Crystallography Open Database
Search results
Result: there are 233 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: Structural Science' volume of publication is 55
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2003091 | CIF Paper | C19 H9 F6 O3 P | R -3 c :H | 13.04; 13.04; 16.884 90; 90; 120 | 2486.3 | Krebs, 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 P | R -3 c :H | 13.067; 13.067; 16.91 90; 90; 120 | 2500.5 | Krebs, 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 P | R -3 c :H | 13.094; 13.094; 16.937 90; 90; 120 | 2514.8 | Krebs, 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 P | R -3 c :H | 13.111; 13.111; 16.953 90; 90; 120 | 2523.8 | Krebs, 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 P | R -3 c :H | 13.131; 13.131; 16.97 90; 90; 120 | 2534 | Krebs, 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 P | R -3 c :H | 13.181; 13.181; 17.025 90; 90; 120 | 2561.6 | Krebs, 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 |
2003033 | CIF Paper | C51 H98 O6 | P -1 | 5.4514; 11.945; 40.482 84.662; 86.97; 79.77 | 2581.1 | A.J. van Langevelde Structure of mono-acid even-numbered β-triacylglycerols Acta Crystallographica Section B, 1999, 55, 114-122 |
2003079 | CIF Paper | C19 H9 B F4 O3 | P b c a | 12.817; 15.196; 15.396 90; 90; 90 | 2998.6 | Krebs, 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 |
2003078 | CIF Paper | C19 H9 I O3 | P b c a | 12.934; 14.748; 15.858 90; 90; 90 | 3024.9 | Krebs, 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 P | P 1 21/n 1 | 12.085; 11.347; 22.93 90; 102.87; 90 | 3065.4 | Krebs, 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 |
2003166 | CIF HKL Paper | C22 H48 Cl2 N6 Ni O8 | C 1 2/c 1 | 10.177; 17.648; 17.605 90; 99.7; 90 | 3116.7 | Haller, 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 |
2003165 | CIF HKL Paper | C22 H48 Cl2 N6 O8 Zn | C 1 2/c 1 | 10.191; 17.678; 17.754 90; 99.42; 90 | 3155 | Haller, 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 |
2002992 | CIF HKL Paper | C13 H28 N2 O4 | P 1 21 1 | 11.0112; 23.5186; 12.2636 90; 90.0121; 90 | 3175.88 | Görbitz, Carl Henrik; Torgersen, Eirin Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine Acta Crystallographica, Section B: Structural Science, 1999, 55, 104-113 |
2003058 | CIF HKL Paper | C16 H22 F N2 O | P b c a | 20.0097; 15.249; 10.4168 90; 90; 90 | 3178.5 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds Acta Crystallographica, Section B: Structural Science, 1999, 55, 231-245 |
2003083 | CIF Paper | C20 H9 F3 O6 S | P 1 21/c 1 | 15.771; 15.473; 15.332 90; 115.7; 90 | 3371.3 | Krebs, 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 |
2003061 | CIF HKL Paper | C16 H21 Cl2 N2 O | P b c a | 14.035; 22.964; 10.71 90; 90; 90 | 3451.8 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds Acta Crystallographica, Section B: Structural Science, 1999, 55, 231-245 |
2003059 | CIF HKL Paper | C16 H22 I N2 O | P 1 21/c 1 | 10.98; 38.914; 8.358 90; 103.88; 90 | 3467 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds Acta Crystallographica, Section B: Structural Science, 1999, 55, 231-245 |
2003087 | CIF Paper | C62 H66 Cl14 Mo6 O6 | P 1 21/n 1 | 17.157; 11.13; 18.456 90; 96.4; 90 | 3502.3 | Krebs, 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 |
2105615 | CIF Paper | C22 H25 N O | P b c a | 14.687; 12.931; 18.564 90; 90; 90 | 3525.6 | Kumaran, 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 |
2105589 | CIF Paper | C9 H12 O S | P 1 21/c 1 | 10.826; 17.065; 19.19 90; 91.011; 90 | 3544.7 | Blake, 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 |
2105632 | CIF Paper | C22 H27 N2 O2 | P c a 21 | 30.565; 5.993; 22.032 90; 90; 90 | 4036 | Iwasaki, 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 |
2003084 | CIF Paper | C38 H18 Cl14 Mo6 O6 | C 1 2/c 1 | 18.205; 13.54; 18.679 90; 97.93; 90 | 4560.3 | Krebs, 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 |
2002976 | CIF Paper | C25 H37 N2 O4.5 S | P 21 21 21 | 12.2739; 19.454; 20.6251 90; 90; 90 | 4924.8 | Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S. Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol‒4,4'-trimethylenedipiperidine‒water (2/2/1) Acta Crystallographica, Section B: Structural Science, 1999, 55, 573-590 |
2002979 | CIF HKL Paper | C60 H44 N6 O8 S2 | C 1 2/c 1 | 15.8692; 24.3728; 13.0952 90; 102.362; 90 | 4947.5 | Ferguson, George; Glidewell, Christopher; Lavender, Emma S. Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π‒π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane‒1,10-phenanthroline‒methanol (1/1/1) Acta Crystallographica Section B, 1999, 55, 591-600 |
2105530 | CIF Paper | C58 H64 N2 O12 | P 1 21/a 1 | 13.667; 18.647; 20.188 90; 90.72; 90 | 5144 | Thuéry, 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 O12 | P -1 | 20.285; 11.608; 23.894 92.22; 112.32; 87.81 | 5199 | Thuéry, 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 |
2003075 | CIF Paper | C40 H42 Ce Mn2 N14 O25 | C 1 2/c 1 | 12.94; 18.06; 22.544 90; 96.29; 90 | 5237 | D. Ramalakshmi; M. V. Rajasekharan Crystallographic disorder in mixed-valent dioxo-bridged Mn^III,IV^ complexes. [Mn~2~O~2~(bpy)~4~][Ce(NO~3~)~6~].5H~2~O Acta Crystallographica Section B, 1999, 55, 186-191 |
2105531 | CIF Paper | C58 H64 N2 O12 | P 1 21/a 1 | 20.341; 11.709; 23.875 90; 112.39; 90 | 5258 | Thuéry, 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 |
2002980 | CIF Paper | C33 H30 N2 O4 | P b c a | 22.811; 22.029; 10.7965 90; 90; 90 | 5425.3 | Ferguson, George; Glidewell, Christopher; Lavender, Emma S. Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π‒π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane‒1,10-phenanthroline‒methanol (1/1/1) Acta Crystallographica Section B, 1999, 55, 591-600 |
2003080 | CIF Paper | C19 H9 As F6 O3 | P b c a | 13.55; 15.807; 32.201 90; 90; 90 | 6897 | Krebs, 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 |
2003173 | CIF Paper | Ca7 O36 Ta6 Zr7 | F d d d :2 | 36.394; 7.3674; 31.006 90; 90; 90 | 8313.6 | Schmid, 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 |
2002986 | CIF HKL Paper | C51 H52 Cl N O13 | P 21 21 21 | 23.048; 34.383; 11.992 90; 90; 90 | 9503 | Cram, Donald J.; de Graaff, R. A. G.; Knobler, Carolyn B.; Lingenfelter, David S.; Maverick, Emily F.; Trueblood, Kenneth N. Chiral recognition between host and guest: a binaphthyl-18-crown-6 host with <small>D</small>-phenylglycinium methyl ester perchlorate guest. A difficult structure solved with <i>CRUNCH</i> Acta Crystallographica Section B, 1999, 55, 432-440 |
2105592 | CIF Paper | C27 H36 N2 O5 | P 1 21 1 | 13.706; 22.8; 30.674 90; 97.15; 90 | 9511 | Antolić, 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 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!