Crystallography Open Database
Search results
Result: there are 393 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 62
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2100345 | CIF Paper | C3 H9 Cl Si | P m n 21 | 7.785; 6.43; 6.254 90; 90; 90 | 313.1 | Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs Acta Crystallographica Section B, 2006, 62, 86-93 |
2100346 | CIF Paper | C3 H9 Cl Si | P m n 21 | 7.768; 6.42; 6.233 90; 90; 90 | 310.8 | Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs Acta Crystallographica Section B, 2006, 62, 86-93 |
2100347 | CIF Paper | C3 H9 Cl Si | P m n 21 | 7.668; 6.34; 6.159 90; 90; 90 | 299.4 | Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs Acta Crystallographica Section B, 2006, 62, 86-93 |
2100348 | CIF Paper | C6 H6 | P b c a | 7.287; 9.2; 6.688 90; 90; 90 | 448.4 | Budzianowski, Armand; Katrusiak, Andrzej Pressure-frozen benzene I revisited Acta Crystallographica Section B, 2006, 62, 94-101 |
2100349 | CIF Paper | C6 H6 | P b c a | 7.221; 9.05; 6.59 90; 90; 90 | 430.7 | Budzianowski, Armand; Katrusiak, Andrzej Pressure-frozen benzene I revisited Acta Crystallographica Section B, 2006, 62, 94-101 |
2100350 | CIF Paper | C6 H6 | P b c a | 7.243; 9.31; 6.756 90; 90; 90 | 455.6 | Budzianowski, Armand; Katrusiak, Andrzej Pressure-frozen benzene I revisited Acta Crystallographica Section B, 2006, 62, 94-101 |
2100351 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 11.757; 29.752; 6.5547 90; 90; 90 | 2292.8 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100352 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 11.7903; 29.728; 6.5519 90; 90; 90 | 2296.5 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100353 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 11.847; 29.649; 6.5443 90; 90; 90 | 2298.7 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100354 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 11.8971; 29.579; 6.535 90; 90; 90 | 2299.7 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100355 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 11.9628; 29.503; 6.5269 90; 90; 90 | 2303.6 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100356 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.053; 29.385; 6.5093 90; 90; 90 | 2305.4 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100357 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.14; 29.258; 6.4918 90; 90; 90 | 2305.8 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100358 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.364; 28.956; 6.4582 90; 90; 90 | 2312.1 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100359 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.4079; 28.861; 6.4428 90; 90; 90 | 2307.2 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100360 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.4288; 28.809; 6.4326 90; 90; 90 | 2303.3 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100361 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.4407; 28.779; 6.4272 90; 90; 90 | 2301.1 | Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization Acta Crystallographica Section B, 2006, 62, 128-134 |
2100362 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.4509; 28.753; 6.4239 90; 90; 90 | 2299.8 | Acta Crystallographica, Section B, 2006, 62, 128-134 |
2100363 | CIF Paper | C27 H33 N O3 | P 21 21 21 | 12.4537; 28.749; 6.424 90; 90; 90 | 2300 | Acta Crystallographica, Section B, 2006, 62, 128-134 |
2100364 | CIF Paper | Al0.1 Nd0.7 O3 Ti0.9 | C 1 2/m 1 | 7.67637; 7.64297; 7.71137 90; 90.042; 90 | 452.428 | Zhang, Zhaoming; Howard, Christopher J.; Knight, Kevin S.; Lumpkin, Gregory R. Structures of the cation-deficient perovskite Nd~0.7~Ti~0.9~Al~0.1~O~3~ from high-resolution neutron powder diffraction in combination with group-theoretical analysis Acta Crystallographica Section B, 2006, 62, 60-67 |
2100365 | CIF Paper | Al0.1 Nd0.7 O3 Ti0.9 | C m m m | 7.71021; 7.69428; 7.74755 90; 90; 90 | 459.62 | Zhang, Zhaoming; Howard, Christopher J.; Knight, Kevin S.; Lumpkin, Gregory R. Structures of the cation-deficient perovskite Nd~0.7~Ti~0.9~Al~0.1~O~3~ from high-resolution neutron powder diffraction in combination with group-theoretical analysis Acta Crystallographica Section B, 2006, 62, 60-67 |
2100366 | CIF HKL Paper | C7 H3 Cl2 N O | P -1 | 7.3325; 8.999; 12.221 78.65; 74.39; 74.23 | 740.7 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100367 | CIF HKL Paper | C10 H6 Cl2 N O | P -1 | 7.42; 8.386; 8.808 73.82; 66.99; 79.04 | 482.4 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100368 | CIF HKL Paper | C9 H5.5 Cl2 N O | P 1 21/n 1 | 4.5522; 15.067; 13.636 90; 98; 90 | 926.2 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100369 | CIF HKL Paper | C7 H3 Br2 N O | P -1 | 8.244; 9.12; 11.687 95.6; 108.55; 106.13 | 783.4 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100370 | CIF Paper | C7 H3 Br2 N O | P -1 | 3.9684; 12.669; 16.047 79.68; 83.71; 83.06 | 784.7 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100371 | CIF Paper | C7 H3 I2 N O | P -1 | 8.648; 9.393; 12.12 97.32; 109.86; 105.59 | 865.5 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100372 | CIF HKL Paper | C7 H3 I2 N O | P 1 21/c 1 | 15.657; 14.32; 7.724 90; 91.9; 90 | 1730.8 | Britton, Doyle 3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates Acta Crystallographica Section B, 2006, 62, 109-117 |
2100373 | CIF Paper | Al596 Cr156 | P 63/m m c | 32.3; 32.3; 12.4 90; 90; 120 | 11203.6 | Zhang, H.; He, Z.B.; Oleynikov, P.; Zou, X. D.; Hovmöller, S.; Kuo, K. H. Structure model for the τ(μ) phase in Al‒Cr‒Si alloys deduced from the λ phase by the strong-reflections approach Acta Crystallographica Section B, 2006, 62, 16-25 |
2100374 | CIF HKL Paper | C10 H12 N5 O5 P | P -1 | 8.9243; 10.72; 14.295 91.41; 100.75; 108.85 | 1266.2 | Ślósarek, G.; Kozak, M.; Gierszewski, J.; Pietraszko, A. Structure of <i>N</i>^6^-furfurylaminopurine (kinetin) dihydrogenphosphate Acta Crystallographica Section B, 2006, 62, 102-108 |
2100375 | CIF Paper | C10 H12 N5 O5 P | P -1 | 4.4923; 10.736; 14.455 91; 100.92; 108.47 | 647 | Ślósarek, G.; Kozak, M.; Gierszewski, J.; Pietraszko, A. Structure of <i>N</i>^6^-furfurylaminopurine (kinetin) dihydrogenphosphate Acta Crystallographica Section B, 2006, 62, 102-108 |
2100376 | CIF Paper | C7 H7 Br N2 O | P -1 | 7.269; 7.709; 8.403 67.01; 68.03; 72 | 394.61 | Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I. Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP Acta Crystallographica Section B, 2006, 62, 135-142 |
2100377 | CIF Paper | C15 H14 Br N3 O4 | P 1 21 1 | 7.359; 12.987; 8.159 90; 105.95; 90 | 749.7 | Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I. Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP Acta Crystallographica Section B, 2006, 62, 135-142 |
2100378 | CIF Paper | C15 H13 Br N2 O2 | P 21 21 21 | 8.851; 10.014; 15.895 90; 90; 90 | 1408.8 | Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I. Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP Acta Crystallographica Section B, 2006, 62, 135-142 |
2100379 | CIF Paper | C2 H5 N3 O S | P 1 21/c 1 | 7.2569; 7.4263; 9.593 90; 98.606; 90 | 511.2 | Munshi, Parthapratim; Thakur, T. S.; Guru Row, T. N.; Desiraju, G. R. Five varieties of hydrogen bond in 1-formyl-3-thiosemicarbazide: an electron density study Acta Crystallographica Section B, 2006, 62, 118-127 |
2100380 | CIF Paper | C2 H5 N3 O S | P 1 21/c 1 | 7.2339; 7.3703; 9.4771 90; 98.426; 90 | 499.83 | Munshi, Parthapratim; Thakur, T. S.; Guru Row, T. N.; Desiraju, G. R. Five varieties of hydrogen bond in 1-formyl-3-thiosemicarbazide: an electron density study Acta Crystallographica Section B, 2006, 62, 118-127 |
2100381 | CIF Paper | C2 H5 N3 O S | P 1 21/c 1 | 7.2359; 7.3713; 9.4768 90; 98.403; 90 | 500.05 | Munshi, Parthapratim; Thakur, T. S.; Guru Row, T. N.; Desiraju, G. R. Five varieties of hydrogen bond in 1-formyl-3-thiosemicarbazide: an electron density study Acta Crystallographica Section B, 2006, 62, 118-127 |
2100382 | CIF Paper | C6 H5 N O3 | P 1 21/c 1 | 6.138; 8.874; 11.702 90; 103.05; 90 | 620.9 | Wójcik, Grażyna; Mossakowska, Izabela Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol Acta Crystallographica Section B, 2006, 62, 143-152 |
2100383 | CIF Paper | C6 H5 N O3 | P 1 21/c 1 | 6.136; 8.8; 11.481 90; 103.4; 90 | 603.1 | Wójcik, Grażyna; Mossakowska, Izabela Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol Acta Crystallographica Section B, 2006, 62, 143-152 |
2100384 | CIF Paper | C6 H5 N O3 | P 1 21/c 1 | 6.146; 8.903; 11.763 90; 103.09; 90 | 626.9 | Wójcik, Grażyna; Mossakowska, Izabela Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol Acta Crystallographica Section B, 2006, 62, 143-152 |
2100385 | CIF Paper | C6 H5 N O3 | P 1 21/n 1 | 3.774; 11.147; 14.695 90; 92.6; 90 | 617.6 | Wójcik, Grażyna; Mossakowska, Izabela Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol Acta Crystallographica Section B, 2006, 62, 143-152 |
2100386 | CIF Paper | C6 H5 N O3 | P 1 21/n 1 | 3.678; 11.091; 14.627 90; 92.75; 90 | 596 | Wójcik, Grażyna; Mossakowska, Izabela Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol Acta Crystallographica Section B, 2006, 62, 143-152 |
2100387 | CIF Paper | C6 H5 N O3 | P 1 21/n 1 | 3.831; 11.093; 14.835 90; 93.45; 90 | 629.3 | Wójcik, Grażyna; Mossakowska, Izabela Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol Acta Crystallographica Section B, 2006, 62, 143-152 |
2100388 | CIF Paper | Hf0.006 O1.968 Zr0.994 | P 42/n m c | 3.58651; 3.58651; 5.16658 90; 90; 90 | 66.458 | Yashima, Masatomo; Tsunekawa, Shin Crystal structures and the oxygen deficiency of tetragonal and monoclinic zirconium oxide nanoparticles Acta Crystallographica, Section B, 2006, 62, 161-164 |
2100389 | CIF Paper | ? | P 42/n m c :1 | 3.58651; 3.58651; 5.16658 90; 90; 90 | 66.46 | Yashima, Masatomo; Tsunekawa, Shin Crystal structures and the oxygen deficiency of tetragonal and monoclinic zirconium oxide nanoparticles Acta Crystallographica, Section B, 2006, 62, 161-164 |
2100390 | CIF Paper | C21 H9 D14 N S | P 1 21 1 | 8.5992; 10.1263; 10.0412 90; 98.364; 90 | 865.07 | Hosoya, Takaaki; Uekusa, Hidehiro; Ohashi, Yuji; Ohhara, Takashi; Tanaka, Ichiro; Niimura, Nobuo Neutron diffraction analysis of deuterium transfer in chiral β-thiolactam formation in the crystalline state Acta Crystallographica Section B, 2006, 62, 153-160 |
2100391 | CIF Paper | C21 H9 D14 N S | P 1 21 1 | 8.7075; 10.2068; 10.0908 90; 99.909; 90 | 883.45 | Hosoya, Takaaki; Uekusa, Hidehiro; Ohashi, Yuji; Ohhara, Takashi; Tanaka, Ichiro; Niimura, Nobuo Neutron diffraction analysis of deuterium transfer in chiral β-thiolactam formation in the crystalline state Acta Crystallographica Section B, 2006, 62, 153-160 |
2100392 | CIF Paper | C21 H9 D14 N S | P 1 21 1 | 8.9117; 10.5512; 10.3463 90; 102.589; 90 | 949.5 | Hosoya, Takaaki; Uekusa, Hidehiro; Ohashi, Yuji; Ohhara, Takashi; Tanaka, Ichiro; Niimura, Nobuo Neutron diffraction analysis of deuterium transfer in chiral β-thiolactam formation in the crystalline state Acta Crystallographica Section B, 2006, 62, 153-160 |
2100393 | CIF Paper | H8.6 K2.6 Li9.4 O42.3 Si16 | P 1 21/m 1 | 6.56; 23.057; 6.978 90; 90.08; 90 | 1055.4 | Park, So-Hyun; Boysen, Hans; Parise, John B. Structural disorder of a new zeolite-like lithosilicate, K~2.6~Li~5.4~[Li~4~Si~16~O~38~]·4.3H~2~O Acta Crystallographica Section B, 2006, 62, 42-51 |
2100394 | CIF Paper | C48 H108 O20 P4 Re4 U | I -4 2 m | 15.5404; 15.5404; 14.8191 90; 90; 90 | 3578.9 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100395 | CIF Paper | C48 H108 O20 P4 Re4 U | C m c 21 | 21.5289; 21.9148; 14.8288 90; 90; 90 | 6996.3 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100396 | CIF Paper | C48 H108 O20 P4 Re4 U | C m c 21 | 21.4344; 21.7929; 14.7782 90; 90; 90 | 6903.2 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100397 | CIF Paper | C48 H108 O20 P4 Re4 U | C 1 c 1 | 21.4; 21.68; 14.78 90; 90; 90 | 6857 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100398 | CIF Paper | C48 H108 O20 P4 Re4 Th | I -4 2 m | 15.5577; 15.5577; 14.873 90; 90; 90 | 3599.9 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100399 | CIF Paper | C48 H108 O20 P4 Re4 Th | C m c 21 | 21.721; 21.738; 14.8793 90; 90; 90 | 7025.6 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100400 | CIF Paper | C48 H108 O20 P4 Re4 Th | C m c 21 | 21.61; 21.623; 14.8324 90; 90; 90 | 6930.8 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100401 | CIF Paper | C48 H108 O20 P4 Re4 Th | C m c 21 | 21.535; 21.548; 14.795 90; 90; 90 | 6865.4 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100402 | CIF Paper | C48 H108 O20 P4 Tc4 Th | I -4 3 m | 15.3423; 15.3423; 15.3423 90; 90; 90 | 3611.4 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100403 | CIF Paper | C48 H108 O20 P4 Tc4 Th | C m c 21 | 21.444; 21.582; 14.736 90; 90; 90 | 6819.9 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100404 | CIF Paper | C48 H108 O20 P4 Tc4 Th | P b c 21 | 21.417; 21.649; 14.848 90; 90; 90 | 6884 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100405 | CIF Paper | C48 H108 O20 P4 Tc4 Th | P b c 21 | 21.358; 21.651; 14.79 90; 90; 90 | 6839 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100406 | CIF Paper | C48 H108 O20 P4 Tc4 Th | P b c 21 | 21.386; 21.732; 14.82 90; 90; 90 | 6888 | M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc) Acta Crystallographica Section B, 2006, 62, 68-85 |
2100407 | CIF HKL Paper | Ce4 Cl0.92 N6.92 O3.16 Si4 | P 21 3 | 10.347; 10.347; 10.347 90; 90; 90 | 1107.8 | Friedrich, Alexandra; Haussuehl, Eiken; Morgenroth, Wolfgang; Lieb, Alexandra; Winkler, Björn; Knorr, Karsten; Schnick, Wolfgang Crystal structure of the high-pressure phase of the oxonitridosilicate chloride Ce~4~[Si~4~O~3+<i>x~</i>N~7{-~<i>x</i>}]Cl~1{-~<i>x</i>}O~<i>x~</i>, <i>x</i> ≃0.2 Acta Crystallographica Section B, 2006, 62, 205-211 |
2100408 | CIF HKL Paper | Ce4 Cl0.93 N6.93 O3.14 Si4 | P 21 3 | 10.223; 10.223; 10.223 90; 90; 90 | 1068.4 | Friedrich, Alexandra; Haussuehl, Eiken; Morgenroth, Wolfgang; Lieb, Alexandra; Winkler, Björn; Knorr, Karsten; Schnick, Wolfgang Crystal structure of the high-pressure phase of the oxonitridosilicate chloride Ce~4~[Si~4~O~3+<i>x~</i>N~7{-~<i>x</i>}]Cl~1{-~<i>x</i>}O~<i>x~</i>, <i>x</i> ≃0.2 Acta Crystallographica Section B, 2006, 62, 205-211 |
2100409 | CIF HKL Paper | Ce4 Cl0.93 N6.93 O3.14 Si4 | P 21 21 21 | 10.824; 10.479; 8.967 90; 90; 90 | 1017.1 | Friedrich, Alexandra; Haussuehl, Eiken; Morgenroth, Wolfgang; Lieb, Alexandra; Winkler, Björn; Knorr, Karsten; Schnick, Wolfgang Crystal structure of the high-pressure phase of the oxonitridosilicate chloride Ce~4~[Si~4~O~3+<i>x~</i>N~7{-~<i>x</i>}]Cl~1{-~<i>x</i>}O~<i>x~</i>, <i>x</i> ≃0.2 Acta Crystallographica Section B, 2006, 62, 205-211 |
2100410 | CIF Paper | C42 H28 | C m c a | 26.789; 7.17; 14.211 90; 90; 90 | 2729.6 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100411 | CIF Paper | C42 H28 | C m c a | 26.789; 7.173; 14.246 90; 90; 90 | 2737.5 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100412 | CIF Paper | C42 H28 | C m c a | 26.775; 7.168; 14.258 90; 90; 90 | 2736.4 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100413 | CIF Paper | C42 H28 | C m c a | 26.828; 7.181; 14.306 90; 90; 90 | 2756.1 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100414 | CIF Paper | C42 H28 | C m c a | 26.838; 7.181; 14.332 90; 90; 90 | 2762.1 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100415 | CIF Paper | C42 H28 | C m c a | 26.818; 7.174; 14.348 90; 90; 90 | 2760.4 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100416 | CIF Paper | C42 H28 | C m c a | 26.938; 7.211; 14.461 90; 90; 90 | 2809 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100417 | CIF Paper | C42 H28 | C m c a | 26.86; 7.193; 14.433 90; 90; 90 | 2788.5 | Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M. Low-temperature structure of rubrene single crystals grown by vapor transport Acta Crystallographica Section B, 2006, 62, 330-334 |
2100418 | CIF Paper | C18 H18 Cl2 N2 O4 Sn | P -1 | 7.1204; 12.5017; 12.578 114.424; 92.562; 104.354 | 973.78 | Somphon, Weenawan; Haller, Kenneth J.; Ng, Seik Weng; Rae, A. David Packing and polytypism in 1,10-phenanthrolin-1-ium (2-carboxyethyl)(2-carboxylatoethyl)dichlorostannate(IV) Acta Crystallographica Section B, 2006, 62, 255-261 |
2100419 | CIF Paper | C3 H7 N O2 S | P 21 21 21 | 8.1109; 12.1621; 5.421 90; 90; 90 | 534.76 | Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV Acta Crystallographica Section B, 2006, 62, 296-309 |
2100420 | CIF Paper | C3 H7 N O2 S | P 21 21 21 | 7.4146; 12; 5.3318 90; 90; 90 | 474.4 | Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV Acta Crystallographica Section B, 2006, 62, 296-309 |
2100421 | CIF Paper | C3 H7 N O2 S | P 21 21 21 | 8.0558; 10.4883; 5.3471 90; 90; 90 | 451.79 | Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV Acta Crystallographica Section B, 2006, 62, 296-309 |
2100422 | CIF Paper | C3 H7 N O2 S | P 21 21 21 | 7.9981; 10.2976; 5.284 90; 90; 90 | 435.2 | Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV Acta Crystallographica Section B, 2006, 62, 296-309 |
2100423 | CIF Paper | C3 H7 N O2 S | P 1 21 1 | 8.105; 5.442; 10.916 90; 94.897; 90 | 479.7 | Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV Acta Crystallographica Section B, 2006, 62, 296-309 |
2100424 | CIF Paper | C21 H45 F6 N4 Ni O6 P | P 21 3 | 14.008; 14.008; 14.008 90; 90; 90 | 2748.7 | Farrugia, L. J.; Frampton, C. S.; Howard, J. A. K.; Mallinson, P. R.; Peacock, R. D.; Smith, G. T.; Stewart, B. Experimental charge-density study on the nickel(II) coordination complex [Ni(H~3~<i>L</i>)][NO~3~][PF~6~] [H~3~<i>L</i> = <i>N</i>,<i>N</i>',<i>N</i>''-tris(2-hydroxy-3-methylbutyl)-1,4,7-triazacyclononane]: a reappraisal Acta Crystallographica Section B, 2006, 62, 236-244 |
2100425 | CIF Paper | C16 H26 O6 | P 31 | 18.685; 18.685; 12.2539 90; 90; 120 | 3705.03 | A. David Rae; Anthony C. Willis; David T. Loong; Martin G. Banwell (<i>Z</i>,2<i>R</i>,3<i>R</i>,4a<i>R</i>,7<i>R</i>,12a<i>S</i>)-2,3,7,8,12,12a-Hexahydro-2,3-dimethoxy-2,3,7-trimethyl-4a<i>H</i>-[1,4]dioxino[2,3-<i>c</i>]oxecin-5(11<i>H</i>)-one: a commensurate occupationally modulated structure revealing a condition for diffraction symmetry enhancement for non-parent reflections Acta Crystallographica Section B, 2006, 62, 262-267 |
2100426 | CIF Paper | Ba1.117 Ni0.117 O3 Rh0.883 | R-3m(00\g)0s | 10.0576; 10.0576; 2.5862 90; 90; 120 | 226.56 | Schönleber, Andreas; Zúñiga, F. Javier; Perez-Mato, J. Manuel; Darriet, Jacques; zur Loye, Hans-Conrad Description of Ba~1+<i>x~</i>Ni~<i>x~</i>Rh~1{-~<i>x</i>}O~3~ with <i>x</i> = 0.1170(5) in superspace: modulated composite <i>versus</i> modulated-layer structure Acta Crystallographica Section B, 2006, 62, 197-204 |
2100427 | CIF Paper | Ba Ni0.105 O2.686 Rh0.791 | X-3c1(00\g)000 | 10.0576; 10.0576; 4.6306 90; 90; 120 | 405.65 | Schönleber, Andreas; Zúñiga, F. Javier; Perez-Mato, J. Manuel; Darriet, Jacques; zur Loye, Hans-Conrad Description of Ba~1+<i>x~</i>Ni~<i>x~</i>Rh~1{-~<i>x</i>}O~3~ with <i>x</i> = 0.1170(5) in superspace: modulated composite <i>versus</i> modulated-layer structure Acta Crystallographica Section B, 2006, 62, 197-204 |
2100428 | CIF HKL Paper | Ba0.38 K0.085 Na0.07 Nb2 O6 Sr0.56 | X4bm | 12.4375; 12.4375; 7.8807 90; 90; 90 | 1219.08 | Surmin, Audrey; Fertey, Pierre; Schaniel, Dominik; Woike, Theo Modulated structure of potassium sodium strontium barium niobates (KNSBN): harmonic solution Acta Crystallographica Section B, 2006, 62, 228-235 |
2100429 | CIF HKL Paper | Ba0.26 K0.09 Na0.08 Nb2 O6 Sr0.67 | X4bm | 12.4292; 12.4292; 7.8524 90; 90; 90 | 1213.08 | Surmin, Audrey; Fertey, Pierre; Schaniel, Dominik; Woike, Theo Modulated structure of potassium sodium strontium barium niobates (KNSBN): harmonic solution Acta Crystallographica Section B, 2006, 62, 228-235 |
2100430 | CIF Paper | Cl6 N3 P3 | P n m a | 13.8572; 12.8086; 6.0801 90; 90; 90 | 1079.17 | Bartlett, Stewart W.; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; İbişogundefinedlu, Hanife; Kiliç, Adem; Shaw, Robert A.; Ün, İlker Structural investigations of phosphorus‒nitrogen compounds. 7. Relationships between physical properties, electron densities, reaction mechanisms and hydrogen-bonding motifs of N~3~P~3~Cl~(6{-~<i>n</i>)}(NHBu^<i>t^</i>)~<i>n~</i> derivatives Acta Crystallographica Section B, 2006, 62, 321-329 |
2100431 | CIF Paper | C4 H10 Cl5 N4 P3 | P 1 21/c 1 | 13.8045; 10.7964; 20.7719 90; 104.132; 90 | 3002.1 | Bartlett, Stewart W.; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; İbişogundefinedlu, Hanife; Kiliç, Adem; Shaw, Robert A.; Ün, İlker Structural investigations of phosphorus‒nitrogen compounds. 7. Relationships between physical properties, electron densities, reaction mechanisms and hydrogen-bonding motifs of N~3~P~3~Cl~(6{-~<i>n</i>)}(NHBu^<i>t^</i>)~<i>n~</i> derivatives Acta Crystallographica Section B, 2006, 62, 321-329 |
2100432 | CIF Paper | C8 H20 Cl4 N5 P3 | P n a 21 | 20.3441; 11.9481; 15.9661 90; 90; 90 | 3880.9 | Bartlett, Stewart W.; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; İbişogundefinedlu, Hanife; Kiliç, Adem; Shaw, Robert A.; Ün, İlker Structural investigations of phosphorus‒nitrogen compounds. 7. Relationships between physical properties, electron densities, reaction mechanisms and hydrogen-bonding motifs of N~3~P~3~Cl~(6{-~<i>n</i>)}(NHBu^<i>t^</i>)~<i>n~</i> derivatives Acta Crystallographica Section B, 2006, 62, 321-329 |
2100433 | CIF Paper | C16 H40 Cl2 N7 P3 | P 1 21/n 1 | 12.5207; 16.1282; 13.1311 90; 95.903; 90 | 2637.59 | Bartlett, Stewart W.; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; İbişogundefinedlu, Hanife; Kiliç, Adem; Shaw, Robert A.; Ün, İlker Structural investigations of phosphorus‒nitrogen compounds. 7. Relationships between physical properties, electron densities, reaction mechanisms and hydrogen-bonding motifs of N~3~P~3~Cl~(6{-~<i>n</i>)}(NHBu^<i>t^</i>)~<i>n~</i> derivatives Acta Crystallographica Section B, 2006, 62, 321-329 |
2100434 | CIF Paper | C4 H8 N2 O3 | P 1 21/c 1 | 8.1233; 9.554; 7.8224 90; 107.596; 90 | 578.7 | Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of α-glycylglycine to 4.7GPa; application of Hirshfeld surfaces to analyse contacts on increasing pressure Acta Crystallographica Section B, 2006, 62, 310-320 |
2100435 | CIF Paper | C4 H8 N2 O3 | P 1 21/c 1 | 7.6428; 9.38; 7.6505 90; 103.882; 90 | 532.44 | Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of α-glycylglycine to 4.7GPa; application of Hirshfeld surfaces to analyse contacts on increasing pressure Acta Crystallographica Section B, 2006, 62, 310-320 |
2100436 | CIF Paper | C4 H8 N2 O3 | P 1 21/c 1 | 7.4304; 9.2896; 7.5943 90; 102.465; 90 | 511.84 | Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of α-glycylglycine to 4.7GPa; application of Hirshfeld surfaces to analyse contacts on increasing pressure Acta Crystallographica Section B, 2006, 62, 310-320 |
2100437 | CIF Paper | C4 H8 N2 O3 | P 1 21/c 1 | 7.31; 9.232; 7.55 90; 101.51; 90 | 499.3 | Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of α-glycylglycine to 4.7GPa; application of Hirshfeld surfaces to analyse contacts on increasing pressure Acta Crystallographica Section B, 2006, 62, 310-320 |
2100438 | CIF Paper | C4 H8 N2 O3 | P 1 21/c 1 | 7.2437; 9.2083; 7.5328 90; 101.214; 90 | 492.86 | Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay Effect of pressure on the crystal structure of α-glycylglycine to 4.7GPa; application of Hirshfeld surfaces to analyse contacts on increasing pressure Acta Crystallographica Section B, 2006, 62, 310-320 |
2100439 | CIF Paper | C27.5 H36.5 Co1.5 N2.5 O9.5 | C 1 2/c 1 | 33.311; 9.834; 18.296 90; 92.35; 90 | 5988 | Damgaard Poulsen, Rasmus; Bentien, Anders; Christensen, Mogens; Brummerstedt Iversen, Bo Solvothermal synthesis, multi-temperature crystal structures and physical properties of isostructural coordination polymers, 2C~4~H~12~N^+^[<i>M</i>~3~(C~8~H~4~O~4~)~4~]^2{-^}·3C~5~H~11~NO, <i>M</i> = Co, Zn Acta Crystallographica Section B, 2006, 62, 245-254 |
2100440 | CIF Paper | C27.5 H36.5 N2.5 O9.5 Zn1.5 | C 1 2/c 1 | 33.2613; 9.7844; 18.2156 90; 92.613; 90 | 5921.96 | Damgaard Poulsen, Rasmus; Bentien, Anders; Christensen, Mogens; Brummerstedt Iversen, Bo Solvothermal synthesis, multi-temperature crystal structures and physical properties of isostructural coordination polymers, 2C~4~H~12~N^+^[<i>M</i>~3~(C~8~H~4~O~4~)~4~]^2{-^}·3C~5~H~11~NO, <i>M</i> = Co, Zn Acta Crystallographica Section B, 2006, 62, 245-254 |
2100441 | CIF Paper | C27.5 H36.5 N2.5 O9.5 Zn1.5 | C 1 2/c 1 | 33.3307; 9.8105; 18.1988 90; 92.552; 90 | 5944.94 | Damgaard Poulsen, Rasmus; Bentien, Anders; Christensen, Mogens; Brummerstedt Iversen, Bo Solvothermal synthesis, multi-temperature crystal structures and physical properties of isostructural coordination polymers, 2C~4~H~12~N^+^[<i>M</i>~3~(C~8~H~4~O~4~)~4~]^2{-^}·3C~5~H~11~NO, <i>M</i> = Co, Zn Acta Crystallographica Section B, 2006, 62, 245-254 |
2100442 | CIF Paper | C27.5 H36.5 N2.5 O9.5 Zn1.5 | C 1 2/c 1 | 33.4193; 9.8455; 18.1908 90; 92.495; 90 | 5979.64 | Damgaard Poulsen, Rasmus; Bentien, Anders; Christensen, Mogens; Brummerstedt Iversen, Bo Solvothermal synthesis, multi-temperature crystal structures and physical properties of isostructural coordination polymers, 2C~4~H~12~N^+^[<i>M</i>~3~(C~8~H~4~O~4~)~4~]^2{-^}·3C~5~H~11~NO, <i>M</i> = Co, Zn Acta Crystallographica Section B, 2006, 62, 245-254 |
2100443 | CIF Paper | C27.5 H36.5 N2.5 O9.5 Zn1.5 | C 1 2/c 1 | 33.5639; 9.8791; 18.1814 90; 92.35; 90 | 6023.54 | Damgaard Poulsen, Rasmus; Bentien, Anders; Christensen, Mogens; Brummerstedt Iversen, Bo Solvothermal synthesis, multi-temperature crystal structures and physical properties of isostructural coordination polymers, 2C~4~H~12~N^+^[<i>M</i>~3~(C~8~H~4~O~4~)~4~]^2{-^}·3C~5~H~11~NO, <i>M</i> = Co, Zn Acta Crystallographica Section B, 2006, 62, 245-254 |
2100444 | CIF Paper | Ag13.034 As1.179 Cu2.966 S11 Sb0.821 | P -3 m 1 | 7.3876; 7.3876; 11.8882 90; 90; 120 | 561.89 | Bindi, Luca; Evain, Michel; Menchetti, Silvio Temperature dependence of the silver distribution in the crystal structure of natural pearceite, (Ag,Cu)~16~(As,Sb)~2~S~11~ Acta Crystallographica, Section B: Structural Science, 2006, 62, 212-219 |
2100445 | CIF Paper | Ag13.034 As1.179 Cu2.966 S11 Sb0.821 | P -3 m 1 | 7.3721; 7.3721; 11.8104 90; 90; 120 | 555.88 | Bindi, Luca; Evain, Michel; Menchetti, Silvio Temperature dependence of the silver distribution in the crystal structure of natural pearceite, (Ag,Cu)~16~(As,Sb)~2~S~11~ Acta Crystallographica Section B, 2006, 62, 212-219 |
2100446 | CIF Paper | Ag12.21 As1.194 Cu3.79 S11 Sb0.806 | P -3 m 1 | 7.389; 7.389; 11.816 90; 90; 120 | 558.69 | Bindi, Luca; Evain, Michel; Menchetti, Silvio Temperature dependence of the silver distribution in the crystal structure of natural pearceite, (Ag,Cu)~16~(As,Sb)~2~S~11~ Acta Crystallographica Section B, 2006, 62, 212-219 |
2100447 | CIF Paper | C6 H2 Cl4 | P -1 | 3.8016; 10.6369; 9.4866 92.072; 98.966; 96.52 | 375.91 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
2100448 | CIF Paper | C6 Cl4 D2 | P -1 | 3.76062; 10.58794; 9.44562 92.4066; 98.6978; 97.5893 | 367.779 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
2100449 | CIF Paper | C6 Cl4 D2 | P -1 | 3.799; 10.6258; 9.47938 91.978; 99.058; 96.234 | 375.132 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
2100450 | CIF Paper | C6 Cl4 D2 | P 1 21/n 1 | 3.78988; 10.50328; 9.56244 90; 99.7184; 90 | 375.182 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
2100451 | CIF Paper | C6 Cl4 D2 | P 1 21/n 1 | 3.81117; 10.53867; 9.57198 90; 99.7088; 90 | 378.949 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
2100452 | CIF Paper | C6 Cl4 D2 | P 1 21/n 1 | 3.85595; 10.61473; 9.59283 90; 99.6884; 90 | 387.033 | Barnett, Sarah A.; Broder, Charlotte K.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard; Tocher, Derek A. Single-crystal X-ray and neutron powder diffraction investigation of the phase transition in tetrachlorobenzene Acta Crystallographica Section B, 2006, 62, 287-295 |
2100453 | CIF Paper | Ce1.86 In8 Rh | P 4/m m m | 4.66516; 4.66516; 12.23763 90; 90; 90 | 266.336 | E. G. Moshopoulou; R. M. Ibberson; J. L. Sarrao; J. D. Thompson; Z. Fisk Structure of Ce~2~RhIn~8~: an example of complementary use of high-resolution neutron powder diffraction and reciprocal-space mapping to study complex materials Acta Crystallographica Section B, 2006, 62, 173-189 |
2100454 | CIF Paper | Rh | F m -3 m | 3.590966; 3.590966; 3.590966 90; 90; 90 | 46.3056 | E. G. Moshopoulou; R. M. Ibberson; J. L. Sarrao; J. D. Thompson; Z. Fisk Structure of Ce~2~RhIn~8~: an example of complementary use of high-resolution neutron powder diffraction and reciprocal-space mapping to study complex materials Acta Crystallographica Section B, 2006, 62, 173-189 |
2100455 | CIF Paper | Ce In3 | P m -3 m | 4.69074; 4.69074; 4.69074 90; 90; 90 | 103.211 | E. G. Moshopoulou; R. M. Ibberson; J. L. Sarrao; J. D. Thompson; Z. Fisk Structure of Ce~2~RhIn~8~: an example of complementary use of high-resolution neutron powder diffraction and reciprocal-space mapping to study complex materials Acta Crystallographica Section B, 2006, 62, 173-189 |
2100456 | CIF Paper | In | I 4/m m m | 3.25094; 3.25094; 4.9474 90; 90; 90 | 52.287 | E. G. Moshopoulou; R. M. Ibberson; J. L. Sarrao; J. D. Thompson; Z. Fisk Structure of Ce~2~RhIn~8~: an example of complementary use of high-resolution neutron powder diffraction and reciprocal-space mapping to study complex materials Acta Crystallographica Section B, 2006, 62, 173-189 |
2100457 | CIF Paper | C2 H6 O4 S | I 1 2/a 1 | 8.9007; 5.8099; 10.2451 90; 101.69; 90 | 518.81 | Acta Crystallographica, Section B, 2006, 62, 280-286 |
2100458 | CIF Paper | C2 H6 O4 S | F d d 2 | 12.0568; 15.9176; 5.8001 90; 90; 90 | 1113.13 | Acta Crystallographica, Section B, 2006, 62, 280-286 |
2100459 | CIF Paper | C2 D6 O4 S | I2/a | 8.68731; 5.82756; 9.94376 90; 100.44; 90 | 495.076 | Acta Crystallographica, Section B, 2006, 62, 280-286 |
2100460 | CIF Paper | C24 H38 N2 O6 | P 1 | 5.9642; 10.4125; 11.7403 108.175; 104.56; 104.087 | 628.08 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100461 | CIF Paper | C16 H25 N O5 | P 21 21 21 | 5.829; 13.544; 21.7 90; 90; 90 | 1713.17 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100462 | CIF Paper | C16 H21 N O4 S | P 1 21 1 | 5.7214; 20.8336; 6.9188 90; 98.409; 90 | 815.84 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100463 | CIF Paper | C22 H36 N2 O8 S2 | P 1 21 1 | 5.7108; 34.0651; 6.659 90; 90.09; 90 | 1295.43 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100464 | CIF Paper | C10 H15 N O | P 21 21 21 | 5.6851; 7.7047; 22.4819 90; 90; 90 | 984.75 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100465 | CIF Paper | C12 H21 N O4 S | P 21 21 21 | 5.4877; 11.9057; 22.639 90; 90; 90 | 1479.1 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100466 | CIF Paper | C12 H19 N O4 | P 1 21 1 | 9.5946; 6.0474; 10.8255 90; 101.607; 90 | 615.28 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100467 | CIF Paper | C10 H16 Cl N O | P 1 21 1 | 7.2557; 6.1228; 12.5486 90; 102.223; 90 | 544.84 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100468 | CIF Paper | C10 H16 N O1.5 | C 2 2 21 | 7.3639; 11.2551; 24.1442 90; 90; 90 | 2001.1 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100469 | CIF Paper | C14 H21 N O6 | P 1 21 1 | 6.1312; 9.1719; 13.7393 90; 100.909; 90 | 758.66 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100470 | CIF Paper | C14 H21 N O6 | P 21 21 21 | 5.637; 13.495; 20.525 90; 90; 90 | 1561.36 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100471 | CIF Paper | C11.5 H17 N O3 | C 1 2 1 | 15.119; 5.784; 13.8788 90; 105.765; 90 | 1168 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100472 | CIF Paper | C11 H19 N O4 S | C 1 2 1 | 14.287; 6.1075; 14.993 90; 93.211; 90 | 1306.2 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100473 | CIF Paper | C10 H16 N2 O4 | P 1 21 1 | 5.5309; 6.8501; 15.6906 90; 97.243; 90 | 589.73 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100474 | CIF Paper | C10 H18 N O5 P | C 1 2 1 | 14.6992; 5.6433; 15.2432 90; 97.333; 90 | 1254.11 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100475 | CIF Paper | C10 H17 N O5 S | C 1 2 1 | 30.9967; 6.9861; 5.617 90; 93.354; 90 | 1214.26 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100476 | CIF Paper | C14 H23 N O8 | P 21 21 21 | 6.622; 7.462; 33.216 90; 90; 90 | 1641.31 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100477 | CIF Paper | C24 H42 N2 O11 | P 1 | 5.9373; 7.0594; 18.3791 80.254; 88.527; 66.247 | 694.14 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100478 | CIF Paper | C17 H23 N O4 S | P 21 21 21 | 5.7491; 7.1665; 42.0343 90; 90; 90 | 1731.85 | Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts 17 salts of ephedrine: crystal structures and packing analysis Acta Crystallographica Section B, 2006, 62, 498-505 |
2100479 | CIF Paper | C14 H26 O2 | P 1 21 1 | 5.54; 41.653; 12.025 90; 90.33; 90 | 2774.8 | Patrick, Brian O.; Brock, Carolyn Pratt S,S-1,2-Dicyclohexylethane-1,2-diol and its racemic compound: a striking exception to Wallach's rule Acta Crystallographica, Section B: Structural Science, 2006, 62, 488-497 |
2100480 | CIF Paper | C14 H26 O2 | P 1 21 1 | 5.4816; 41.262; 11.954 90; 90.39; 90 | 2703.7 | Patrick, Brian O.; Brock, Carolyn Pratt S,S-1,2-Dicyclohexylethane-1,2-diol and its racemic compound: a striking exception to Wallach's rule Acta Crystallographica, Section B: Structural Science, 2006, 62, 488-497 |
2100481 | CIF Paper | C14 H26 O2 | C 1 2/c 1 | 23.153; 11.852; 10.926 90; 104.64; 90 | 2900.9 | Patrick, Brian O.; Brock, Carolyn Pratt S,S-1,2-Dicyclohexylethane-1,2-diol and its racemic compound: a striking exception to Wallach's rule Acta Crystallographica, Section B: Structural Science, 2006, 62, 488-497 |
2100482 | CIF Paper | C14 H26 O2 | C 1 2/c 1 | 23.161; 11.584; 10.973 90; 106.1; 90 | 2828.6 | Patrick, Brian O.; Brock, Carolyn Pratt S,S-1,2-Dicyclohexylethane-1,2-diol and its racemic compound: a striking exception to Wallach's rule Acta Crystallographica, Section B: Structural Science, 2006, 62, 488-497 |
2100483 | CIF HKL Paper | C5 H12 O4 | I -4 | 6.0867; 6.0867; 8.4958 90; 90; 90 | 314.752 | Elizabeth A.Zhurova; Vladimir G. Tsirelson; Vladimir V. Zhurov; Adam I. Stash; A. Alan Pinkerton Chemical bonding in pentaerythritol at very low temperature or at high pressure: an experimental and theoretical study Acta Crystallographica Section B, 2006, 62, 513-520 |
2100484 | CIF Paper | Ag14.52 Cu1.48 S11 Sb2 | P 3 2 1 | 15.0954; 15.0954; 11.8825 90; 90; 120 | 2344.9 | M. Evain; L. Bindi; S. Menchetti Structural complexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)~16~(Sb,As)~2~S~11~ Acta Crystallographica Section B, 2006, 62, 447-456 |
2100485 | CIF Paper | Ag14.814 Cu1.186 S11 Sb2 | C 1 2/c 1 | 26.188; 15.1199; 23.784 90; 90; 90 | 9418 | M. Evain; L. Bindi; S. Menchetti Structural complexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)~16~(Sb,As)~2~S~11~ Acta Crystallographica Section B, 2006, 62, 447-456 |
2100486 | CIF HKL Paper | C22 H20 O3 | P21/c(\a0\g)00 | 7.2527; 24.951; 9.8959 90; 106.645; 90 | 1715.7 | Cyril A. Fuhre; Kurt Schenk; Robert Häner; Gervais Chapuis; Nicolas Guiblin; Helen Stoeckli-Evans The incommensurately modulated structure of a tricyclic natural-product-like compound of empirical formula C~22~H~20~O~3~ Acta Crystallographica Section B, 2006, 62, 506-512 |
2100487 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 8.4637; 6.0176; 10.1812 90; 105.747; 90 | 499.08 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100488 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 10.2175; 6.0353; 8.486 90; 105.716; 90 | 503.73 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100489 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 8.407; 6.0038; 10.1607 90; 105.829; 90 | 493.4 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100490 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 8.3155; 5.9607; 10.1123 90; 106.021; 90 | 481.76 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100491 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 8.1889; 5.905; 10.01 90; 106.349; 90 | 464.47 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100492 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.9633; 5.7915; 9.8203 90; 106.933; 90 | 433.27 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100493 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.8667; 5.7418; 9.7349 90; 107.299; 90 | 419.83 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100494 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.8065; 5.7061; 9.6871 90; 107.409; 90 | 411.74 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100495 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.7447; 5.6735; 9.6219 90; 107.559; 90 | 403.08 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100496 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.6626; 5.6223; 9.5448 90; 107.815; 90 | 391.49 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100497 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.6343; 5.6073; 9.5122 90; 107.911; 90 | 387.46 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100498 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5999; 5.5911; 9.4814 90; 107.995; 90 | 383.17 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100499 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5511; 5.5626; 9.4311 90; 108.221; 90 | 376.28 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100500 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5316; 5.553; 9.4148 90; 108.253; 90 | 373.94 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100501 | CIF Paper | C4 H12 Cl2 Pt S2 | P 1 21/n 1 | 7.5335; 5.5545; 9.4126 90; 108.256; 90 | 374.04 | Hansson, Christian; Carlson, Stefan; Giveen, Deborah; Johansson, Maria; Yong, Shen; Oskarsson, Åke <i>Cis</i>/<i>trans</i> isomers of Pt<i>X</i>~2~<i>L</i>~2~ (<i>X</i> = halogen, <i>L</i> = neutral ligand); the crystal structure of <i>trans</i>-dichlorobis(dimethyl sulfide)platinum(II) and the pressure dependence of its unit-cell dimensions Acta Crystallographica Section B, 2006, 62, 474-479 |
2100502 | CIF Paper | C15 H16 N2 O2 | P 1 21/n 1 | 4.001; 25.09; 12.94 90; 93.65; 90 | 1296 | Sharif, Shasad; Powell, Douglas R.; Schagen, David; Steiner, Thomas; Toney, Michael D.; Fogle, Emily; Limbach, Hans-Heinrich X-ray crystallographic structures of enamine and amine Schiff bases of pyridoxal and its 1:1 hydrogen-bonded complexes with benzoic acid derivatives: evidence for coupled inter- and intramolecular proton transfer Acta Crystallographica Section B, 2006, 62, 480-487 |
2100503 | CIF Paper | C22 H21 N3 O6 | P -1 | 7.683; 12.188; 12.562 114.88; 99.61; 96.03 | 1031.8 | Sharif, Shasad; Powell, Douglas R.; Schagen, David; Steiner, Thomas; Toney, Michael D.; Fogle, Emily; Limbach, Hans-Heinrich X-ray crystallographic structures of enamine and amine Schiff bases of pyridoxal and its 1:1 hydrogen-bonded complexes with benzoic acid derivatives: evidence for coupled inter- and intramolecular proton transfer Acta Crystallographica Section B, 2006, 62, 480-487 |
2100504 | CIF Paper | C9 H12 N2 O2 | P 1 21/c 1 | 11.046; 4.8739; 18.027 90; 106.728; 90 | 929.5 | Sharif, Shasad; Powell, Douglas R.; Schagen, David; Steiner, Thomas; Toney, Michael D.; Fogle, Emily; Limbach, Hans-Heinrich X-ray crystallographic structures of enamine and amine Schiff bases of pyridoxal and its 1:1 hydrogen-bonded complexes with benzoic acid derivatives: evidence for coupled inter- and intramolecular proton transfer Acta Crystallographica Section B, 2006, 62, 480-487 |
2100505 | CIF Paper | C16 H17 N3 O6 | P 1 21/c 1 | 7.113; 11.797; 18.314 90; 94.644; 90 | 1531.7 | Sharif, Shasad; Powell, Douglas R.; Schagen, David; Steiner, Thomas; Toney, Michael D.; Fogle, Emily; Limbach, Hans-Heinrich X-ray crystallographic structures of enamine and amine Schiff bases of pyridoxal and its 1:1 hydrogen-bonded complexes with benzoic acid derivatives: evidence for coupled inter- and intramolecular proton transfer Acta Crystallographica Section B, 2006, 62, 480-487 |
2100506 | CIF Paper | C2 Ca F6 O6 S2 | R -3 :H | 5.60549; 5.605486; 31.1417 90; 90; 120 | 847.42 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
2100507 | CIF Paper | C2 Cu F6 O6 S2 | P -1 | 4.98965; 10.7668; 4.82189 103.523; 118.085; 79.459 | 221.402 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
2100508 | CIF Paper | C2 F6 O6 S2 Zn | R -3 :H | 4.97873; 4.97873; 31.3165 90; 90; 120 | 672.27 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
2100509 | CIF Paper | C2 F6 Mg O6 S2 | R -3 :H | 5.0494; 5.0494; 31.033 90; 90; 120 | 685.23 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
2100510 | CIF Paper | C2 Ba F6 O6 S2 | I 1 2/a 1 | 21.7505; 4.90797; 9.6949 90; 100.379; 90 | 1018.01 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
2100511 | CIF Paper | Na2 O7 Si3 | C2/c(0\b0)s0 | 20.416; 6.4987; 4.9294 90; 90.26; 90 | 654 | Krüger, Hannes; Kahlenberg, Volker; Friese, Karen Na~2~Si~3~O~7~: an incommensurate structure with crenel-type modulation functions, refined from a twinned crystal Acta Crystallographica Section B, 2006, 62, 440-446 |
2100512 | CIF Paper | Ba2 Nb O6 Y | F m -3 m | 8.44114; 8.44114; 8.44114 90; 90; 90 | 601.455 | Barnes, Paris W.; Lufaso, Michael W.; Woodward, Patrick M. Structure determination of <i>A</i>~2~<i>M</i>^3+^TaO~6~ and <i>A</i>~2~<i>M</i>^3+^NbO~6~ ordered perovskites: octahedral tilting and pseudosymmetry Acta Crystallographica Section B, 2006, 62, 384-396 |
2100513 | CIF Paper | Al Ca2 Nb O6 | P 1 21/n 1 | 5.37706; 5.41557; 7.6255 90; 89.97; 90 | 222.053 | Barnes, Paris W.; Lufaso, Michael W.; Woodward, Patrick M. Structure determination of <i>A</i>~2~<i>M</i>^3+^TaO~6~ and <i>A</i>~2~<i>M</i>^3+^NbO~6~ ordered perovskites: octahedral tilting and pseudosymmetry Acta Crystallographica Section B, 2006, 62, 384-396 |
2100514 | CIF Paper | Ca2 Cr O6 Ta | P 1 21/n 1 | 5.42609; 5.49922; 7.71863 90; 90.017; 90 | 230.318 | Barnes, Paris W.; Lufaso, Michael W.; Woodward, Patrick M. Structure determination of <i>A</i>~2~<i>M</i>^3+^TaO~6~ and <i>A</i>~2~<i>M</i>^3+^NbO~6~ ordered perovskites: octahedral tilting and pseudosymmetry Acta Crystallographica Section B, 2006, 62, 384-396 |
2100515 | CIF Paper | Cr O6 Sr2 Ta | I 4/m | 5.57516; 5.57516; 7.8808 90; 90; 90 | 244.954 | Barnes, Paris W.; Lufaso, Michael W.; Woodward, Patrick M. Structure determination of <i>A</i>~2~<i>M</i>^3+^TaO~6~ and <i>A</i>~2~<i>M</i>^3+^NbO~6~ ordered perovskites: octahedral tilting and pseudosymmetry Acta Crystallographica Section B, 2006, 62, 384-396 |
2100516 | CIF Paper | Ga O6 Sr2 Ta | I 4/m | 5.57539; 5.57539; 7.8949 90; 90; 90 | 245.413 | Barnes, Paris W.; Lufaso, Michael W.; Woodward, Patrick M. Structure determination of <i>A</i>~2~<i>M</i>^3+^TaO~6~ and <i>A</i>~2~<i>M</i>^3+^NbO~6~ ordered perovskites: octahedral tilting and pseudosymmetry Acta Crystallographica Section B, 2006, 62, 384-396 |
2100517 | CIF Paper | Nb O6 Sc Sr2 | P 1 21/n 1 | 5.7045; 5.6973; 8.0505 90; 90.021; 90 | 261.643 | Barnes, Paris W.; Lufaso, Michael W.; Woodward, Patrick M. Structure determination of <i>A</i>~2~<i>M</i>^3+^TaO~6~ and <i>A</i>~2~<i>M</i>^3+^NbO~6~ ordered perovskites: octahedral tilting and pseudosymmetry Acta Crystallographica Section B, 2006, 62, 384-396 |
2100518 | CIF HKL Paper | C4 H7 N O2 | P 1 21 1 | 6.27983; 7.83799; 5.46295 90; 114.893; 90 | 243.913 | Asiloé J. Mora; Michella Brunelli; Andrew N. Fitch; Jonathan Wright; Maria E. Báez; Francisco López-Carrasquero Structures of (<i>S</i>)-({-})-4-oxo-2-azetidinecarboxylic acid and 3-azetidinecarboxylic acid from powder synchrotron diffraction data Acta Crystallographica Section B, 2006, 62, 606-611 |
2100519 | CIF HKL Paper | C4 H5 N O3 | P 21 21 21 | 8.94684; 7.66956; 7.27555 90; 90; 90 | 499.236 | Asiloé J. Mora; Michella Brunelli; Andrew N. Fitch; Jonathan Wright; Maria E. Báez; Francisco López-Carrasquero Structures of (<i>S</i>)-({-})-4-oxo-2-azetidinecarboxylic acid and 3-azetidinecarboxylic acid from powder synchrotron diffraction data Acta Crystallographica Section B, 2006, 62, 606-611 |
2100520 | CIF HKL Paper | C6 D7 N O | I 41/a m d :2 | 7.9411; 7.9411; 19.6002 90; 90; 90 | 1236.01 | Damay, F.; Carretero-Genevrier, A.; Cousson, A.; Rodriguez-Carvajal, J.; Van Beek, W.; Fillaux, F. Synchrotron and neutron diffraction study of 4-methylpyridine-<i>N</i>-oxide at low temperature Acta Crystallographica Section B, 2006, 62, 627-633 |
2100521 | CIF HKL Paper | C6 D7 N O | F d d d :2 | 12.1382; 10.2367; 19.5676 90; 90; 90 | 2431.37 | Damay, F.; Carretero-Genevrier, A.; Cousson, A.; Rodriguez-Carvajal, J.; Van Beek, W.; Fillaux, F. Synchrotron and neutron diffraction study of 4-methylpyridine-<i>N</i>-oxide at low temperature Acta Crystallographica Section B, 2006, 62, 627-633 |
2100522 | CIF HKL Paper | C6 D7 N O | P 41 | 15.41038; 15.41038; 19.68 90; 90; 90 | 4673.6 | Damay, F.; Carretero-Genevrier, A.; Cousson, A.; Rodriguez-Carvajal, J.; Van Beek, W.; Fillaux, F. Synchrotron and neutron diffraction study of 4-methylpyridine-<i>N</i>-oxide at low temperature Acta Crystallographica Section B, 2006, 62, 627-633 |
2100523 | CIF Paper | C9 H14 N2 O2 S | P -1 | 7.2934; 7.8145; 10.2181 87.055; 70.569; 72.898 | 524.22 | V. Tsirelson; A. Stash; V. Potemkin; A. Rykounov; A. Shutalev; E. Zhurova; V. Zhurov; A. A. Pinkerton; G. Gurskaya; V. Zavodnik Molecular and crystal properties of ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate from experimental and theoretical electron densities Acta Crystallographica Section B, 2006, 62, 676-688 |
2100524 | CIF Paper | C5 H4 N4 O | C 1 2/c 1 | 22.0427; 3.9311; 14.234 90; 114.885; 90 | 1118.89 | Harriott Nowell; Christopher S. Frampton; Julie Waite; Sarah L. Price Blind crystal structure prediction of a novel second polymorph of 1-hydroxy-7-azabenzotriazole Acta Crystallographica Section B, 2006, 62, 642-650 |
2100525 | CIF Paper | C5 H4 N4 O | P 1 21/c 1 | 3.7487; 20.8881; 7.0982 90; 96.257; 90 | 552.5 | Harriott Nowell; Christopher S. Frampton; Julie Waite; Sarah L. Price Blind crystal structure prediction of a novel second polymorph of 1-hydroxy-7-azabenzotriazole Acta Crystallographica Section B, 2006, 62, 642-650 |
2100526 | CIF Paper | C14 H10 N4 O4 | P 1 21/n 1 | 9.1379; 6.1776; 11.7682 90; 93.853; 90 | 662.82 | Glidewell, Christopher; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L. Isomers and polymorphs of (<i>E</i>,<i>E</i>)-1,4-bis(nitrophenyl)-2,3-diaza-1,3-butadienes Acta Crystallographica Section B, 2006, 62, 666-675 |
2100527 | CIF Paper | C14 H10 N4 O4 | P 1 21/c 1 | 7.7809; 14.7825; 6.2196 90; 113.106; 90 | 658 | Glidewell, Christopher; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L. Isomers and polymorphs of (<i>E</i>,<i>E</i>)-1,4-bis(nitrophenyl)-2,3-diaza-1,3-butadienes Acta Crystallographica Section B, 2006, 62, 666-675 |
2100528 | CIF Paper | C14 H10 N4 O4 | P 1 21 1 | 7.8036; 7.0914; 12.3424 90; 101.742; 90 | 668.72 | Glidewell, Christopher; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L. Isomers and polymorphs of (<i>E</i>,<i>E</i>)-1,4-bis(nitrophenyl)-2,3-diaza-1,3-butadienes Acta Crystallographica Section B, 2006, 62, 666-675 |
2100529 | CIF Paper | C14 H10 N4 O4 | P 1 21/n 1 | 7.0128; 7.6318; 12.8037 90; 105.825; 90 | 659.29 | Glidewell, Christopher; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L. Isomers and polymorphs of (<i>E</i>,<i>E</i>)-1,4-bis(nitrophenyl)-2,3-diaza-1,3-butadienes Acta Crystallographica Section B, 2006, 62, 666-675 |
2100530 | CIF Paper | C14 H10 N4 O4 | C 1 2/c 1 | 30.865; 4.766; 21.736 90; 123.926; 90 | 2653.1 | Glidewell, Christopher; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L. Isomers and polymorphs of (<i>E</i>,<i>E</i>)-1,4-bis(nitrophenyl)-2,3-diaza-1,3-butadienes Acta Crystallographica Section B, 2006, 62, 666-675 |
2100531 | CIF Paper | C14 H10 N4 O4 | P 1 21/n 1 | 3.7318; 7.2442; 23.9367 90; 94.053; 90 | 645.48 | Glidewell, Christopher; Low, John Nicolson; Skakle, Janet M.S.; Wardell, James L. Isomers and polymorphs of (<i>E</i>,<i>E</i>)-1,4-bis(nitrophenyl)-2,3-diaza-1,3-butadienes Acta Crystallographica Section B, 2006, 62, 666-675 |
2100532 | CIF Paper | C12 H9 Cl N2 O | P c c n | 13.2296; 21.0744; 7.6898 90; 90; 90 | 2144 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100533 | CIF Paper | C13 H11 Cl N2 O | P -1 | 9.6824; 11.3082; 11.5139 77.453; 73.445; 87.978 | 1179.07 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100534 | CIF Paper | C12 H10 Cl F N2 O2 | P -1 | 6.8033; 8.1303; 11.5356 84.032; 84.297; 69.569 | 593.32 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100535 | CIF Paper | C12 H8 Cl2 N2 O | P 1 21 1 | 5.0855; 28.982; 15.607 90; 90.37; 90 | 2300.2 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100536 | CIF Paper | C12 H8 Br Cl N2 O | P 21 21 21 | 4.881; 13.3448; 18.3974 90; 90; 90 | 1198.33 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100537 | CIF Paper | C12 H8 Cl I N2 O | P b c a | 10.6597; 25.9833; 9.2044 90; 90; 90 | 2549.38 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100538 | CIF Paper | C13 H11 Cl N2 O2 | P 21 21 21 | 4.8536; 11.8437; 21.0612 90; 90; 90 | 1210.69 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100539 | CIF Paper | C13 H8 Cl N3 O | P -1 | 7.2885; 7.7607; 20.8849 96.456; 92.913; 91.81 | 1171.49 | Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine <i>N</i>-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B, 2006, 62, 651-665 |
2100540 | CIF Paper | Ca2 Co0.9 O7 Si2 Zn0.1 | P -4 | 23.518; 23.518; 5.0263 90; 90; 90 | 2780 | Jia, Zihong. H.; Schaper, Andreas K.; Massa, Werner; Rager, Helmut Structure and Phase Transitions in Ca~2~CoSi~2~O~7~ ‒ Ca~2~ZnSi~2~O~7~ Solid Solution Crystals Acta Crystallographica, Section B, 2006, 62, 547-555 |
2100541 | CIF Paper | Ca2 Co0.9 O7 Si2 Zn0.1 | P 21 21 2 | 23.518; 23.518; 5.0263 90; 90; 90 | 2780 | Jia, Zihong. H.; Schaper, Andreas K.; Massa, Werner; Rager, Helmut Structure and Phase Transitions in Ca~2~CoSi~2~O~7~ ‒ Ca~2~ZnSi~2~O~7~ Solid Solution Crystals Acta Crystallographica, Section B, 2006, 62, 547-555 |
2100542 | CIF Paper | C18 H14 Cl N8 O2.5 | P -1 | 6.9825; 15.7877; 17.878 100.232; 95.906; 100.567 | 1887.81 | V. Ferretti; L. Pretto; M. A. Tabrizi; P. Gilli Role of strong intramolecular N—H···N hydrogen bonds in determining the conformation of adenosine-receptor antagonists Acta Crystallographica Section B, 2006, 62, 634-641 |
2100543 | CIF Paper | C22 H22 N8 O3 | P 1 21/c 1 | 11.2816; 24.0888; 8.1651 90; 103.917; 90 | 2153.81 | V. Ferretti; L. Pretto; M. A. Tabrizi; P. Gilli Role of strong intramolecular N—H···N hydrogen bonds in determining the conformation of adenosine-receptor antagonists Acta Crystallographica Section B, 2006, 62, 634-641 |
2100544 | CIF Paper | C26 H30 N8 O5 | P -1 | 12.6218; 14.0932; 15.6948 72.867; 71.328; 70.635 | 2439.15 | V. Ferretti; L. Pretto; M. A. Tabrizi; P. Gilli Role of strong intramolecular N—H···N hydrogen bonds in determining the conformation of adenosine-receptor antagonists Acta Crystallographica Section B, 2006, 62, 634-641 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!