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 |
|---|---|---|---|---|---|---|
| 2101442 | CIF Paper | C26 H19 N2 O4 | P 1 21/c 1 | 15.328; 14.483; 20.421 90; 105.65; 90 | 4365.3 | Jones, R.; Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J. Structures and photochemistry of 1,5-disubstituted dibenzobarrelenes Acta Crystallographica Section B, 1996, 52, 151-158 |
| 2101443 | CIF Paper | C24.8 H17.5 N2 O4 | P 1 21/n 1 | 15.174; 14.408; 20.531 90; 109.21; 90 | 4238.7 | Jones, R.; Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J. Structures and photochemistry of 1,5-disubstituted dibenzobarrelenes Acta Crystallographica Section B, 1996, 52, 151-158 |
| 2101444 | CIF Paper | C22 H20 O6 | P -1 | 14.9; 15.128; 8.809 105.03; 90.22; 82.79 | 1901.7 | Jones, R.; Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J. Structures and photochemistry of 1,5-disubstituted dibenzobarrelenes Acta Crystallographica Section B, 1996, 52, 151-158 |
| 2101445 | CIF Paper | C20 H14 Cl2 O4 | P n a 21 | 14.867; 8.109; 14.944 90; 90; 90 | 1801.6 | Jones, R.; Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J. Structures and photochemistry of 1,5-disubstituted dibenzobarrelenes Acta Crystallographica Section B, 1996, 52, 151-158 |
| 2101446 | CIF Paper | C1.92 H1.32 Al0.04 Cl0.64 O24 Si11.96 | P n m a | 20.009; 19.909; 13.366 90; 90; 90 | 5324.5 | van Koningsveld, H.; Jansen, J. C.; Man, A. J. M. de Single-crystal structure analysis and energy minimizations of a MFI-type zeolite at low <i>p</i>-dichlorobenzene sorbate loading Acta Crystallographica Section B, 1996, 52, 131-139 |
| 2101447 | CIF Paper | C12 H8 Al0.08 Cl4 O48 Si23.92 | P 21 21 21 | 20.102; 19.797; 13.436 90; 90; 90 | 5347 | van Koningsveld, H.; Jansen, J. C.; van Bekkum, H. The location of <i>p</i>-dichlorobenzene in a single crystal of zeolite H-ZSM-5 at high sorbate loading Acta Crystallographica Section B, 1996, 52, 140-144 |
| 2101448 | CIF Paper | C16 H16 Cl N O3 | P 1 21/a 1 | 13.922; 6.951; 30.173 90; 93.04; 90 | 2915.8 | Böcskei, Zs.; Simon, K.; Németh, V.; Ágai, B.; Toke, L. Interesting conformational and substitutional disorder in the crystal structures of three homologous crowns Acta Crystallographica Section B, 1996, 52, 194-200 |
| 2101449 | CIF Paper | C18 H20 Cl N O4 | P 1 21 1 | 11.146; 12.343; 13.737 90; 107.92; 90 | 1798.2 | Böcskei, Zs.; Simon, K.; Németh, V.; Ágai, B.; Toke, L. Interesting conformational and substitutional disorder in the crystal structures of three homologous crowns Acta Crystallographica Section B, 1996, 52, 194-200 |
| 2101450 | CIF Paper | C20 H26 Cl N O6 | P 1 c 1 | 12.477; 12.646; 13.4267 90; 102.747; 90 | 2066.3 | Böcskei, Zs.; Simon, K.; Németh, V.; Ágai, B.; Toke, L. Interesting conformational and substitutional disorder in the crystal structures of three homologous crowns Acta Crystallographica Section B, 1996, 52, 194-200 |
| 2101451 | CIF Paper | Al3 F19 Pb5 | I 4 c m | 14.07; 14.07; 7.3 90; 90; 90 | 1445 | Sarraute, S.; Ravez, J.; Von der Mühll, R.; Bravic, G.; Feigelson, R. S.; Abrahams, S. C. Structure of ferroelectric Pb~5~Al~3~F~19~ at 160 K, polarization reversal and relationship to ferroelectric Pb~5~Cr~3~F~19~ at 295 K Acta Crystallographica Section B, 1996, 52, 72-77 |
| 2101452 | CIF Paper | C42 H92.5 Ca2 Cl4 O46.25 | P 21 21 21 | 15.875; 17.583; 24.27 90; 90; 90 | 6774.5 | Nicolis, I.; Coleman, A. W.; Charpin, P.; Rango, C. de First sphere coordination of divalent metal cations by cyclodextrin: structure of the β-cyclodextrin‒calcium chloride‒water (1/2/11.25) compound Acta Crystallographica Section B, 1996, 52, 122-130 |
| 2101453 | CIF Paper | C6 H5 N O3 | P 21 21 21 | 11.136; 6.649; 8.091 90; 90; 90 | 599.08 | Hamzaoui, F.; Baert, F.; Wojcik, G. Electron-density study of <i>m</i>-nitrophenol in the orthorhombic structure Acta Crystallographica Section B, 1996, 52, 159-164 |
| 2101454 | CIF Paper | Cu Nd2 O4 | I 4/m m m | 3.9488; 3.9488; 12.1869 90; 90; 90 | 190.03 | Makarova, I. P.; Simonov, V. I.; Blomberg, M. K.; Merisalo, M. J. X-ray diffraction study of Nd~2~CuO~4~ single crystals at 20 K Acta Crystallographica Section B, 1996, 52, 93-99 |
| 2101455 | CIF Paper | Cu Nd2 O4 | I 4/m m m | 3.9379; 3.9379; 12.14 90; 90; 90 | 188.256 | Makarova, I. P.; Simonov, V. I.; Blomberg, M. K.; Merisalo, M. J. X-ray diffraction study of Nd~2~CuO~4~ single crystals at 20 K Acta Crystallographica Section B, 1996, 52, 93-99 |
| 2101456 | CIF Paper | Pu0.6 U0.4 | R -3 m | 10.68535; 10.68535; 10.68535 89.7364; 89.7364; 89.7364 | 1219.98 | Lawson, A. C.; Goldstone, J. A.; Cort, B.; Martinez, R. J.; Vigil, F. A.; Zocco, T. G.; Richardson, Jnr, J. W.; Mueller, M. H. Structure of ζ-phase plutonium‒uranium Acta Crystallographica Section B, 1996, 52, 32-37 |
| 2101457 | CIF Paper | Pu0.6 U0.4 | R -3 m | 15.0765; 15.0765; 18.5925 90; 90; 120 | 3659.9 | Lawson, A. C.; Goldstone, J. A.; Cort, B.; Martinez, R. J.; Vigil, F. A.; Zocco, T. G.; Richardson, Jnr, J. W.; Mueller, M. H. Structure of ζ-phase plutonium‒uranium Acta Crystallographica Section B, 1996, 52, 32-37 |
| 2101458 | CIF Paper | C18 H20 N2 O4 S4 | P -1 | 7.664; 9.874; 14.851 101.71; 90.45; 102.27 | 1073.8 | Nüesch, F.; Grätzel, M.; Nesper, R.; Shklover, V. Crystal and molecular structures of 3-acetyl-5-[2-(3-ethyl-2-benzothiazolidene)]ethylidenerhodanine and its lithium and sodium salts. Layered organic–inorganic structures Acta Crystallographica Section B, 1996, 52, 277-286 |
| 2101459 | CIF Paper | C20.5 H27.5 Li N3.5 O6.5 S3 | P -1 | 7.249; 10.773; 16.433 87.66; 85.22; 77.04 | 1245.9 | Nüesch, F.; Grätzel, M.; Nesper, R.; Shklover, V. Crystal and molecular structures of 3-acetyl-5-[2-(3-ethyl-2-benzothiazolidene)]ethylidenerhodanine and its lithium and sodium salts. Layered organic–inorganic structures Acta Crystallographica Section B, 1996, 52, 277-286 |
| 2101460 | CIF Paper | C16 H29 N2 Na O11 S3 | C 1 2/c 1 | 46.209; 7.005; 16.583 90; 109.45; 90 | 5061 | Nüesch, F.; Grätzel, M.; Nesper, R.; Shklover, V. Crystal and molecular structures of 3-acetyl-5-[2-(3-ethyl-2-benzothiazolidene)]ethylidenerhodanine and its lithium and sodium salts. Layered organic‒inorganic structures Acta Crystallographica Section B, 1996, 52, 277-286 |
| 2101461 | CIF Paper | C29 H33 Co N5 O4 P | P 1 21/c 1 | 15.15; 14.846; 12.785 90; 93.26; 90 | 2870.9 | Sawada, K.; Hashizume, D.; Sekine, A.; Uekusa, H.; Kato, K.; Ohashi, Y.; Kakinuma, K.; Ohgo, Y. Four polymorphs of a cobaloxime complex with different solid-state photoisomerization rates Acta Crystallographica Section B, 1996, 52, 303-313 |
| 2101462 | CIF Paper | C29 H33 Co N5 O4 P | P b c a | 59.684; 14.909; 12.956 90; 90; 90 | 11529 | Sawada, K.; Hashizume, D.; Sekine, A.; Uekusa, H.; Kato, K.; Ohashi, Y.; Kakinuma, K.; Ohgo, Y. Four polymorphs of a cobaloxime complex with different solid-state photoisomerization rates Acta Crystallographica Section B, 1996, 52, 303-313 |
| 2101463 | CIF Paper | C29 H33 Co N5 O4 P | P 1 21/c 1 | 15.103; 13.483; 14.908 90; 107.12; 90 | 2901 | Sawada, K.; Hashizume, D.; Sekine, A.; Uekusa, H.; Kato, K.; Ohashi, Y.; Kakinuma, K.; Ohgo, Y. Four polymorphs of a cobaloxime complex with different solid-state photoisomerization rates Acta Crystallographica Section B, 1996, 52, 303-313 |
| 2101464 | CIF Paper | C29 H33 Co N5 O4 P | P 21 21 21 | 14.926; 18.433; 10.642 90; 90; 90 | 2927.9 | Sawada, K.; Hashizume, D.; Sekine, A.; Uekusa, H.; Kato, K.; Ohashi, Y.; Kakinuma, K.; Ohgo, Y. Four polymorphs of a cobaloxime complex with different solid-state photoisomerization rates Acta Crystallographica Section B, 1996, 52, 303-313 |
| 2101465 | CIF Paper | C4 H9 N O4 | P -1 | 7.483; 8.881; 4.731 91.29; 93.23; 100.24 | 308.7 | Hirano, A.; Kubozono, Y.; Maeda, H.; Ishida, H.; Kashino, S. Structure of ammonium hydrogen succinate above and below the phase transition around 170K Acta Crystallographica Section B, 1996, 52, 323-327 |
| 2101466 | CIF Paper | C4 H9 N O4 | P -1 | 7.437; 8.834; 4.6927 91.32; 93.37; 100.68 | 302.26 | Hirano, A.; Kubozono, Y.; Maeda, H.; Ishida, H.; Kashino, S. Structure of ammonium hydrogen succinate above and below the phase transition around 170K Acta Crystallographica Section B, 1996, 52, 323-327 |
| 2101467 | CIF Paper | C4 H9 N O4 | P -1 | 7.4384; 8.8222; 4.6875 91.48; 93.178; 100.85 | 301.44 | Hirano, A.; Kubozono, Y.; Maeda, H.; Ishida, H.; Kashino, S. Structure of ammonium hydrogen succinate above and below the phase transition around 170K Acta Crystallographica Section B, 1996, 52, 323-327 |
| 2101468 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.7208; 8.211; 8.831 90; 90.94; 90 | 414.77 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2101469 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.772; 8.111; 8.981 90; 89.95; 90 | 420.4 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2101470 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.772; 8.111; 8.981 90; 89.95; 90 | 420.4 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2101471 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.885; 8.013; 9.251 90; 88.8; 90 | 436.1 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2101472 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.885; 8.013; 9.251 90; 88.8; 90 | 436.1 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2101473 | CIF Paper | C10 H10 V | P 1 21/n 1 | 5.934; 8.013; 9.344 90; 91.52; 90 | 444.1 | Antipin, M. Yu.; Boese, R. Structure of vanadocene in the temperature interval 108–357 K and the nature of the ring disorder Acta Crystallographica Section B, 1996, 52, 314-322 |
| 2101474 | CIF Paper | C8 H17 N O2 | P -1 | 5.753; 7.498; 10.649 105.71; 93.64; 97.63 | 435.9 | Luo, J.; Ruble, J. R.; Craven, B. M.; McMullan, R. K. Effects of H/D substitution on thermal vibrations in piperazinium hexanoate-h~11~,d~11~ Acta Crystallographica Section B, 1996, 52, 357-368 |
| 2101475 | CIF Paper | C8 H6 D11 N O2 | P -1 | 5.75; 7.486; 10.622 105.81; 93.66; 97.66 | 433.6 | Luo, J.; Ruble, J. R.; Craven, B. M.; McMullan, R. K. Effects of H/D substitution on thermal vibrations in piperazinium hexanoate-h~11~,d~11~ Acta Crystallographica Section B, 1996, 52, 357-368 |
| 2101476 | CIF Paper | B4 O7 Pb | P 21 n m | 4.251; 4.463; 10.86 90; 90; 90 | 206.04 | Corker, D. L.; Glazer, A. M. Structure and optical non-linearity of PbO.2B~2~O~3~ Acta Crystallographica Section B, 1996, 52, 260-265 |
| 2101477 | CIF Paper | Al Fe O3 | P n a 21 | 4.9839; 8.5544; 9.2413 90; 90; 90 | 393.996 | Bouree, F.; Baudour, J. L.; Elbadraoui, E.; Musso, J.; Laurent, C.; Rousset, A. Crystal and magnetic structure of piezoelectric, ferrimagnetic and magnetoelectric aluminium iron oxide FeAlO~3~ from neutron powder diffraction Acta Crystallographica Section B, 1996, 52, 217-222 |
| 2101478 | CIF Paper | Al Fe O3 | P n a 21 | 4.9792; 8.5466; 9.2345 90; 90; 90 | 392.976 | Bouree, F.; Baudour, J. L.; Elbadraoui, E.; Musso, J.; Laurent, C.; Rousset, A. Crystal and magnetic structure of piezoelectric, ferrimagnetic and magnetoelectric aluminium iron oxide FeAlO~3~ from neutron powder diffraction Acta Crystallographica Section B, 1996, 52, 217-222 |
| 2101479 | CIF Paper | C7 H3 Cl N2 O2 | P b c a | 9.469; 14.752; 10.859 90; 90; 90 | 1516.9 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101480 | CIF Paper | C8 H6 N2 O2 | P b c a | 9.969; 14.728; 10.179 90; 90; 90 | 1494.5 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101481 | CIF Paper | C7 H3 Cl N2 O2 | P 1 21/n 1 | 7.889; 15.064; 7.311 90; 118.22; 90 | 765.6 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101482 | CIF Paper | C7 H3 N3 O4 | P b c n | 13.081; 9.027; 6.545 90; 90; 90 | 772.8 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101483 | CIF Paper | C18 H8 N4 Se4 | P 1 21/c 1 | 12.5048; 3.8724; 18.5041 90; 104.131; 90 | 868.92 | Corfield, P. W. R.; La Placa, S. J. Structure of the charge-transfer salt 2,2',5,5'-tetraselenafulvalene–7,7,8,8-tetracyano-<i>p</i>-quinodimethane (TSeF–TCNQ) Acta Crystallographica Section B, 1996, 52, 384-387 |
| 2101484 | CIF Paper | Ca3 Fe2 O12 Si3 | I a -3 d | 12.0643; 12.0643; 12.0643 90; 90; 90 | 1756 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Atomic displacement parameters for garnets: a lattice-dynamical evaluation Acta Crystallographica Section B, 1996, 52, 239-250 |
| 2101485 | CIF Paper | C52 H49 F6 P5 Pt2 S | P 1 2/n 1 | 13.742; 11.058; 16.7504 90; 96.644; 90 | 2528.3 | Clegg, William; Capdevila, Mercè; González-Duarte, Pilar; Sola, Joan Structural investigation of homonuclear Pt~2~ and heteronuclear PdPt complexes containing a metal‒metal bond bridged by hydrido and sulfido ligands Acta Crystallographica Section B, 1996, 52, 270-276 |
| 2101486 | CIF Paper | C52 H49 F6 P5 Pd Pt S | P 1 2/n 1 | 13.724; 11.097; 16.74 90; 96.77; 90 | 2531.6 | Clegg, William; Capdevila, Mercè; González-Duarte, Pilar; Sola, Joan Structural investigation of homonuclear Pt~2~ and heteronuclear PdPt complexes containing a metal‒metal bond bridged by hydrido and sulfido ligands Acta Crystallographica Section B, 1996, 52, 270-276 |
| 2101487 | CIF Paper | C52 H49 F6 P5 Pt2 S | P 1 21/n 1 | 13.689; 21.857; 16.662 90; 95.92; 90 | 4959 | Clegg, William; Capdevila, Mercè; González-Duarte, Pilar; Sola, Joan Structural investigation of homonuclear Pt~2~ and heteronuclear PdPt complexes containing a metal‒metal bond bridged by hydrido and sulfido ligands Acta Crystallographica Section B, 1996, 52, 270-276 |
| 2101488 | CIF Paper | C6 H8 N6 O8 | P 1 21/c 1 | 11.559; 8.018; 11.697 90; 98.01; 90 | 1073.5 | Ammon, H. L.; Du, Z.; Gilardi, R. D.; Dave, P. R.; Forohar, F.; Axenrod, T. Structure of 1,3,5,7-tetranitro-3,7-diazabicyclo-[3.3.0]octane. Structure solution from molecular packing analysis Acta Crystallographica Section B, 1996, 52, 352-356 |
| 2101489 | CIF Paper | C6 H24 Cl9 N3 Sb2 | P 1 c 1 | 9.47; 9.034; 14.08 90; 95.81; 90 | 1198.4 | Zaleski, J.; Pietraszko, A. Structure at 200 and 298 K and X-ray investigations of the phase transition at 242 K of [NH~2~(CH~3~)~2~]~3~Sb~2~Cl~9~ (DMACA) Acta Crystallographica Section B, 1996, 52, 287-295 |
| 2101490 | CIF Paper | C6 H24 Cl9 N3 Sb2 | P 1 21/c 1 | 9.686; 9.037; 14.066 90; 95.57; 90 | 1225.4 | Zaleski, J.; Pietraszko, A. Structure at 200 and 298 K and X-ray investigations of the phase transition at 242 K of [NH~2~(CH~3~)~2~]~3~Sb~2~Cl~9~ (DMACA) Acta Crystallographica Section B, 1996, 52, 287-295 |
| 2101491 | CIF Paper | C16 H22 N4 O6 | P -1 | 8.534; 9.352; 12.371 92.59; 96.16; 116.05 | 877.2 | Suresh, C. G.; Gangamani, B. P.; Ganesh, K. N. The rare <i>trans</i>-<i>syn</i> thymine photodimers: structures of polyoxyethylene-linked bisthymines and the derived <i>trans</i>-<i>syn</i> thymine photodimers. Comparison of the stereochemistry before and after photodimerization Acta Crystallographica Section B, 1996, 52, 376-383 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!