Crystallography Open Database

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2100215 CIF
Paper
C24 H36 O5P 21 21 218.4953; 12.706; 20.8011
90; 90; 90
2245.3Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100216 CIF
Paper
C24 H37 O5.5C 1 2 126.6049; 7.7044; 22.9126
90; 93.424; 90
4688.12Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100217 CIF
Paper
C24 H34 O5P 1 21 112.0863; 6.8301; 13.1153
90; 101.138; 90
1062.28Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100218 CIF
Paper
C4 H9 Cd N7 Ni O0?P?8.4867; 15.951; 7.604
90; 90.48; 90
1029.3Petříček, Václav; Dušek, Michal; Černák, Juraj
Modulated one-dimensional structure of [Cd(NH~3~)~3~Ni(CN)~4~]
Acta Crystallographica Section B, 2005, 61, 280-286
2100219 CIF
Paper
C2 H3 K N8 O2P -17.031; 11.4089; 4.6788
93.158; 106.749; 83.473
356.964Leonid A. Solovyov; Alexander M. Astachov; Maxim S. Molokeev; Alexander D. Vasiliev
Powder diffraction crystal structure analysis using derivative difference minimization: example of the potassium salt of 1-(tetrazol-5-yl)-2-nitroguanidine
Acta Crystallographica Section B, 2005, 61, 435-442
2100220 CIF
Paper
K5 Mo4 O16 Yb?P?10.4054; 6.1157; 19.7751
90; 136.625; 90
864.2Alla Arakcheeva; Gervais Chapuis; Vaclav Petricek; Vladimir Morozov
The role of second coordination-sphere interactions in incommensurately modulated structures, using β-K~5~Yb(MoO~4~)~4~ as an example
Acta Crystallographica Section B, 2005, 61, 400-406
2100221 CIFC2 H2 N4 O3P -15.1233; 10.314; 17.998
106.61; 97.81; 90.13
902.1Bolotina, Nadezhda B.; Kirschbaum, Kristin; Pinkerton, A.Alan
Acta Crystallographica, Section B, 2005, 61, 577-584
2100222 CIF
Paper
C20 H24 O7C 1 2/c 115.3519; 10.4044; 11.8506
90; 109.607; 90
1783.11Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100223 CIF
Paper
C21 H29 Cl N O6.5C 1 2/c 136.0403; 7.8165; 17.0066
90; 111.792; 90
4448.5Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100224 CIF
Paper
C20 H24 O6 SC 1 2/c 18.6029; 12.2965; 17.6032
90; 104.038; 90
1806.55Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100225 CIF
Paper
C20 H24 O7 SC 1 2/c 18.8113; 12.2699; 17.564
90; 103.988; 90
1842.6Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100226 CIF
Paper
C20 H24 O8 SP 1 21/n 18.7886; 15.3454; 15.4972
90; 106.277; 90
2006.25Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100227 CIF
Paper
Li2 O2P 63/m m c3.183; 3.183; 7.7258
90; 90; 120
67.787Luis Guillermo Cota; Pablo de la Mora
On the structure of lithium peroxide, Li~2~O~2~
Acta Crystallographica Section B, 2005, 61, 133-136
2100228 CIF
HKL
Paper
C10 H10 N2 O2P 1 21/c 18.901; 7.666; 6.984
90; 90.091; 90
476.6Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100229 CIF
HKL
Paper
C10 H16 N2 O2P -15.706; 6.7599; 7.0771
100.269; 112.446; 90.163
247.5Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100230 CIF
HKL
Paper
C14 H28 N2 O4P 1 21/n 16.6652; 5.5881; 20.034
90; 94.942; 90
743.4Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100231 CIF
Paper
C16 H16 N2 O2P 1 21/c 16.499; 16.459; 7.1794
90; 112.986; 90
706.98Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100232 CIF
Paper
C16 H28 N2 O2P 1 21/c 110.423; 5.2619; 15.221
90; 109.92; 90
784.85Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100233 CIF
HKL
Paper
C26 H22 N4 O2P -17.82; 8.619; 9.201
111.897; 109.851; 94.657
525.6Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100234 CIF
Paper
C16 H28 N2 O4P -16.9612; 7.3146; 9.659
106.182; 104.481; 106.201
423.96Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100235 CIF
HKL
Paper
C12 H20 N2 O2P -18.962; 9.4944; 14.7119
90.501; 92.919; 99.664
1232.26Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100236 CIF
Paper
C17 H13 N3 O2P 21 21 2123.97; 10.609; 5.457
90; 90; 90
1387.7Ryabova, Svetlana Yu.; Rastorgueva, Nina A.; Sonneveld, Eduard J.; Peschar, Rene; Schenk, Henk; Tafeenko, Viktor A.; Aslanov, Leonid A.; Chernyshev, Vladimir V.
Structural characterization of [1,4]diazepino[6,5-<i>b</i>]indoles by powder diffraction
Acta Crystallographica Section B, 2005, 61, 192-199
2100237 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.5213; 9.172; 5.5847
90; 90; 90
436.49Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100238 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.4365; 8.9506; 5.5512
90; 90; 90
419.18Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100239 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.3702; 8.7699; 5.5103
90; 90; 90
404.49Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100240 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.3266; 8.665; 5.4851
90; 90; 90
395.75Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100241 CIF
Paper
C3 H7 N O3P 21 21 218.298; 8.6; 5.4663
90; 90; 90
390.09Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100242 CIF
Paper
C3 H7 N O3P 21 21 216.9083; 9.644; 5.6166
90; 90; 90
374.2Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100243 CIF
Paper
Mn O4 ReP 1 2/c 14.8022; 5.6318; 5.0803
90; 92.762; 90
137.24Bramnik, Kirill G.; Ehrenberg, Helmut; Buhre, Stephan; Fuess, Hartmut
Preparation, crystal structure and magnetic properties of the high-pressure phase MnReO~4~ with a wolframite-type structure
Acta Crystallographica Section B, 2005, 61, 246-249
2100244 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1798; 9.1869; 5.1978
90; 105.614; 90
468.16Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100245 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1822; 9.1912; 5.1995
90; 105.636; 90
468.6Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100246 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1853; 9.1959; 5.2013
90; 105.649; 90
469.11Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100247 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1893; 9.1996; 5.2043
90; 105.669; 90
469.71Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100248 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.193; 9.2039; 5.2078
90; 105.688; 90
470.37Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100249 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1944; 9.2078; 5.2103
90; 105.699; 90
470.84Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100250 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1957; 9.2123; 5.2142
90; 105.702; 90
471.47Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100251 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.2047; 9.2255; 5.2249
90; 105.785; 90
473.34Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100252 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.213; 9.2385; 5.2359
90; 105.87; 90
475.19Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100253 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.215; 9.2455; 5.2407
90; 105.928; 90
475.94Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100254 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.2165; 9.2483; 5.2429
90; 105.942; 90
476.32Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100255 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.217; 9.2515; 5.2446
90; 105.964; 90
476.62Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100256 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.218; 9.2536; 5.2468
90; 105.975; 90
476.94Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100257 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.2453; 9.2118; 5.4115
90; 106.931; 90
488.59Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100258 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.2405; 9.178; 5.4003
90; 107.072; 90
485.19Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100259 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.243; 9.1821; 5.4015
90; 107.074; 90
485.63Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100260 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.2448; 9.1898; 5.4023
90; 107.09; 90
486.16Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100261 CIF
Paper
C18 H17 N O4P 1 21/c 18.5153; 16.0591; 12.1476
90; 96.801; 90
1649.5Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100262 CIF
Paper
C18 H17 N O4P 1 21/c 16.4499; 14.9693; 16.6559
90; 92.947; 90
1606.01Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100263 CIF
Paper
C18 H17 N O4P 1 21/c 16.4238; 15.1513; 17.0552
90; 93.167; 90
1657.43Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100264 CIF
Paper
C18 H17 N O4P 1 21/n 112.1552; 15.8657; 16.6708
90; 97.425; 90
3188.02Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100265 CIF
Paper
Nb O6 Sr2 YP 1 21/n 15.81174; 5.86444; 8.24541
90; 90.166; 90
281.024Howard, Christopher J.; Barnes, Paris W.; Kennedy, Brendan J.; Woodward, Patrick M.
Structures of the ordered double perovskites Sr~2~YTaO~6~ and Sr~2~YNbO~6~
Acta Crystallographica Section B, 2005, 61, 258-262
2100266 CIF
Paper
O6 Sr2 Ta YP 1 21/n 15.81216; 5.85937; 8.24479
90; 90.1479; 90
280.78Howard, Christopher J.; Barnes, Paris W.; Kennedy, Brendan J.; Woodward, Patrick M.
Structures of the ordered double perovskites Sr~2~YTaO~6~ and Sr~2~YNbO~6~
Acta Crystallographica Section B, 2005, 61, 258-262
2100267 CIF
Paper
C4 H8 OA b a 29.3789; 13.658; 13.661
90; 90; 90
1749.9Dave Allan, D
The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH)
Acta Crystallographica Section B, 2005, 61, 449-454
2100268 CIF
Paper
C4 H8 OA b a 29.3312; 13.642; 13.619
90; 90; 90
1733.6Dave Allan, D
The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH)
Acta Crystallographica Section B, 2005, 61, 449-454
2100269 CIF
Paper
C4 H8 OP n a 214.9208; 8.2302; 9.598
90; 90; 90
388.71Dave Allan, D
The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH)
Acta Crystallographica Section B, 2005, 61, 449-454
2100270 CIF
HKL
Paper
C4 H8 N2 O5P 1 21/n 16.097; 12.7152; 8.8587
90; 94.051; 90
685.05Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100271 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.113; 12.7149; 8.8564
90; 93.437; 90
687.14Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100272 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.127; 12.7253; 8.8633
90; 93.068; 90
690.06Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100273 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1377; 12.7306; 8.8641
90; 92.528; 90
691.94Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100274 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1313; 12.703; 8.8456
90; 92.187; 90
688.4Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100275 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1538; 12.747; 8.877
90; 91.627; 90
696.1Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100276 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.158; 12.7515; 8.8763
90; 91.263; 90
696.83Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100277 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1567; 12.733; 8.865
90; 91.18; 90
694.8Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100278 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.177; 12.785; 8.898
90; 90; 90
702.7Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100279 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1626; 12.757; 8.876
90; 90; 90
697.8Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100280 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1624; 12.757; 8.878
90; 90; 90
697.9Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100281 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1665; 12.763; 8.8814
90; 90; 90
699Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100282 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1739; 12.7594; 8.8831
90; 90; 90
699.77Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100283 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.2144; 12.7512; 8.8841
90; 90; 90
703.99Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100284 CIF
Paper
C21 H27 N5 O4 SP -19.1487; 24.2873; 5.1794
93.118; 101.154; 83.479
1121.18Burley, Jonathan C.
Structure and intermolecular interactions of glipizide from laboratory X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 710-716
2100287 CIF
Paper
C25 H33 N9 O8P -17.69; 9.6995; 20.1404
80.522; 86.792; 72.33
1411.81Ferretti, Valeria; Pretto, Loretta; Tabrizi, Mojgan Aghazadeh; Bertolasi, Valerio
A structural study of new potent and selective antagonists to the A~2B~ adenosine receptor
Acta Crystallographica Section B, 2005, 61, 569-576
2100292 CIF
HKL
Paper
C10 H24 Cu N2 O13P 1 21/n 114.772; 13.987; 43.344
90; 97.33; 90
8882Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100293 CIF
HKL
Paper
C10 H24 Cu N2 O13P 1 21/n 114.659; 14.029; 42.475
90; 96.85; 90
8673Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100294 CIF
HKL
Paper
C10 H24 N2 O13 ZnP 1 21/c 114.721; 14.077; 26.111
90; 96.83; 90
5372.5Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100295 CIF
HKL
Paper
C10 H24 N2 O13 ZnP 1 21/c 114.633; 14.034; 25.561
90; 96.48; 90
5215.7Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100296 CIF
HKL
Paper
C10 H24 Mg N2 O13P 1 21/c 114.601; 14.182; 26.241
90; 96.77; 90
5395.9Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100297 CIF
HKL
Paper
C10 H24 Mg N2 O13P 1 21/c 114.497; 14.181; 25.7
90; 96.46; 90
5249.9Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100298 CIF
HKL
Paper
C10 H24 Co N2 O13P 4111.425; 11.425; 27.248
90; 90; 90
3556.7Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100299 CIF
HKL
Paper
C10 H24 Co N2 O13P 4111.306; 11.306; 27.041
90; 90; 90
3456.5Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100300 CIF
Paper
C6 Cd3 O12 P2P 1 21 18.7743; 9.4828; 9.167
90; 113.609; 90
698.9Bestaoui, Naima; Ouyang, Xiang; Fredoueil, Florence; Bujoli, Bruno; Clearfield, Abraham
Structural characterization of Cd~3~(O~3~PC~2~H~4~CO~2~)~2~·2H~2~O from in-house X-ray powder data and NMR
Acta Crystallographica Section B, 2005, 61, 669-674
2100301 CIF
HKL
Paper
C7 H5 N O4P 1 21/c 19.7116; 11.1347; 6.4421
90; 108.595; 90
660.26Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100302 CIF
HKL
Paper
C7 H5 N O4P 1 21/c 19.6986; 11.1571; 6.5891
90; 107.804; 90
678.85Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100303 CIF
HKL
Paper
C7 H3 D2 N O4P 1 21/c 19.7196; 11.1396; 6.454
90; 108.754; 90
661.69Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100304 CIF
HKL
Paper
C7 H3 D2 N O4P 1 21/c 19.7217; 11.1545; 6.5112
90; 108.397; 90
669.99Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100305 CIF
HKL
Paper
C7 H3 D2 N O4P 1 21/c 19.7614; 11.2243; 6.643
90; 108.304; 90
691Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100306 CIF
Paper
C7 H10 N O5 PP 1 21/c 112.1405; 12.4273; 6.3851
90; 100.122; 90
948.35Bendeif, El-eulmi; Dahaoui, Slimane; François, Michel; Benali-Cherif, Nourredine; Lecomte, Claude
Isostructural phase transition in <i>m</i>-carboxyphenylammonium monohydrogenphosphite
Acta Crystallographica Section B, 2005, 61, 700-709
2100307 CIF
Paper
C7 H10 N O5 PP 1 21/c 113.036; 11.538; 6.6366
90; 104.73; 90
965.4Bendeif, El-eulmi; Dahaoui, Slimane; François, Michel; Benali-Cherif, Nourredine; Lecomte, Claude
Isostructural phase transition in <i>m</i>-carboxyphenylammonium monohydrogenphosphite
Acta Crystallographica Section B, 2005, 61, 700-709
2100328 CIF
Paper
Cl H4 Na9 O20 S4P 4/n :229.6829; 29.6829; 8.4018
90; 90; 90
7402.61Pritchard, Robin Gavin; Begum, Zubeda; Lau, Yuf Fai; Austin, Jonothan
Structures of Na~9~[SO~4~]~4~<i>X</i>·2H~2~O~2~, where <i>X</i> = Cl or Br, in which the halide anions orchestrate extended orientation sequences of H~2~O~2~ solvate molecules
Acta Crystallographica Section B, 2005, 61, 663-668
2100329 CIF
Paper
Br H4 Na9 O20 S4P 4/n :214.9126; 14.9126; 8.4052
90; 90; 90
1869.2Pritchard, Robin Gavin; Begum, Zubeda; Lau, Yuf Fai; Austin, Jonothan
Structures of Na~9~[SO~4~]~4~<i>X</i>·2H~2~O~2~, where <i>X</i> = Cl or Br, in which the halide anions orchestrate extended orientation sequences of H~2~O~2~ solvate molecules
Acta Crystallographica Section B, 2005, 61, 663-668
2100332 CIF
Paper
Al0.21 Ga1.93 K0.152 O7 Ti1.86I 4/m18.0971; 18.0971; 2.9916
90; 90; 90
979.8Michiue, Yuichi; Yoshikado, Shinzo
X-ray diffraction study for one-dimensional ionic conductors K~<i>x~</i>(Ga~1{-~<i>y</i>}Al~y~)~2+<i>x~</i>Ti~2{-~<i>x</i>}O~7~ (<i>x</i> ≃0.14, <i>y</i> ≃0.10, 0.23, 0.39)
Acta Crystallographica Section B, 2005, 61, 608-615
2100333 CIF
Paper
Al0.49 Ga1.65 K0.155 O7 Ti1.86I 4/m18.0606; 18.0606; 2.9839
90; 90; 90
973.3Michiue, Yuichi; Yoshikado, Shinzo
X-ray diffraction study for one-dimensional ionic conductors K~<i>x~</i>(Ga~1{-~<i>y</i>}Al~y~)~2+<i>x~</i>Ti~2{-~<i>x</i>}O~7~ (<i>x</i> ≃0.14, <i>y</i> ≃0.10, 0.23, 0.39)
Acta Crystallographica Section B, 2005, 61, 608-615
2100334 CIF
Paper
Al0.84 Ga1.3 K0.157 O7 Ti1.86I 4/m18.0088; 18.0088; 2.9759
90; 90; 90
965.1Michiue, Yuichi; Yoshikado, Shinzo
X-ray diffraction study for one-dimensional ionic conductors K~<i>x~</i>(Ga~1{-~<i>y</i>}Al~y~)~2+<i>x~</i>Ti~2{-~<i>x</i>}O~7~ (<i>x</i> ≃0.14, <i>y</i> ≃0.10, 0.23, 0.39)
Acta Crystallographica Section B, 2005, 61, 608-615
2100335 CIFO2 SiR -3 :H13.7761; 13.7761; 41.5456
90; 90; 120
6828.23Acta Crystallographica, Section B, 2005, 61, 627-634
2100339 CIF
Paper
C3 H7 NP b c a5.0741; 9.7594; 13.305
90; 90; 90
658.87Lozano-Casal, Patricia; Allan, David R.; Parsons, Simon
Pressure-induced polymorphism in cyclopropylamine
Acta Crystallographica Section B, 2005, 61, 717-723
2100340 CIF
HKL
Paper
C6 H14 O2C 1 2/c 116.36; 16.219; 10.942
90; 90.96; 90
2903Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100341 CIF
HKL
Paper
C6 H14 O2C 1 2/c 116.333; 16.145; 10.916
90; 90.92; 90
2878.1Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100342 CIF
HKL
Paper
C6 H16 O3P 1 2/n 110.582; 7.3637; 10.587
90; 92.13; 90
824.4Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100343 CIF
HKL
Paper
C6 H26 O8P n n m6.308; 6.321; 15.759
90; 90; 90
628.4Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100344 CIF
HKL
Paper
C6 H15 O2.5P 65 2 214.696; 14.696; 13.686
90; 90; 120
2559.8Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2105401 CIFB2 K Nb O6P b n 217.3056; 31.1632; 9.1659
90; 90; 90
2086.76Schmid, S.; Wagner, T.
Structure of K Nb O B2 O5 - a commensurately modulated structure
Acta Crystallographica B (39,1983-), 2005, 61, 361-366

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