Crystallography Open Database
Search results
Result: there are 10718 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 2102045 | CIF Paper | C38 H34 As2 Cl6 Pt | P b c a | 20.582; 8.146; 23.491 90; 90; 90 | 3938.5 | Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II) Acta Crystallographica Section B, 2000, 56, 226-233 |
| 2102046 | CIF Paper | C38 H34 As2 Cl4 Pt | P -1 | 9.3899; 9.5481; 11.931 109.7; 108.26; 98.77 | 915.6 | Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II) Acta Crystallographica Section B, 2000, 56, 226-233 |
| 2102047 | CIF HKL Paper | C39 H33 As2 Cl2 Pt | P 1 21/n 1 | 11.778; 18.712; 16.647 90; 104.78; 90 | 3547.4 | Johansson, Maria H.; Otto, Stefanus; Roodt, Andreas; Oskarsson, Åke Packing effects on the geometry of neutral platinum(II) complexes due to solvate molecules: the structure of <i>trans</i>-dichlorobis(triphenylarsine)platinum(II) Acta Crystallographica Section B, 2000, 56, 226-233 |
| 2102048 | CIF Paper | C18 H16 N2 O4 S2 | P 1 21/c 1 | 9.0603; 10.6109; 9.4613 90; 101.893; 90 | 890.1 | Nagel, Norbert; Bock, Hans; Eller, Peter Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine Acta Crystallographica Section B, 2000, 56, 234-244 |
| 2102049 | CIF Paper | C18 H16 N2 O4 S2 | P 1 21/n 1 | 10.6449; 6.451; 13.1061 90; 96.195; 90 | 894.74 | Nagel, Norbert; Bock, Hans; Eller, Peter Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine Acta Crystallographica Section B, 2000, 56, 234-244 |
| 2102050 | CIF Paper | C21 H22 N2 O5 S2 | P b c n | 17.503; 7.731; 15.188 90; 90; 90 | 2055.2 | Nagel, Norbert; Bock, Hans; Eller, Peter Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine Acta Crystallographica Section B, 2000, 56, 234-244 |
| 2102051 | CIF Paper | C22 H28 N2 O6 S4 | P -1 | 8.4277; 13.0779; 13.401 116.532; 97.1; 90.425 | 1308.1 | Nagel, Norbert; Bock, Hans; Eller, Peter Dimorphism and inclusion compounds of <i>N</i>,<i>N</i>'-di(benzenesulfonyl)-<i>p</i>-phenylenediamine Acta Crystallographica Section B, 2000, 56, 234-244 |
| 2102052 | CIF Paper | C20 H4 Co D27 N6 O4 | P 1 21 1 | 9.6772; 13.8988; 8.9432 90; 96.322; 90 | 1195.56 | Ohhara, Takashi; Harada, Jun; Ohashi, Yuji; Tanaka, Ichiro; Kumazawa, Shintaro; Niimura, Nobuo Direct observation of deuterium migration in crystalline-state reaction by single-crystal neutron diffraction. II. 3‒1 Photoisomerization of a cobaloxime complex Acta Crystallographica Section B, 2000, 56, 245-253 |
| 2102053 | CIF Paper | C20 H4 Co D27 N6 O4 | P 1 21 1 | 9.1579; 13.9694; 9.2757 90; 99.954; 90 | 1168.78 | Ohhara, Takashi; Harada, Jun; Ohashi, Yuji; Tanaka, Ichiro; Kumazawa, Shintaro; Niimura, Nobuo Direct Observation of Deuterium Migration in Crystalline-State Reaction by Single Crystal Neutron Diffraction II. 3-1 Photoisomerization of a Cobaloxime Complex Acta Crystallographica, Section B, 2000, 56, 245-253 |
| 2102054 | CIF Paper | C20 H4 Co D27 N6 O4 | P 1 21 1 | 9.1579; 13.9694; 9.2757 90; 99.954; 90 | 1168.78 | Ohhara, Takashi; Harada, Jun; Ohashi, Yuji; Tanaka, Ichiro; Kumazawa, Shintaro; Niimura, Nobuo Direct Observation of Deuterium Migration in Crystalline-State Reaction by Single Crystal Neutron Diffraction II. 3-1 Photoisomerization of a Cobaloxime Complex Acta Crystallographica, Section B, 2000, 56, 245-253 |
| 2102055 | CIF Paper | C13 H10 O | C 1 2/c 1 | 16.2219; 8.1468; 16.334 90; 112.911; 90 | 1988.35 | Kutzke, Hartmut; Klapper, Helmut; Hammond, Robert B.; Roberts, Kevin J. Metastable β-phase of benzophenone: independent structure determinations via X-ray powder diffraction and single crystal studies Acta Crystallographica, Section B: Structural Science, 2000, 56, 486-496 |
| 2102056 | CIF Paper | C13 H10 O | C 1 2/c 1 | 16.2; 8.104; 16.248 90; 112.82; 90 | 1966.2 | Kutzke, Hartmut; Klapper, Helmut; Hammond, Robert B.; Roberts, Kevin J. Metastable β-phase of benzophenone: independent structure determinations via X-ray powder diffraction and single crystal studies Acta Crystallographica, Section B: Structural Science, 2000, 56, 486-496 |
| 2102057 | CIF Paper | Br2 H6 N2 Pd | P b c a | 13.3202; 12.7223; 7.05854 90; 90; 90 | 1196.17 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
| 2102058 | CIF Paper | Br2 H6 N2 Pd | P -1 | 6.7854; 7.1057; 6.6241 103.221; 102.514; 100.386 | 294.52 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
| 2102059 | CIF Paper | Br2 H6 N2 Pd | P b c a | 8.4315; 8.4206; 8.0916 90; 90; 90 | 574.49 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
| 2102060 | CIF Paper | H6 I2 N2 Pd | P b c a | 13.906; 13.5035; 7.505 90; 90; 90 | 1409.29 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
| 2102061 | CIF Paper | H6 I2 N2 Pd | P b c a | 8.8347; 8.841; 8.6081 90; 90; 90 | 672.36 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
| 2102062 | CIF Paper | C8 H4 Na2 O4 | P b c 21 | 3.54807; 10.81599; 18.9943 90; 90; 90 | 728.92 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2102063 | CIF Paper | C8 H16 N2 O4 | P b c 21 | 4.0053; 11.814; 20.186 90; 90; 90 | 955.17 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2102064 | CIF Paper | C8 H4 K2 O4 | P 1 21/c 1 | 10.561; 3.944; 11.535 90; 113.08; 90 | 442 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2102065 | CIF Paper | C8 H5 K O4 | C 1 2/c 1 | 18.825; 3.77; 11.179 90; 94.56; 90 | 790.9 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2102066 | CIF Paper | C8 H9 N O4 | C 1 2/c 1 | 18.924; 3.7967; 11.481 90; 98.04; 90 | 816.8 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2102067 | CIF Paper | C8 H4 Li2 O4 | P 1 21/c 1 | 8.35918; 5.13212; 8.48489 90; 93.1555; 90 | 363.45 | Kaduk, James A. Terephthalate salts: salts of monopositive cations Acta Crystallographica Section B, 2000, 56, 474-485 |
| 2102068 | CIF Paper | Bi0.5 Na0.5 O3 Ti | P 4 b m | 5.5191; 5.5191; 3.9085 90; 90; 90 | 119.055 | Jones, G. O.; Thomas, P. A. The tetragonal phase of Na~0.5~Bi~0.5~TiO~3~ – a new variant of the perovskite structure Acta Crystallographica Section B, 2000, 56, 426-430 |
| 2102069 | CIF Paper | H4 K3 Nd O17 Si6 | P b a m | 16.008; 15.004; 7.2794 90; 90; 90 | 1748.4 | Haile, S. M.; Wuensch, B. J. Structure, phase transitions and ionic conductivity of K~3~NdSi~6~O~15~·<i>x</i>H~2~O. I. α-K~3~NdSi~6~O~15~·2H~2~O and its polymorphs Acta Crystallographica Section B, 2000, 56, 335-348 |
| 2102070 | CIF Paper | K3 Nd O15 Si6 | B b 21 m | 14.37; 15.518; 14.265 90; 90; 90 | 3181 | Haile, S. M.; Wuensch, B. J. Structure, phase transitions and ionic conductivity of K~3~NdSi~6~O~15~·<i>x</i>H~2~O. II. Structure of β-K~3~NdSi~6~O~15~ Acta Crystallographica Section B, 2000, 56, 349-362 |
| 2102071 | CIF HKL Paper | C252 N12 S18 | I 2 3 | 18.8492; 18.8492; 18.8492 90; 90; 90 | 6697 | Penicaud, Alain; Boubekeur, Kamal; Kotov, Alexander I.; Yagubskii, Eduard B. Novel infinite three-dimensional network of neutral fullerene molecules in (C~60~)~8~(twin-TDAS)~6~ Acta Crystallographica Section B, 2000, 56, 497-500 |
| 2102072 | CIF HKL Paper | Bi24 Cl10 O31 | P 1 2/c 1 | 10.033; 7.9745; 29.552 90; 88.742; 90 | 2363.8 | Eggenweiler, U.; Keller, E.; Krämer, V. Redetermination of the crystal structures of the `Arppe compound' Bi~24~O~31~Cl~10~ and the isomorphous Bi~24~O~31~Br~10~ Acta Crystallographica Section B, 2000, 56, 431-437 |
| 2102073 | CIF Paper | Bi24 Br10 O31 | A 1 2/m 1 | 10.141; 4.005; 29.977 90; 90.197; 90 | 1217.5 | Eggenweiler, U.; Keller, E.; Krämer, V. Redetermination of the crystal structures of the `Arppe compound' Bi~24~O~31~Cl~10~ and the isomorphous Bi~24~O~31~Br~10~ Acta Crystallographica Section B, 2000, 56, 431-437 |
| 2102074 | CIF Paper | C18 H24 O3 | P 1 21 1 | 6.2321; 9.9264; 12.812 90; 97.079; 90 | 786.54 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102075 | CIF Paper | C18 H26 O3 | P 21 21 21 | 6.318; 6.4489; 38.841 90; 90; 90 | 1582.5 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102076 | CIF Paper | C18 H26 O3 | P 21 21 21 | 14.241; 9.4401; 11.648 90; 90; 90 | 1565.9 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102077 | CIF Paper | C18 H24 O4 | P 1 21 1 | 6.2214; 12.05; 10.888 90; 103.07; 90 | 795.1 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102078 | CIF Paper | C18 H26 O4 | P 21 21 21 | 6.335; 9.482; 27.245 90; 90; 90 | 1636.6 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102079 | CIF Paper | C18 H26 O4 | P 21 21 21 | 9.3361; 9.6261; 17.764 90; 90; 90 | 1596.5 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102080 | CIF Paper | C18 H24 O4 | P 1 21 1 | 6.2246; 12.014; 10.915 90; 103.09; 90 | 795.04 | Anthony, Addlagatta; Jaskólski, Mariusz; Nangia, Ashwini Crystal chemistry of some synthetic 2-oxa-steroids: conformation, packing motifs and isostructurality Acta Crystallographica Section B, 2000, 56, 512-525 |
| 2102081 | CIF Paper | O62 P4 W18 | P -1 | 5.2945; 6.542; 32.744 90; 90.2; 89.78 | 1134.1 | Pascal Roussel; Philippe Labbe; Daniel Groult Symmetry and twins in the monophosphate tungsten bronze series (PO~2~)~4~(WO~3~)~2<i>m~</i> (2 {łeq} <i>m</i> {łeq} 14) Acta Crystallographica Section B, 2000, 56, 377-391 |
| 2102082 | CIF Paper | Cu7 P Se6 | P 21 3 | 10.108; 10.108; 10.108 90; 90; 90 | 1032.75 | Gaudin, E.; Boucher, F.; Petricek, V.; Taulelle, F.; Evain, M. Structures and phase transitions of the <i>A</i>~7~PSe~6~ (<i>A</i>~=~Ag, Cu) argyrodite-type ionic conductors. II. β- and γ-Cu~7~PSe~6~ Acta Crystallographica Section B, 2000, 56, 402-408 |
| 2102083 | CIF Paper | Cu7 P Se6 | F -4 3 m | 10.113; 10.113; 10.113 90; 90; 90 | 1034.28 | Gaudin, E.; Boucher, F.; Petricek, V.; Taulelle, F.; Evain, M. Structures and phase transitions of the <i>A</i>~7~PSe~6~ (<i>A</i>~=~Ag, Cu) argyrodite-type ionic conductors. II. β- and γ-Cu~7~PSe~6~ Acta Crystallographica Section B, 2000, 56, 402-408 |
| 2102084 | CIF HKL Paper | Cu H20 N2 O14 S2 | P 1 21/a 1 | 9.0964; 12.2225; 6.3447 90; 106.295; 90 | 677.07 | Figgis, Brian N.; Sobolev, Alexandre N.; Simmons, Charles J.; Hitchman, Michael A.; Stratemeier, Horst; Riley, Mark J. Bonding effects and the crystal structures of (NH~4~)~2~[Cu(H~2~O)~6~](SO~4~)~2~ and its H~2~^18^O substituted form at 9.5K Acta Crystallographica Section B, 2000, 56, 438-443 |
| 2102085 | CIF HKL Paper | Cu H20 N2 O14 S2 | P 1 21/a 1 | 9.0921; 12.2195; 6.3442 90; 106.277; 90 | 676.59 | Figgis, Brian N.; Sobolev, Alexandre N.; Simmons, Charles J.; Hitchman, Michael A.; Stratemeier, Horst; Riley, Mark J. Bonding effects and the crystal structures of (NH~4~)~2~[Cu(H~2~O)~6~](SO~4~)~2~ and its H~2~^18^O substituted form at 9.5K Acta Crystallographica Section B, 2000, 56, 438-443 |
| 2102086 | CIF Paper | Al477.44 Cr63.42 Fe51.42 | P 63/m | 40.68; 40.68; 12.546 90; 90; 120 | 17980 | Mo, Z.M.; Zhou, H.Y.; Kuo, K.H. Structure of ν-Al~80.61~Cr~10.71~Fe~8.68~, a giant hexagonal approximant of a quasicrystal determined by a combination of electron microscopy and X-ray diffraction Acta Crystallographica Section B, 2000, 56, 392-401 |
| 2102087 | CIF Paper | K O3 Ta | P m -3 m | 3.9883; 3.9883; 3.9883 90; 90; 90 | 63.44 | Zhurova, Elizabeth A.; Ivanov, Yury; Zavodnik, Valery; Tsirelson, Vladimir Electron density and atomic displacements in KTaO~3~ Acta Crystallographica Section B, 2000, 56, 594-600 |
| 2102088 | CIF Paper | C13 H19 N3 O6 | P 21 21 21 | 7.984; 9.535; 18.352 90; 90; 90 | 1397.1 | Pichon-Pesme, Virginie; Lachekar, Hassane; Souhassou, Mohamed; Lecomte, Claude Electron density and electrostatic properties of two peptide molecules: tyrosyl-glycyl-glycine monohydrate and glycyl-aspartic acid dihydrate Acta Crystallographica Section B, 2000, 56, 728-737 |
| 2102089 | CIF Paper | C6 H14 N2 O7 | P 21 21 21 | 9.659; 9.672; 10.739 90; 90; 90 | 1003.26 | Pichon-Pesme, Virginie; Lachekar, Hassane; Souhassou, Mohamed; Lecomte, Claude Electron density and electrostatic properties of two peptide molecules: tyrosyl-glycyl-glycine monohydrate and glycyl-aspartic acid dihydrate Acta Crystallographica Section B, 2000, 56, 728-737 |
| 2102090 | CIF Paper | K Li O4 S | P 63 | 5.202; 5.202; 8.647 90; 90; 120 | 202.65 | Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K Acta Crystallographica Section B, 2000, 56, 607-617 |
| 2102091 | CIF Paper | K Li O4 S | P m c n | 5.264; 9.148; 8.666 90; 90; 90 | 417.3 | Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K Acta Crystallographica Section B, 2000, 56, 607-617 |
| 2102092 | CIF Paper | K Li O4 S | P m c n | 5.27; 9.193; 8.751 90; 90; 90 | 424 | Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K Acta Crystallographica Section B, 2000, 56, 607-617 |
| 2102093 | CIF Paper | C76 H134 Cu2 N2 O12 | P -1 | 10.231; 12.878; 16.804 92.39; 104.31; 106.17 | 2045.9 | Rusjan, Marcia; Chaia, Zulema D.; Piro, Oscar E.; Guillon, Daniel; Cukiernik, Fabio D. Synthesis, structure and magnetic properties of tetrakis-μ-carboxylato-bis(dodecylnicotinato)dicopper(II) complexes; crystal and molecular structure of the decyl carboxylate derivative Acta Crystallographica Section B, 2000, 56, 666-672 |
| 2102094 | CIF Paper | C5 H6 N2 | I -4 | 13.799; 13.799; 10.876 90; 90; 90 | 2070.9 | Boese, Roland; Gehrke, Annette; Kapon, Moshe; Herbstein, Frank H. Determining the crystal structure of twinned 2-methylpyrazine Acta Crystallographica Section B, 2000, 56, 677-681 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

