acta Crystallographica Section B, 2004, 60, 453-460 |
| 2102564 | CIF HKL Paper | C8 H8 O6 | P -1 | 3.6673; 9.7608; 11.8421 97.647; 90.219; 100.537 | 412.87 | Bawa, Shaleen; Coté, Marie L.; Dubois, Patrick; Lalancette, Roger A.; Thompson, Hugh W. 2-Hydroxyisophthalic acid: hydrogen-bonding patterns in the monohydrate and the tetraphenylphosphonium salt. An instance of dramatic acidity enhancement by symmetric, internally hydrogen-bonded anion stabilization Acta Crystallographica Section B, 2004, 60, 438-446 |
| 2102565 | CIF HKL Paper | C32 H25 O5 P | P 1 21/c 1 | 15.287; 8.027; 22.144 90; 101.15; 90 | 2666 | Bawa, Shaleen; Coté, Marie L.; Dubois, Patrick; Lalancette, Roger A.; Thompson, Hugh W. 2-Hydroxyisophthalic acid: hydrogen-bonding patterns in the monohydrate and the tetraphenylphosphonium salt. An instance of dramatic acidity enhancement by symmetric, internally hydrogen-bonded anion stabilization Acta Crystallographica Section B, 2004, 60, 438-446 |
| 2102566 | CIF Paper | C26 H38 O21 S2 | C 1 2 1 | 21.3279; 8.9299; 8.8382 90; 99.4537; 90 | 1660.43 | Baddeley, Thomas C.; Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, James L. Supramolecular structures of substituted α,α'-trehalose derivatives Acta Crystallographica Section B, 2004, 60, 461-471 |
| 2102567 | CIF Paper | C38 H46 O21 S2 | P 21 21 21 | 18.1484; 21.1046; 23.4224 90; 90; 90 | 8971.1 | Baddeley, Thomas C.; Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, James L. Supramolecular structures of substituted α,α'-trehalose derivatives Acta Crystallographica Section B, 2004, 60, 461-471 |
| 2102568 | CIF Paper | C24.7 H34.1 N6 O15.35 | P 21 21 21 | 12.2281; 15.5803; 18.1066 90; 90; 90 | 3449.6 | Baddeley, Thomas C.; Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, James L. Supramolecular structures of substituted α,α'-trehalose derivatives Acta Crystallographica Section B, 2004, 60, 461-471 |
| 2102569 | CIF Paper | C24 H40 N2 O17 | P 21 21 2 | 8.8385; 21.8363; 8.0831 90; 90; 90 | 1560.04 | Baddeley, Thomas C.; Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, James L. Supramolecular structures of substituted α,α'-trehalose derivatives Acta Crystallographica Section B, 2004, 60, 461-471 |
| 2102570 | CIF Paper | C12 H28 N2 O11 | P 43 21 2 | 8.6093; 8.6093; 22.1566 90; 90; 90 | 1642.25 | Baddeley, Thomas C.; Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, James L. Supramolecular structures of substituted α,α'-trehalose derivatives Acta Crystallographica Section B, 2004, 60, 461-471 |
| 2102571 | CIF Paper | C13 H11 I N2 O2 | P 1 21/c 1 | 16.1564; 9.3589; 8.3326 90; 96.333; 90 | 1252.25 | Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L. Isomeric iodo-<i>N</i>-(nitrobenzyl)anilines: interplay of hard and soft hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions Acta Crystallographica Section B, 2004, 60, 472-480 |
| 2102572 | CIF Paper | C13 H11 I N2 O2 | P 21 21 21 | 7.0966; 12.5908; 13.836 90; 90; 90 | 1236.27 | Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L. Isomeric iodo-<i>N</i>-(nitrobenzyl)anilines: interplay of hard and soft hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions Acta Crystallographica Section B, 2004, 60, 472-480 |
| 2102573 | CIF Paper | C13 H11 I N2 O2 | P 1 21/c 1 | 21.2778; 8.1809; 7.2793 90; 94.316; 90 | 1263.53 | Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L. Isomeric iodo-<i>N</i>-(nitrobenzyl)anilines: interplay of hard and soft hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions Acta Crystallographica Section B, 2004, 60, 472-480 |
| 2102574 | CIF Paper | C13 H11 I N2 O2 | P -1 | 8.1685; 10.8834; 15.4372 76.9219; 80.0727; 74.2167 | 1277.36 | Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L. Isomeric iodo-<i>N</i>-(nitrobenzyl)anilines: interplay of hard and soft hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions Acta Crystallographica Section B, 2004, 60, 472-480 |
| 2102575 | CIF Paper | C23 H22 N2 O4 | P 1 21 1 | 5.0472; 11.3381; 16.8796 90; 94.331; 90 | 963.19 | Ferretti, Valeria; Gilli, Paola; Borea, Pier Andrea Structural features controlling the binding of β-carbolines to the benzodiazepine receptor Acta Crystallographica Section B, 2004, 60, 481-489 |
| 2102576 | CIF Paper | C23 H22 N2 O4 | P 21 21 21 | 9.9033; 11.5758; 17.1805 90; 90; 90 | 1969.55 | Ferretti, Valeria; Gilli, Paola; Borea, Pier Andrea Structural features controlling the binding of β-carbolines to the benzodiazepine receptor Acta Crystallographica Section B, 2004, 60, 481-489 |
| 2102577 | CIF Paper | C13 H11 N3 O | C 1 2/c 1 | 14.3632; 7.6804; 19.6712 90; 90.934; 90 | 2169.74 | Ferretti, Valeria; Gilli, Paola; Borea, Pier Andrea Structural features controlling the binding of β-carbolines to the benzodiazepine receptor Acta Crystallographica Section B, 2004, 60, 481-489 |
| 2102578 | CIF Paper | C13 H14 Cl N2 O1.5 | C 1 2/c 1 | 16.9891; 12.5409; 13.7967 90; 121.896; 90 | 2495.67 | Ferretti, Valeria; Gilli, Paola; Borea, Pier Andrea Structural features controlling the binding of β-carbolines to the benzodiazepine receptor Acta Crystallographica Section B, 2004, 60, 481-489 |
| 2102579 | CIF Paper | C34 H45 N5 O7 S2 | P 1 21 1 | 10.5077; 13.2881; 13.515 90; 101.924; 90 | 1846.3 | Doi, Mitsunobu; Kimura, Tooru; Ishida, Toshimasa; Kiso, Yoshiaki Rigid backbone moiety of KNI-272, a highly selective HIV protease inhibitor: methanol, acetone and dimethylsulfoxide solvated forms of 3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-<i>N</i>-<i>tert</i>-butyl-1,3-thiazolidine-4-carboxamide Acta Crystallographica Section B, 2004, 60, 433-437 |
| 2102580 | CIF Paper | C35 H47 N5 O7 S3 | C 1 2 1 | 29.39; 12.882; 10.609 90; 103.373; 90 | 3907.7 | Doi, Mitsunobu; Kimura, Tooru; Ishida, Toshimasa; Kiso, Yoshiaki Rigid backbone moiety of KNI-272, a highly selective HIV protease inhibitor: methanol, acetone and dimethylsulfoxide solvated forms of 3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-<i>N</i>-<i>tert</i>-butyl-1,3-thiazolidine-4-carboxamide Acta Crystallographica Section B, 2004, 60, 433-437 |
| 2102581 | CIF Paper | C39 H53 N5 O8 S2 | P 1 21 1 | 10.6395; 13.213; 14.6921 90; 98.931; 90 | 2040.4 | Doi, Mitsunobu; Kimura, Tooru; Ishida, Toshimasa; Kiso, Yoshiaki Rigid backbone moiety of KNI-272, a highly selective HIV protease inhibitor: methanol, acetone and dimethylsulfoxide solvated forms of 3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-<i>N</i>-<i>tert</i>-butyl-1,3-thiazolidine-4-carboxamide Acta Crystallographica Section B, 2004, 60, 433-437 |
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