Crystallography Open Database
Search results
Result: there are 1740 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 space group like 'P 21 21 2'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2016491 | CIF HKL Paper | C12 H18 N2 O6 | P 21 21 2 | 15.348; 17.8805; 4.7728 90; 90; 90 | 1309.8 | Görbitz, Carl Henrik; Hartviksen, Lars Male The monohydrates of the four polar dipeptides <small>L</small>-seryl-<small>L</small>-asparagine, <small>L</small>-seryl-<small>L</small>-tyrosine, <small>L</small>-tryptophanyl-<small>L</small>-serine and <small>L</small>-tyrosyl-<small>L</small>-tryptophan Acta Crystallographica Section C, 2008, 64, o171-o176 |
| 2016714 | CIF HKL Paper | C4 H12 Na O10 Rb | P 21 21 2 | 11.9764; 14.3836; 6.22447 90; 90; 90 | 1072.25 | Lutz, Martin; Schreurs, Antoine M. M. Was Bijvoet right? Sodium rubidium (+)-tartrate tetrahydrate revisited Acta Crystallographica Section C, 2008, 64, m296-m299 |
| 2017025 | CIF HKL Paper | C13 H13 I N2 O5 | P 21 21 2 | 17.549; 7.0981; 10.9242 90; 90; 90 | 1360.8 | Budow, Simone; Leonard, Peter; Eickmeier, Henning; Reuter, Hans; Seela, Frank The <i>N</i>^1^-(2'-deoxyribofuranoside) of 3-iodo-5-nitroindole: a universal nucleoside forming nitro–iodo interactions Acta Crystallographica Section C, 2009, 65, o100-o102 |
| 2017097 | CIF HKL Paper | C22 H20 N2 Zn | P 21 21 2 | 11.931; 12.157; 6.2921 90; 90; 90 | 912.6 | Lennartson, Anders; Håkansson, Mikael Diphenyldipyridinezinc(II): partial spontaneous resolution of an organometallic reagent Acta Crystallographica Section C, 2009, 65, m205-m207 |
| 2017263 | CIF HKL Paper | C22 H28 Cl2 N4 O4 | P 21 21 2 | 9.7566; 12.7626; 9.3138 90; 90; 90 | 1159.75 | Polaske, Nathan W.; Nichol, Gary S.; Olenyuk, Bogdan Polymorphism and phase transition behavior of 6,6'-bis(chloromethyl)-1,1',4,4'-tetramethyl-3,3'-(<i>p</i>-phenylenedimethylene)bis(piperazine-2,5-dione) Acta Crystallographica Section C, 2009, 65, o381-o384 |
| 2017507 | CIF Paper | C76 H56 Co2 N4 O18 | P 21 21 2 | 10.1264; 28.487; 11.3835 90; 90; 90 | 3283.8 | Zhan, Ge; Li, Xin-Hua Poly[[<i>trans</i>-diaquabis(μ~2~-biphenyl-2,2'-dicarboxylato)bis(μ~2~-4,4'-bipyridine)dicobalt(II)] biphenyl-2,2'-dicarboxylic acid disolvate] Acta Crystallographica Section C, 2010, 66, m29-m31 |
| 2018369 | CIF Paper | C38 H69 N O13 | P 21 21 2 | 14.4531; 34.6885; 8.7114 90; 90; 90 | 4367.52 | Noguchi, Shuji; Miura, Keiko; Fujiki, Sadahiro; Iwao, Yasunori; Itai, Shigeru Clarithromycin form I determined by synchrotron X-ray powder diffraction Acta Crystallographica Section C, 2012, 68, o41-o44 |
| 2018549 | CIF HKL Paper | C32 H30.65 N2 O3.33 | P 21 21 2 | 14.2076; 15.9721; 11.392 90; 90; 90 | 2585.13 | Gherase, Dragos; Naubron, Jean-Valère; Roussel, Christian; Giorgi, Michel XRD and VCD: a marriage of love or convenience? Honeymoon around a cyclic urea derivative Acta Crystallographica Section C, 2012, 68, o247-o252 |
| 2018550 | CIF HKL Paper | C32 H30.8 N2 O3.4 | P 21 21 2 | 14.2212; 15.9917; 11.392 90; 90; 90 | 2590.78 | Gherase, Dragos; Naubron, Jean-Valère; Roussel, Christian; Giorgi, Michel XRD and VCD: a marriage of love or convenience? Honeymoon around a cyclic urea derivative Acta Crystallographica Section C, 2012, 68, o247-o252 |
| 2019458 | CIF HKL Paper | C11 H11 F3 O4 | P 21 21 2 | 11.209; 20.221; 4.9699 90; 90; 90 | 1126.5 | Bats, Jan W.; Živković, Aleksandra; Parsch, Jörg; Engels, Joachim W. Three different fluoro- or chloro-substituted 1'-deoxy-1'-phenyl-β-<small>D</small>-ribofuranoses Acta Crystallographica Section C, 2014, 70, 400-404 |
| 2019595 | CIF HKL Paper | C4 H8 Cl N O4 | P 21 21 2 | 9.7082; 8.9123; 8.482 90; 90; 90 | 733.88 | Benali-Cherif, Rim; Takouachet, Radhwane; Bendeif, El-Eulmi; Benali-Cherif, Nourredine A comparative study of two polymorphs of <small>L</small>-aspartic acid hydrochloride Acta Crystallographica Section C, 2014, 70, 689-692 |
| 2019874 | CIF HKL | C4 H16 Mg2 N18 O7 | P 21 21 2 | 10.193; 23.924; 7.284 90; 90; 90 | 1776.3 | Bensegueni, Mohamed Abdellatif; Cherouana, Aouatef; Dahaoui, Slimane Syntheses and crystal structures of two magnesium‒tetrazole compounds in salt and polymeric forms Acta Crystallographica Section C, 2015, 71 |
| 2020024 | CIF HKL Paper | C13 H13 Cl2 N3 O3 | P 21 21 2 | 19.7273; 7.6749; 9.3882 90; 90; 90 | 1421.42 | Nogueira, Thais C. M.; Pinheiro, Alessandra C.; Wardell, James L.; de Souza, Marcus V. N.; Abberley, Jordan P.; Harrison, William T. A. Weak C—H···O and C—H···π hydrogen bonds and π–π stacking interactions in a series of four <i>N</i>'-[(<i>E</i>)-(aryl)methylidene]-<i>N</i>-methyl-2-oxo-1,3-oxazolidine-4-carbohydrazides Acta Crystallographica Section C, 2015, 71 |
| 2021173 | CIF HKL Paper | C20 H32 O7 | P 21 21 2 | 11.7555; 20.224; 8.0385 90; 90; 90 | 1911.1 | Brito, Maria V.; Marques, Ricardo A.; Mattos, Marcos C.; Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Oliveira, Maria C. F.; Martins, Felipe T. Semisynthesis and absolute configuration of a novel rearranged 19,20-δ-lactone (9βH)-pimarane diterpene Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2022765 | CIF HKL Paper | C19 H15 N5 S | P 21 21 2 | 7.89079; 16.499; 13.1394 90; 90; 90 | 1710.62 | Naghiyev, Farid N.; Khrustalev, Victor N.; Asadov, Khammed A.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G Crystal structure and Hirshfeld surface analysis of 2-amino-6-[(1-phenyl-eth-yl)amino]-4-(thio-phen-2-yl)pyridine-3,5-dicarbo-nitrile. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 526-530 |
| 2023202 | CIF Paper | C20 H26 O2 | P 21 21 2 | 18.396; 20.248; 8.9338 90; 90; 90 | 3327.7 | Tonga Lembe, Jordan; Mphahlele, Precious Mokgadi; Kamdem Kengne, Michael Hermann; Jiyane, Pangaman; Djuidje Fotsing, Marthe Carine; Ardene, Charmaine; Mmutlane, Edwin Mpho; Ndinteh, Derek Tantoh Crystal structure of Staudtienic acid, a diterpenoid from Staudtia kamerunensis Warb. (Myristicaceae) Acta Crystallographica Section E Crystallographic Communications, 2024, 80 |
| 2100541 | CIF Paper | Ca2 Co0.9 O7 Si2 Zn0.1 | P 21 21 2 | 23.518; 23.518; 5.0263 90; 90; 90 | 2780 | Jia, Zihong. H.; Schaper, Andreas K.; Massa, Werner; Rager, Helmut Structure and Phase Transitions in Ca~2~CoSi~2~O~7~ ‒ Ca~2~ZnSi~2~O~7~ Solid Solution Crystals Acta Crystallographica, Section B, 2006, 62, 547-555 |
| 2101050 | CIF Paper | O8 W3 | P 21 21 2 | 10.35; 13.99; 3.774 90; 90; 90 | 546.462 | Sundberg, M.; Zakharov, N. D.; Zibrov, I. P.; Barabanenkov, Yu. A.; Filonenko, V. P.; Werner, P. Two high-pressure tungsten oxide structures of W~3~O~8~ stoichiometry deduced from high-resolution electron microscopy images Acta Crystallographica Section B, 1993, 49, 951-958 |
| 2101074 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.112; 14.31; 6.2043 90; 90; 90 | 1075.3 | Brożek, Z.; Stadnicka, K. Structure of sodium ammonium (+)-tartrate tetrahydrate at 200, 151 and 120 K Acta Crystallographica Section B, 1994, 50, 59-68 |
| 2101075 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.088; 14.28; 6.192 90; 90; 90 | 1069 | Brożek, Z.; Stadnicka, K. Structure of sodium ammonium (+)-tartrate tetrahydrate at 200, 151 and 120 K Acta Crystallographica Section B, 1994, 50, 59-68 |
| 2101076 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.065; 14.346; 6.182 90; 90; 90 | 1070 | Brożek, Z.; Stadnicka, K. Structure of sodium ammonium (+)-tartrate tetrahydrate at 200, 151 and 120 K Acta Crystallographica Section B, 1994, 50, 59-68 |
| 2101161 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.0762; 14.3621; 6.1829 90; 90; 90 | 1072.36 | Brożek, Z.; Mucha, D.; Stadnicka, K. X-ray Rietveld structure determination of ammonium Rochelle salt at 120 (paraelectric phase) and 100 K (ferroelectric phase) Acta Crystallographica Section B, 1994, 50, 465-472 |
| 2101256 | CIF Paper | C29 H48 O4.5 | P 21 21 2 | 27.266; 13.865; 7.237 90; 90; 90 | 2735.9 | Candeloro De Sanctis, S.; Coiro, V. M.; Mazza, F.; Pochetti, G. The inclusion compound of deoxycholic acid with (‒)-camphor: a structural and energetic study Acta Crystallographica Section B, 1995, 51, 81-89 |
| 2101500 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.206; 14.451; 6.25 90; 90; 90 | 1102.4 | Suzuki, E.; Muta, T.; Nozaki, R.; Shiozaki, Y. Modification of crystal structure of ammonium Rochelle salt [NaNH~4~(+)-C~4~H~4~O~6~.4H~2~O] owing to the replacement of NH~4~ ions with K ions Acta Crystallographica Section B, 1996, 52, 296-302 |
| 2101501 | CIF Paper | C4 H15.76 K0.06 N0.94 Na O10 | P 21 21 2 | 12.172; 14.421; 6.239 90; 90; 90 | 1095.2 | Suzuki, E.; Muta, T.; Nozaki, R.; Shiozaki, Y. Modification of crystal structure of ammonium Rochelle salt [NaNH~4~(+)-C~4~H~4~O~6~.4H~2~O] owing to the replacement of NH~4~ ions with K ions Acta Crystallographica Section B, 1996, 52, 296-302 |
| 2101502 | CIF Paper | C4 H15.6 K0.1 N0.9 Na O10 | P 21 21 2 | 12.165; 14.42; 6.239 90; 90; 90 | 1094 | Suzuki, E.; Muta, T.; Nozaki, R.; Shiozaki, Y. Modification of crystal structure of ammonium Rochelle salt [NaNH~4~(+)-C~4~H~4~O~6~.4H~2~O] owing to the replacement of NH~4~ ions with K ions Acta Crystallographica Section B, 1996, 52, 296-302 |
| 2101634 | CIF Paper | C10 H19 N3 O4 | P 21 21 2 | 16.419; 15.309; 4.708 90; 90; 90 | 1183.4 | Görbitz, C. H.; Backe, P. H. Structures of <small>L</small>-valyl-<small>L</small>-glutamine and <small>L</small>-glutamyl-<small>L</small>-valine Acta Crystallographica Section B, 1996, 52, 999-1006 |
| 2101646 | CIF Paper | C4 H13.12 K0.72 N0.28 Na O10 | P 21 21 2 | 11.899; 14.273; 6.211 90; 90; 90 | 1054.8 | Suzuki, E.; Kabasawa, H.; Honma, T.; Nozaki, R.; Shiozaki, Y. Temperature dependence of crystal structure of NaK~0.72~(NH~4~)~0.28~(+)-C~4~H~4~O~6~.4H~2~O in the paraelectric phase Acta Crystallographica Section B, 1996, 52, 976-981 |
| 2101647 | CIF Paper | C4 H13.12 K0.72 N0.28 Na O10 | P 21 21 2 | 11.929; 14.297; 6.221 90; 90; 90 | 1061 | Suzuki, E.; Kabasawa, H.; Honma, T.; Nozaki, R.; Shiozaki, Y. Temperature dependence of crystal structure of NaK~0.72~(NH~4~)~0.28~(+)-C~4~H~4~O~6~.4H~2~O in the paraelectric phase Acta Crystallographica Section B, 1996, 52, 976-981 |
| 2101648 | CIF Paper | C4 H13.12 K0.72 N0.28 Na O10 | P 21 21 2 | 11.955; 14.317; 6.231 90; 90; 90 | 1066.5 | Suzuki, E.; Kabasawa, H.; Honma, T.; Nozaki, R.; Shiozaki, Y. Temperature dependence of crystal structure of NaK~0.72~(NH~4~)~0.28~(+)-C~4~H~4~O~6~.4H~2~O in the paraelectric phase Acta Crystallographica Section B, 1996, 52, 976-981 |
| 2102569 | CIF Paper | C24 H40 N2 O17 | P 21 21 2 | 8.8385; 21.8363; 8.0831 90; 90; 90 | 1560.04 | Baddeley, Thomas C.; Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, James L. Supramolecular structures of substituted α,α'-trehalose derivatives Acta Crystallographica Section B, 2004, 60, 461-471 |
| 2102616 | CIF Paper | C13.8 H27.2 N3.4 O4.7 | P 21 21 2 | 16.2957; 23.426; 9.5842 90; 90; 90 | 3658.7 | Görbitz, Carl Henrik A crystallographic titration of the dipeptide <small>L</small>-isoleucyl-<small>L</small>-isoleucine Acta Crystallographica Section B, 2004, 60, 569-577 |
| 2103260 | CIF Paper | C20 H20 N2 O6 | P 21 21 2 | 10.282; 18.024; 5.136 90; 90; 90 | 951.8 | Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (<i>R</i>,<i>R</i>)-<i>O</i>,<i>O</i>'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (<i>R</i>,<i>R</i>)-<i>O</i>,<i>O</i>'-dibenzoyltartaric acid diamide Acta Crystallographica Section B, 2002, 58, 265-271 |
| 2103262 | CIF Paper | C20 H18 O8 | P 21 21 2 | 9.462; 17.653; 5.662 90; 90; 90 | 945.7 | Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (<i>R</i>,<i>R</i>)-<i>O</i>,<i>O</i>'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (<i>R</i>,<i>R</i>)-<i>O</i>,<i>O</i>'-dibenzoyltartaric acid diamide Acta Crystallographica Section B, 2002, 58, 265-271 |
| 2103263 | CIF Paper | C20 H19 N O7 | P 21 21 2 | 9.898; 17.756; 5.264 90; 90; 90 | 925.1 | Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (<i>R</i>,<i>R</i>)-<i>O</i>,<i>O</i>'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (<i>R</i>,<i>R</i>)-<i>O</i>,<i>O</i>'-dibenzoyltartaric acid diamide Acta Crystallographica Section B, 2002, 58, 265-271 |
| 2103683 | CIF Paper | Ca2 Co O7 Si2 | P 21 21 2 | 23.51; 23.51; 5.025 90; 90; 90 | 2777.4 | Hagiya, Kenji; Kusaka, Katsuhiro; Ohmasa, Masaaki; Iishi, Kazuaki Commensurate structure of Ca~2~CoSi~2~O~7~, a new twinned orthorhombic structure Acta Crystallographica Section B, 2001, 57, 271-277 |
| 2103847 | CIF HKL Paper | C26 H44 N4 O8 | P 21 21 2 | 19.9172; 6.7515; 10.6272 90; 90; 90 | 1429.05 | Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher (1<i>R</i>,3<i>S</i>)-Camphoric acid as a building block in supramolecular chemistry: adducts with organic polyamines Acta Crystallographica Section B, 2003, 59, 118-131 |
| 2103848 | CIF HKL Paper | C14 H26 N2 O4 | P 21 21 2 | 19.1277; 7.5743; 10.692 90; 90; 90 | 1549 | Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher (1<i>R</i>,3<i>S</i>)-Camphoric acid as a building block in supramolecular chemistry: adducts with organic polyamines Acta Crystallographica Section B, 2003, 59, 118-131 |
| 2103849 | CIF HKL Paper | C36 H66 N2 O14 | P 21 21 2 | 13.573; 22.05; 6.8417 90; 90; 90 | 2047.62 | Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher (1<i>R</i>,3<i>S</i>)-Camphoric acid as a building block in supramolecular chemistry: adducts with organic polyamines Acta Crystallographica Section B, 2003, 59, 118-131 |
| 2103853 | CIF Paper | C11 H10 O3 | P 21 21 2 | 25.51; 5.2248; 7.6494 90; 90; 90 | 1019.5 | Sørensen, Henning Osholm; Larsen, Sine Hydrogen bonding in enantiomeric <i>versus</i> racemic mono-carboxylic acids; a case study of 2-phenoxypropionic acid Acta Crystallographica Section B, 2003, 59, 132-140 |
| 2103957 | CIF HKL Paper | C4 H12 Cl N O4 | P 21 21 2 | 11.714; 11.784; 5.8265 90; 90; 90 | 804.3 | Palacios, Elías; Burriel, Ramón; Ferloni, Paolo The phases of [(CH~3~)~4~N](ClO~4~) at low temperature Acta Crystallographica Section B, 2003, 59, 625-633 |
| 2103959 | CIF Paper | C4 H12 Cl N O4 | P 21 21 2 | 11.566; 11.806; 5.7292 90; 90; 90 | 782.3 | Palacios, Elías; Burriel, Ramón; Ferloni, Paolo The phases of [(CH~3~)~4~N](ClO~4~) at low temperature Acta Crystallographica Section B, 2003, 59, 625-633 |
| 2103960 | CIF Paper | C4 H12 Cl N O4 | P 21 21 2 | 11.639; 11.798; 5.779 90; 90; 90 | 793.6 | Palacios, Elías; Burriel, Ramón; Ferloni, Paolo The phases of [(CH~3~)~4~N](ClO~4~) at low temperature Acta Crystallographica Section B, 2003, 59, 625-633 |
| 2104733 | CIF HKL Paper | C24 H86 F7 Ga14 N8 O72 P16 Zn2 | P 21 21 2 | 24.814; 18.458; 10.2575 90; 90; 90 | 4698 | Helliwell, M.; Helliwell, J. R.; Kaucic, V.; Zabukovec Logar, N.; Teat, S. J.; Warren, J. E.; Dodson, E. J. Determination of zinc incorporation in the Zn-substituted gallophosphate ZnULM-5 by multiple wavelength anomalous dispersion techniques Acta Crystallographica Section B, 2010, 66, 345-357 |
| 2105329 | CIF HKL Paper | C3 H8 N2 O | P 21 21 2 | 10.8522; 4.9102; 4.5766 90; 90; 90 | 243.87 | Näther, Christian; Döring, Cindy; Jess, Inke; Jones, Peter G.; Taouss, Christina Thermodynamic and structural relationships between the two polymorphs of 1,3-dimethylurea Acta Crystallographica Section B, 2013, 69, 70-76 |
| 2105742 | CIF | C8 H4 Cl2 N2 O4 Rb | P 21 21 2 | 6.5088; 18.1788; 9.6194 90; 90; 90 | 1138.19 | Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state Acta Crystallographica Section B, 2014, 70, 181-190 |
| 2105743 | CIF | C8 H4 Cl2 N2 O4 Rb | P 21 21 2 | 6.4217; 18.0295; 9.574 90; 90; 90 | 1108.48 | Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state Acta Crystallographica Section B, 2014, 70, 181-190 |
| 2105744 | CIF | C8 H4 Cl2 Cs N2 O4 | P 21 21 2 | 6.6462; 18.2212; 9.7758 90; 90; 90 | 1183.87 | Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state Acta Crystallographica Section B, 2014, 70, 181-190 |
| 2105745 | CIF HKL | C8 H4 Cl2 Cs N2 O4 | P 21 21 2 | 6.5601; 18.152; 9.7345 90; 90; 90 | 1159.17 | Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state Acta Crystallographica Section B, 2014, 70, 181-190 |
| 2105818 | CIF Paper | C28 H32 F2 N6 O6.5 S0.5 | P 21 21 2 | 10.9169; 33.039; 7.9038 90; 90; 90 | 2850.8 | Chan, E. J.; Gao, Q.; Dabros, M. Understanding the structure details when drying hydrate crystals of pharmaceuticals ‒ interpretations from diffuse scattering and inter-modulation satellites of a partially dehydrated crystal Acta Crystallographica Section B, 2014, 70, 555-567 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!