Crystallography Open Database

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2003076 CIF
Paper
Bi7 O18 Ta3C 134.005; 7.6024; 6.6358
90.086; 109.127; 90.043
1620.8Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S
Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~
Acta Crystallographica Section B, 1999, 55, 157-164
2003077 CIF
Paper
Bi7 O18 Ta3C 1 2/m 134.0084; 7.6069; 6.63644
90; 109.238; 90
1620.97Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S
Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~
Acta Crystallographica Section B, 1999, 55, 157-164
2003078 CIF
Paper
C19 H9 I O3P b c a12.934; 14.748; 15.858
90; 90; 90
3024.9Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003079 CIF
Paper
C19 H9 B F4 O3P b c a12.817; 15.196; 15.396
90; 90; 90
2998.6Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003080 CIF
Paper
C19 H9 As F6 O3P b c a13.55; 15.807; 32.201
90; 90; 90
6897Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003081 CIF
Paper
C19 H9 F6 O3 PR -3 c :H12.946; 12.946; 16.806
90; 90; 120
2439.3Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003082 CIF
Paper
C19 H10 N2 O9P 1 21/n 16.496; 7.653; 33.039
90; 91.95; 90
1641.5Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003083 CIF
Paper
C20 H9 F3 O6 SP 1 21/c 115.771; 15.473; 15.332
90; 115.7; 90
3371.3Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003084 CIF
Paper
C38 H18 Cl14 Mo6 O6C 1 2/c 118.205; 13.54; 18.679
90; 97.93; 90
4560.3Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003085 CIF
Paper
C38 H18 O12 S2P -18.63; 8.968; 9.876
97.91; 102.37; 108.61
689.8Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003086 CIF
Paper
C33 H36 F6 N O3 PP 1 21/n 112.085; 11.347; 22.93
90; 102.87; 90
3065.4Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003087 CIF
Paper
C62 H66 Cl14 Mo6 O6P 1 21/n 117.157; 11.13; 18.456
90; 96.4; 90
3502.3Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003088 CIF
Paper
C19 H9 F6 O3 PR -3 c :H12.964; 12.964; 16.813
90; 90; 120
2447.1Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003089 CIF
Paper
C19 H9 F6 O3 PR -3 c :H12.997; 12.997; 16.843
90; 90; 120
2464Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003090 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.015; 13.015; 16.859
90; 90; 120
2473.2Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003091 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.04; 13.04; 16.884
90; 90; 120
2486.3Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003092 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.067; 13.067; 16.91
90; 90; 120
2500.5Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003093 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.094; 13.094; 16.937
90; 90; 120
2514.8Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003094 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.111; 13.111; 16.953
90; 90; 120
2523.8Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003095 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.131; 13.131; 16.97
90; 90; 120
2534Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003096 CIF
Paper
C19 H9 F6 O3 PR -3 c :H13.181; 13.181; 17.025
90; 90; 120
2561.6Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions
Acta Crystallographica, Section B: Structural Science, 1999, 55, 410-423
2003097 CIF
Paper
Ca15 I O37 P9P 63/m9.567; 9.567; 20.754
90; 90; 120
1645.1Alberius Henning, Peter; Lidin, Sven; Petříček, Vačlav
Iodo-oxyapatite, the first example from a new class of modulated apatites
Acta Crystallographica Section B, 1999, 55, 165-169
2003098 CIF
Paper
C9 H20 N2 O4P 1 21 19.8944; 4.7425; 12.9045
90; 93.374; 90
604.48Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003099 CIF
Paper
C10 H22 N2 O4C 1 2 126.9873; 4.7471; 9.9652
90; 94.546; 90
1272.64Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003100 CIF
Paper
C11 H24 N2 O4C 1 2 129.0557; 4.7551; 9.9398
90; 101.358; 90
1346.42Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003101 CIF
Paper
C12 H26 N2 O4P 1 21 110.012; 4.7227; 30.335
90; 98.38; 90
1419Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003102 CIF
Paper
C11 H24 N2 O4 SC 1 2 131.7681; 4.717; 10.0043
90; 105.914; 90
1441.69Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003103 CIF
Paper
C11 H24 N2 O4P 1 21 15.2528; 23.9809; 5.42
90; 110.42; 90
639.84Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003104 CIF
Paper
C12 H26 N2 O4P 15.1933; 5.4064; 13.6968
91.516; 98.603; 110.376
355.16Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003105 CIF
Paper
Bi14 O24 WI 4/m8.71083; 8.71083; 17.32202
90; 90; 90
1314.37Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S.
Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data
Acta Crystallographica Section B, 1999, 55, 306-312
2003106 CIF
Paper
Bi14 Mo O24I 4/m8.70839; 8.70839; 17.31634
90; 90; 90
1313.2Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S.
Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data
Acta Crystallographica Section B, 1999, 55, 306-312
2003109 CIF
Paper
C10 H15 LiR 3 m :H14.7711; 14.7711; 3.82206
90; 90; 120
722.19Robert E. Dinnebier
Disorder determined by high-resolution powder diffraction: structure of pentamethylcyclopentadienyllithium
Acta Crystallographica Section B, 1999, 55, 35-44
2003110 CIF
Paper
C15 H28 N4 O4P 1 21/c 15.8907; 26.071; 11.8868
90; 106.118; 90
1753.8Marc Hostettler; Henrik Birkedal; Manual Gardon; Gervais Chapuis; Dieter Schwarzenbach; Michel Bonin
Phase-transition-induced twinning in the 1:1 adduct of hexamethylenetetramine and azelaic acid
Acta Crystallographica Section B, 1999, 55, 448-458
2003112 CIF
Paper
C H4 N2 OP -4 21 m5.589; 5.589; 4.6947
90; 90; 90
146.65Zavodnik, Valery; Stash, Adam; Tsirelson, Vladimir; de Vries, Roelof; Feil, Dirk
Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results
Acta Crystallographica Section B, 1999, 55, 45-54
2003124 CIF
HKL
Paper
Fe Nd O3P n m a5.5887; 7.7619; 5.4489
90; 90; 90
236.37Streltsov, V. A.; Ishizawa, N.
Synchrotron X-ray study of the electron density in <i>R</i>FeO~3~ (<i>R</i> = Nd, Dy)
Acta Crystallographica Section B, 1999, 55, 1-7
2003125 CIF
HKL
Paper
Dy Fe O3P n m a5.5957; 7.629; 5.3009
90; 90; 90
226.29Streltsov, V. A.; Ishizawa, N.
Synchrotron X-ray study of the electron density in <i>R</i>FeO~3~ (<i>R</i> = Nd, Dy)
Acta Crystallographica Section B, 1999, 55, 1-7
2003129 CIF
HKL
Paper
Al Li O6 Si2C 1 2/c 19.462; 8.392; 5.221
90; 110.18; 90
389.12Kuntzinger, Sandrine; Ghermani, Nour Eddine
Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data
Acta Crystallographica Section B, 1999, 55, 273-284
2003130 CIF
HKL
Paper
Al Li O6 Si2C 1 2/c 19.456; 8.386; 5.216
90; 110.13; 90
388.35Kuntzinger, Sandrine; Ghermani, Nour Eddine
Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data
Acta Crystallographica Section B, 1999, 55, 273-284
2003131 CIF
Paper
Nb0.5 O3 Sr Yb0.5P 1 21/n 15.79095; 5.8221; 8.20358
90; 90.1262; 90
276.59Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee
The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~
Acta Crystallographica, Section B, 1999, 55, 348-354
2003132 CIF
Paper
Nb0.5 O3 Sr Yb0.5P 1 21/n 15.79095; 5.8221; 8.20358
90; 90.1262; 90
276.59Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee
The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~
Acta Crystallographica, Section B, 1999, 55, 348-354
2003133 CIF
HKL
Paper
C5 H5 Cl4 Hg NP 1 21/n 19.094; 18.143; 12.902
90; 106.13; 90
2045Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick
Polynuclear chloromercurate(II) systems in their chloropyridinium salts
Acta Crystallographica Section B, 1999, 55, 396-409
2003134 CIF
HKL
Paper
C20 H20 Cl14 Hg3 N4P 1 21/n 17.522; 28.046; 9.165
90; 105.78; 90
1860.6Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick
Polynuclear chloromercurate(II) systems in their chloropyridinium salts
Acta Crystallographica Section B, 1999, 55, 396-409
2003135 CIF
Paper
C20 H20 Cl14 Hg3 N4P -19.907; 13.226; 7.282
84.41; 74.81; 87.34
916.2Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick
Polynuclear chloromercurate(II) systems in their chloropyridinium salts
Acta Crystallographica Section B, 1999, 55, 396-409
2003136 CIF
HKL
Paper
C5 H5 Cl4 Hg NP 1 21/c 17.243; 22.145; 12.32
90; 99.52; 90
1948.9Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick
Polynuclear chloromercurate(II) systems in their chloropyridinium salts
Acta Crystallographica Section B, 1999, 55, 396-409
2003137 CIF
HKL
Paper
C10 H10 Cl8 Hg2 N2C 1 2/m 113.447; 7.534; 9.939
90; 97.48; 90
998.3Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick
Polynuclear chloromercurate(II) systems in their chloropyridinium salts
Acta Crystallographica Section B, 1999, 55, 396-409
2003165 CIF
HKL
Paper
C22 H48 Cl2 N6 O8 ZnC 1 2/c 110.191; 17.678; 17.754
90; 99.42; 90
3155Haller, Kenneth J.; Rae, A. David; Bygott, Alexia M. T.; Hockless, David C. R.; Ralph, Stephen F.; Geue, Rodney J.; Sargeson, Alan M.
Four-component intergrowth structures of the metal-ion cage complexes <i>fac</i>-(1,5,9,13,20-pentamethyl-3,7,11,15,18,22-hexaazabicyclo[7.7.7]tricosane)<i>M</i>^II^ diperchlorate hydrate, [<i>M</i>(C~22~H~48~N~6~)](ClO~4~)~2~.<i>x</i>H~2~O, <i>M</i> = Ni, Zn
Acta Crystallographica Section B, 1999, 55, 380-388
2003166 CIF
HKL
Paper
C22 H48 Cl2 N6 Ni O8C 1 2/c 110.177; 17.648; 17.605
90; 99.7; 90
3116.7Haller, Kenneth J.; Rae, A. David; Bygott, Alexia M. T.; Hockless, David C. R.; Ralph, Stephen F.; Geue, Rodney J.; Sargeson, Alan M.
Four-component intergrowth structures of the metal-ion cage complexes <i>fac</i>-(1,5,9,13,20-pentamethyl-3,7,11,15,18,22-hexaazabicyclo[7.7.7]tricosane)<i>M</i>^II^ diperchlorate hydrate, [<i>M</i>(C~22~H~48~N~6~)](ClO~4~)~2~.<i>x</i>H~2~O, <i>M</i> = Ni, Zn
Acta Crystallographica Section B, 1999, 55, 380-388
2003173 CIF
Paper
Ca7 O36 Ta6 Zr7F d d d :236.394; 7.3674; 31.006
90; 90; 90
8313.6Schmid, Siegbert; Thompson, John G.; Withers, Ray L.; Ling, Christopher D.; Ishizawa, Nobuo; Kishimoto, Shunji
The crystal structure of Ca~7~Zr~7~Ta~6~O~36~ refined using synchrotron-radiation data
Acta Crystallographica Section B, 1999, 55, 313-320
2105530 CIF
Paper
C58 H64 N2 O12P 1 21/a 113.667; 18.647; 20.188
90; 90.72; 90
5144Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques
Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)
Acta Crystallographica Section B, 1999, 55, 95-103
2105531 CIF
Paper
C58 H64 N2 O12P 1 21/a 120.341; 11.709; 23.875
90; 112.39; 90
5258Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques
Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)
Acta Crystallographica Section B, 1999, 55, 95-103
2105532 CIF
Paper
C58 H64 N2 O12P -120.285; 11.608; 23.894
92.22; 112.32; 87.81
5199Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques
Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)
Acta Crystallographica Section B, 1999, 55, 95-103
2105533 CIF
Paper
C6 H2 F4 O2P 1 21/n 16.5533; 4.8848; 10.148
90; 107.99; 90
308.97Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R.
A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone
Acta Crystallographica Section B, 1999, 55, 1005-1013
2105534 CIF
Paper
C6 H2 Br4 O2P 1 21/n 18.8907; 4.7316; 11.0612
90; 92.167; 90
464.981Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R.
A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone
Acta Crystallographica Section B, 1999, 55, 1005-1013
2105550 CIF
Paper
C5 H16 Cl4 Co N2P 1 21/c 17.1633; 15.94; 11.137
90; 98.44; 90
1257.9Criado, J. J.; Jiménez-Sánchez, A.; Cano, F. H.; Sáez-Puche, R.; Rodríguez-Fernández, E.
Preparation and characterization of tetrachlorocobaltates(II) of α,ω-alkylenediammonium. Magnetic and thermal properties. Crystal structure of [NH~3~(CH~2~)~5~NH~3~]CoCl~4~
Acta Crystallographica Section B, 1999, 55, 947-952
2105553 CIF
Paper
C4 H16 N4 Ni O14 V6P 1 21/c 18.9311; 17.127; 6.627
90; 111.61; 90
942.4Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley
Crystal structure of layered bis(ethylenediamine)nickel hexavanadate as a new representative of the V~6~O~14~ series
Acta Crystallographica Section B, 1999, 55, 953-962
2105554 CIF
Paper
C4 H16 N4 Ni O14 V6P 1 21/n 117.862; 17.127; 6.627
90; 111.61; 90
1884.9Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley
Crystal structure of layered bis(ethylenediamine)nickel hexavanadate as a new representative of the V~6~O~14~ series
Acta Crystallographica Section B, 1999, 55, 953-962
2105555 CIF
Paper
La Mo2 O5P 63/m m c8.368; 8.368; 19.13687
90; 90; 120
1160.5Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex C.
Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~
Acta Crystallographica Section B, 1999, 55, 683-697
2105556 CIF
Paper
Mo3 O8 Zn2P 63 m c5.77322; 5.77322; 9.91231
90; 90; 120
286.116Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex. C.
Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~
Acta Crystallographica Section B, 1999, 55, 683-697
2105557 CIF
Paper
N O PI 1 2/a 18.5194; 4.7448; 10.397
90; 90.013; 90
420.276Haines, J.; Chateau, C.; Léger, J. M.; Le Sauze, A.; Diot, N.; Marchand, R.; Hull, S.
Crystal structure of moganite-type phosphorus oxynitride: relationship to other twinned-quartz-based structures
Acta Crystallographica Section B, 1999, 55, 677-682
2105559 CIF
Paper
Cs2 H3 O8 P SP 1 21/n 17.856; 7.732; 7.827
90; 99.92; 90
468.3Chisholm, Calum R. I.; Haile, Sossina M.
Structure and thermal behavior of the new superprotonic conductor Cs~2~(HSO~4~)(H~2~PO~4~)
Acta Crystallographica Section B, 1999, 55, 937-946
2105579 CIF
Paper
C12 H13 N3 O2 SP 1 21/c 18.771; 13.344; 11.036
90; 108.314; 90
1226.2Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105580 CIF
Paper
C9 H13 N3 O2 SP b c a11.9723; 12.5938; 15.063
90; 90; 90
2271.2Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105581 CIF
Paper
C16 H13 N3 O2 SP 1 21/c 110.182; 11.923; 12.284
90; 107.23; 90
1424.4Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105582 CIF
Paper
C13 H13 N3 O2 SP 1 21/c 15.5561; 19.701; 12.143
90; 100.263; 90
1307.9Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105583 CIF
Paper
C12 H10 N2 O2 S2P 1 21/c 19.162; 11.121; 12.033
90; 104.388; 90
1187.6Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105584 CIF
Paper
C5 H6 O SP 1 21/a 16.848; 7.54; 11.111
90; 106.01; 90
551.5Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105585 CIF
Paper
C5 H6 O SP 21 21 216.641; 7.109; 11.594
90; 90; 90
547.4Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105586 CIF
Paper
C7 H8 O2 SP -17.5941; 7.8219; 7.9811
63.112; 64.66; 89.636
371.7Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105587 CIF
Paper
C5 H3 N O SP 1 21/n 17.516; 8.332; 9.059
90; 100.19; 90
558.4Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105588 CIF
Paper
C5 H6 O S2P n 21 a19.513; 8.083; 4.046
90; 90; 90
638.1Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105589 CIF
Paper
C9 H12 O SP 1 21/c 110.826; 17.065; 19.19
90; 91.011; 90
3544.7Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105590 CIF
Paper
C13 H8 Cl2 OI 1 2/c 124.527; 6.064; 7.457
90; 100.1; 90
1091.9Mitkevich, V. V.; Lirtsman, V. G.; Strzhemechny, M. A.; Avdeenko, A. A.; Eremenko, V. V.
Investigation of the structural phase transitions near 190K in 4,4'-dichlorobenzophenone
Acta Crystallographica Section B, 1999, 55, 799-806
2105592 CIF
Paper
C27 H36 N2 O5P 1 21 113.706; 22.8; 30.674
90; 97.15; 90
9511Antolić, S.; Teichert, M.; Sheldrick, G.; Kojić-Prodić, B.; Čudić, M.; Horvat, Š.
Structure and molecular modelling of protected dipeptide fragment (Boc‒Phe‒Leu‒OBzl) of enkephalin
Acta Crystallographica Section B, 1999, 55, 975-984
2105614 CIF
Paper
C25 H33 NP 1 21/c 113.667; 16.414; 9.409
90; 94.54; 90
2104.1Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.
Molecular structures and conformations of three 3-azabicyclononanes
Acta Crystallographica Section B, 1999, 55, 793-798
2105615 CIF
Paper
C22 H25 N OP b c a14.687; 12.931; 18.564
90; 90; 90
3525.6Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.
Molecular structures and conformations of three 3-azabicyclononanes
Acta Crystallographica Section B, 1999, 55, 793-798
2105616 CIF
Paper
C23 H29 N OP 1 21/n 17.638; 13.188; 18.865
90; 97.94; 90
1882.1Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.
Molecular structures and conformations of three 3-azabicyclononanes
Acta Crystallographica Section B, 1999, 55, 793-798
2105617 CIF
Paper
C24 H25 Cl N4P 1 21/c 18.19; 14.463; 18.115
90; 96.2; 90
2133.2Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Fernàndez-Castaño, Cristina
Self-assembly of N<i>H</i>-pyrazoles <i>via</i> intermolecular N—H···N hydrogen bonds
Acta Crystallographica Section B, 1999, 55, 985-993
2105618 CIF
Paper
C8 H10 N4 OP b c n16.409; 7.619; 13.544
90; 90; 90
1693.3Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Fernàndez-Castaño, Cristina
Self-assembly of N<i>H</i>-pyrazoles <i>via</i> intermolecular N—H···N hydrogen bonds
Acta Crystallographica Section B, 1999, 55, 985-993
2105619 CIF
Paper
C11 H8 N4 OP 1 21/n 17.196; 14.125; 10.862
90; 97.34; 90
1095Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105620 CIF
Paper
C11 H11 N3 OP 1 21/n 17.052; 13.211; 11.996
90; 104.96; 90
1079.7Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105621 CIF
Paper
C12 H11 N3 O2P 1 21/n 18.638; 10.841; 12.208
90; 94.69; 90
1139.4Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105622 CIF
Paper
C11 H11 N3 O2P n m a15.236; 6.618; 11.379
90; 90; 90
1147.4Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105623 CIF
Paper
C12 H11 N3 O2P -16.878; 8.241; 11.395
105.21; 96.62; 102.92
597Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105624 CIF
Paper
C10 H8 N4 O3P 1 21/n 17.184; 19.491; 8.084
90; 109.27; 90
1068.5Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105625 CIF
Paper
C16 H23 N2 OP 1 21/c 112.684; 11.74; 11.024
90; 111.4; 90
1528.4Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105626 CIF
Paper
C16 H23 N2 OP 1 21/c 112.5774; 11.6228; 10.8229
90; 110.853; 90
1478.5Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105627 CIF
Paper
C17 H25 N2 O SP 1 21/c 113.5737; 11.8796; 11.1628
90; 98.76; 90
1779Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105628 CIF
Paper
C15 H22 N3 OP 1 21/c 112.425; 11.598; 11.038
90; 109.53; 90
1499.1Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105629 CIF
Paper
C17 H25 N2 OP 1 21/c 112.49; 11.597; 11.28
90; 97.12; 90
1621.3Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105630 CIF
Paper
C17 H25 N2 OP 1 21/c 112.4422; 11.495; 11.094
90; 97.381; 90
1573.6Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105631 CIF
Paper
C20 H25 N2 OP n a 2120.0837; 5.6969; 15.106
90; 90; 90
1728.4Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105632 CIF
Paper
C22 H27 N2 O2P c a 2130.565; 5.993; 22.032
90; 90; 90
4036Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105633 CIF
Paper
C17 H25 N2 O3 SP 1 21/c 111.1835; 15.487; 11.566
90; 114.539; 90
1822.3Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105634 CIF
Paper
O12 Re2 Tm5C 1 2/m 112.3717; 5.6744; 7.4805
90; 107.816; 90
499.96Ehrenberg, H.; Hartmann, T.; Wltschek, G.; Fuess, H.; Morgenroth, W.; Krane, H.-G.
The crystal structure of Tm~5~Re~2~O~12~
Acta Crystallographica Section B, 1999, 55, 849-852
2105635 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 15.985; 9.291; 10.931
90; 100.32; 90
598Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105636 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 16.006; 9.338; 10.986
90; 100.45; 90
605.9Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105637 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 15.961; 9.273; 10.891
90; 100.02; 90
592.8Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105638 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 15.968; 9.283; 10.897
90; 100.08; 90
594.4Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105639 CIF
Paper
C4 H16 Cl4 Co N2P 1 21/n 18.5313; 11.4382; 13.307
90; 90.038; 90
1298.53Mahmoudkhani, Amir H.; Langer, Vratislav
Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Acta Crystallographica Section B, 1999, 55, 752-757
2105640 CIF
Paper
C4 H16 Cl4 Co N2P 1 21/n 18.5513; 11.4527; 13.3364
90; 90.01; 90
1306.11Mahmoudkhani, Amir H.; Langer, Vratislav
Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Acta Crystallographica Section B, 1999, 55, 752-757

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