Crystallography Open Database
Search results
Result: there are 942 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 41 21 2'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2233023 | CIF HKL Paper | C9 H10 O4 | P 41 21 2 | 8.1423; 8.1423; 27.6814 90; 90; 90 | 1835.2 | Portalone, Gustavo A new polymorph of 2,6-dimethoxybenzoic acid Acta Crystallographica Section E, 2011, 67, o3394-o3395 |
2233432 | CIF HKL Paper | C12 H24 N10 O10 Zn | P 41 21 2 | 12.1252; 12.1252; 14.6108 90; 90; 90 | 2148.1 | Liu, Xun-Gao; Shen, Liang; Cai, Qi-Suo; Luo, Ma Bis[(1<i>S</i>,1'<i>S</i>)-1,1'-(4-amino-4<i>H</i>-1,2,4-triazole-3,5-diyl)diethanol-κ<i>N</i>^1^]bis(nitrato-κ<i>O</i>)zinc Acta Crystallographica Section E, 2012, 68, m191-m192 |
2233854 | CIF HKL Paper | C19 H34 N2 S | P 41 21 2 | 6.1008; 6.1008; 53.79 90; 90; 90 | 2002.05 | Umar, M. Naveed; Tahir, M. Nawaz; Shoaib, Mohammad; Ali, Akbar; Ziauddin 1,3-Bis(1-cyclohexylethyl)imidazolidine-2-thione Acta Crystallographica Section E, 2012, 68, o743 |
2235612 | CIF HKL Paper | C17 H15 N3 O6 S | P 41 21 2 | 9.6818; 9.6818; 44.017 90; 90; 90 | 4126 | Khan, Islam Ullah; Mubashar-ur-Rehman, Hafiz; Aziz, Salman; Harrison, William T. A. 3-(1<i>H</i>-Indol-3-yl)-2-(2-nitrobenzenesulfonamido)propanoic acid including an unknown solvate Acta Crystallographica Section E, 2012, 68, o2019 |
2235792 | CIF HKL Paper | C16 H24 O3 | P 41 21 2 | 7.3359; 7.3359; 54.7419 90; 90; 90 | 2945.96 | Tebbaa, Mohamed; Benharref, Ahmed; Daran, Jean-Claude; Barkaoui, Latifa; Berraho, Moha Methyl 2-(4a,8-Dimethyl-7-oxodecahydronaphthalen-2-yl)acrylate Acta Crystallographica Section E, 2012, 68, o2391 |
2236581 | CIF HKL Paper | C15 H20 O4 | P 41 21 2 | 6.4737; 6.4737; 62.438 90; 90; 90 | 2616.7 | Liu, Ting-ting; Wu, Hai-Bo; Wang, Wen-Shu 6,8-Dihydroxy-8a-methyl-3,5-dimethylidenedecahydronaphtho[2,3-<i>b</i>]furan-2(3<i>H</i>)-one Acta Crystallographica Section E, 2012, 68, o3251 |
2237105 | CIF HKL Paper | C21 H26 F3 O3 P S | P 41 21 2 | 12.1339; 12.1339; 30.057 90; 90; 90 | 4425.3 | Muller, Alfred; Holzapfel, Cedric W. (Biphenyl-2,2'-diyl)di-<i>tert</i>-butylphosphonium trifluoromethanesulfonate Acta Crystallographica Section E, 2013, 69, o20 |
2237237 | CIF HKL Paper | C19 H15 N3 O2 | P 41 21 2 | 5.0314; 5.0314; 58.701 90; 90; 90 | 1486.01 | Mahboubi Anarjan, Parisa; Noshiranzadeh, Nader; Bikas, Rahman; Woińska, Magdalena; Wozniak, Krzysztof <i>N</i>,<i>N</i>'-(Pyridine-2,6-diyl)dibenzamide Acta Crystallographica Section E, 2013, 69, o102 |
2237314 | CIF HKL Paper | C8 H8 N6 O | P 41 21 2 | 9.548; 9.548; 21.957 90; 90; 90 | 2001.69 | Hernández-Gil, Javier; Ferrer, Sacramento; Ballesteros, Rafael; Castiñeiras, Alfonso <i>N</i>-(5-Amino-1<i>H</i>-1,2,4-triazol-3-yl)pyridine-2-carboxamide Acta Crystallographica Section E, 2013, 69, o227-o228 |
2237446 | CIF HKL Paper | C32 H27 N2 O7.5 | P 41 21 2 | 10.6848; 10.6848; 47.9935 90; 90; 90 | 5479.2 | Chin, Jik; Koh, Dongsoo; Lough, Alan J. 2,2'-[(1<i>S</i>,2<i>S</i>)-1,2-Bis(2-hydroxyphenyl)ethane-1,2-diyl]bis(isoindoline-1,3-dione) ethanol monosolvate hemihydrate Acta Crystallographica Section E, 2013, 69, o406-o407 |
2238246 | CIF HKL Paper | C7 H8 N2 O2 | P 41 21 2 | 8.774; 8.774; 10.0282 90; 90; 90 | 772 | Haines, Alan H.; Hughes, David L. (4<i>S</i>,5<i>S</i>)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarbonitrile Acta Crystallographica Section E, 2013, 69, o1104 |
2238354 | CIF HKL Paper | C28 H40 N2 O2 S2 | P 41 21 2 | 13.8159; 13.8159; 13.5221 90; 90; 90 | 2581.09 | Walker, Ashley; Forsyth, Craig M.; Perlmutter, Patrick 2-(10',10'-Dimethyl-3'-sulfanylidene-4'-azatricyclo[5.2.1.0^1,5^]decan-2'-yl)-10,10-dimethyl-4-azatricyclo[5.2.1.0^1,5^]decane-3-thione Acta Crystallographica Section E, 2013, 69, o1282 |
2239469 | CIF HKL Paper | C24 H24 B F4 N | P 41 21 2 | 9.367; 9.367; 49.137 90; 90; 90 | 4311 | Ben Ali, Karim; Retailleau, Pascal (3<i>R</i>,4<i>S</i>)-3-Methyl-4-phenyl-2-[(<i>R</i>)-1-phenylethyl]-3,4-dihydroisoquinolin-2-ium tetrafluoridoborate Acta Crystallographica Section E, 2014, 70, o255 |
2239510 | CIF HKL Paper | C28 H56 Cl4 Cu4 N4 O4 | P 41 21 2 | 13.9016; 13.9016; 38.834 90; 90; 90 | 7504.8 | Luo, Mei; Huang, Yong-Hua; Zhang, Jing-Cheng Tetrakis[μ~3~-2-(piperidin-1-yl)ethanolato]tetrakis[chloridocopper(II)] Acta Crystallographica Section E, 2014, 70, m194 |
2239780 | CIF HKL Paper | C8 H8 Br4 N2 | P 41 21 2 | 9.6858; 9.6858; 26.5116 90; 90; 90 | 2487.2 | Assoumatine, Tokouré; Stoeckli-Evans, Helen Crystal structure of a tetrakis-substituted pyrazine compound: 2,3,5,6-tetrakis(bromomethyl)pyrazine Acta Crystallographica Section E, 2014, 70, 51-53 |
2240112 | CIF HKL Paper | C11 H19 N7 O7.5 P | P 41 21 2 | 18.5564; 18.5564; 10.1139 90; 90; 90 | 3482.6 | Jasko, Maxim V.; Gurskaya, Galina V.; Kukhanova, Marina K.; Bushmarinov, Ivan S. Crystal structure of ammonium 3'-azido-3'-deoxythymidine-5'-aminocarbonylphosphonate hemihydrate: an anti-HIV agent Acta Crystallographica Section E, 2014, 70, 396-399 |
2240301 | CIF HKL Paper | C36 H36 N4 O4.75 S2 | P 41 21 2 | 13.3438; 13.3438; 40.237 90; 90; 90 | 7164.5 | Yennawar, Hemant P.; Singh, Harnoor; Silverberg, Lee J. Crystal structure of <i>N</i>-[(2<i>S</i>,5<i>R</i>)-4-oxo-2,3-diphenyl-1,3-thiazinan-5-yl]acetamide 0.375-hydrate Acta Crystallographica Section E, 2015, 71, 62-64 |
2241195 | CIF HKL Paper | C24 H30.78 Mn N2 O10.39 | P 41 21 2 | 8.0953; 8.0953; 37.568 90; 90; 90 | 2461.98 | Buvaylo, Elena A.; Vassilyeva, Olga Yu.; Skelton, Brian W. Crystal structure of bis(2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-methoxyphenolato)manganese(IV) 0.39-hydrate Acta Crystallographica Section E, 2015, 71, 1307-1310 |
2242158 | CIF HKL Paper | C23 H28 N2 O8 S | P 41 21 2 | 12.9905; 12.9905; 29.942 90; 90; 90 | 5052.8 | Wu, Yun-Deng; Liu, Xiao-Hong; Xu, Jian; Zhang, Si-Han; Shen, Kun; Sun, Ling; He, Yong-Mei; Ma, Yan; Zhang, Ai-Hua Crystal structure of an apremilast ethanol hemisolvate hemihydrate solvatomorph Acta Crystallographica Section E, 2017, 73, 821-824 |
2244097 | CIF HKL Paper | C26 H32 Br N2 O2.5 | P 41 21 2 | 9.9254; 9.9254; 47.1267 90; 90; 90 | 4642.62 | Janzen, Daron E.; Butler, Maya S.; Reinheimer, Eric W. Crystal structures of anhydrous and hydrated <i>N</i>-benzylcinchonidinium bromide Acta Crystallographica Section E, 2022, 78 |
2300132 | CIF Paper | C40 H48 O8 | P 41 21 2 | 6.8558; 6.8558; 16.9375 90; 90; 90 | 796.096 | Brunelli, Michela; Neumann, Marcus A.; Fitch, Andrew N.; Mora, Asiloé J. Temperature phase changes in solid bicyclo[3.3.1]nonane-2,6-dione and bicyclo[3.3.1]nonane-3,7-dione from powder X-ray diffraction data Journal of Applied Crystallography, 2007, 40, 702-709 |
2300251 | CIF | D2 O | P 41 21 2 | 6.6748; 6.67484; 6.6838 90; 90; 90 | 297.78 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
2310644 | CIF | C3 H12 Cl Cu N6 S3 | P 41 21 2 | 13.41; 13.41; 13.79 90; 90; 90 | 2479.83 | Okaya, Y.; Knobler, C.B. Refinement of the crystal structure of tris(thiourea) copper(I) chloride Acta Crystallographica (1,1948-23,1967), 1964, 17, 928-930 |
2310696 | CIF | P2 Zn | P 41 21 2 | 5.08; 5.08; 18.59 90; 90; 90 | 479.741 | White, J.G. The crystal structure of the tetragonal modification of Zn P2 Acta Crystallographica (1,1948-23,1967), 1965, 18, 217-220 |
2312063 | CIF HKL Paper | C45.25 H55 Ni S4 | P 41 21 2 | 11.7187; 11.7187; 65.014 90; 90; 90 | 8928.2 | Das Gupta, Titir; Applebaum, Jack; Broussard, William; Mack, Carson; Wu, Che; Mague, Joel T.; Donahue, James P. Bis[1,2-bis-(4-<i>tert</i>-butyl-phen-yl)ethyl-ene-1,2-di-thiol-ato(1-)]nickel(II) pentane 0.25-solvate. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 182-186 |
2312483 | CIF Paper | C12 H16 N2 O4 | P 41 21 2 | 11.1312; 11.1312; 10.894 90; 90; 90 | 1349.8 | González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
3000144 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 7.0872; 7.0872; 27.477 90; 90; 90 | 1380.13 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000145 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 7.1071; 7.1071; 27.466 90; 90; 90 | 1387.33 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000146 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 7.1316; 7.1316; 27.467 90; 90; 90 | 1396.96 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000147 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 7.1562; 7.1562; 27.473 90; 90; 90 | 1406.93 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000148 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 7.2063; 7.2063; 27.5057 90; 90; 90 | 1428.39 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000149 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 6.8496; 6.8496; 26.691 90; 90; 90 | 1252.26 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000150 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 6.7514; 6.7514; 26.507 90; 90; 90 | 1208.2 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3000151 | On hold until 2018-03-30 | C20 H14 | P 41 21 2 | 6.6809; 6.6809; 26.433 90; 90; 90 | 1179.82 | Roszak Kinga; Katrusiak, Andrzej ? To be published in PCCP |
3500095 | CIF HKL | C24 H32 O6 | P 41 21 2 | 9.1629; 9.1629; 50.2545 90; 90; 90 | 4219.3 | Thierry Maris Desonide Personal communication to COD, 2020 |
4000050 | CIF | C36 H84 Ga4 O12 | P 41 21 2 | 12.5566; 12.5566; 32.0324 90; 90; 90 | 5050.5 | Valet, Murielle; Hoffman, David M. Synthesis of Homoleptic Gallium Alkoxide Complexes and the Chemical Vapor Deposition of Gallium Oxide Films Chemistry of Materials, 2001, 13, 2135-2143 |
4000912 | CIF | C80 H88 Li N8 O8 | P 41 21 2 | 15.436; 15.436; 28.831 90; 90; 90 | 6869.6 | Pandian, Ramasamy P.; Raju, Nandyala P.; Gallucci, Judith C.; Woodward, Patrick M.; Epstein, Arthur J.; Kuppusamy, Periannan A New Tetragonal Crystalline Polymorph of Lithium Octa-n-Butoxy-Naphthalocyanine (LiNc-BuO) Radical: Structural, Magnetic and Oxygen-Sensing Properties Chemistry of Materials, 2010, 22, 6254 |
4001225 | CIF | C12 H16 Se2 Ti | P 41 21 2 | 9.3965; 9.3965; 14.412 90; 90; 90 | 1272.5 | Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te) Chemistry of Materials, 2008, 20, 5100 |
4001226 | CIF | C12 H16 Hf Se2 | P 41 21 2 | 9.5191; 9.5191; 14.604 90; 90; 90 | 1323.3 | Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te) Chemistry of Materials, 2008, 20, 5100 |
4001229 | CIF | C18 H28 Se2 Zr | P 41 21 2 | 10.026; 10.026; 19.288 90; 90; 90 | 1938.8 | Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te) Chemistry of Materials, 2008, 20, 5100 |
4002034 | CIF | H22 N4 O3 S6 Sn2 | P 41 21 2 | 8.56294; 8.56294; 22.7703 90; 90; 90 | 1669.61 | Nørby, Peter; Overgaard, Jacob; Christensen, Per S.; Richter, Bo; Song, Xin; Dong, Mingdong; Han, Anpan; Skibsted, Jørgen; Iversen, Bo B.; Johnsen, Simon (NH4)4Sn2S6·3H2O: Crystal Structure, Thermal Decomposition, and Precursor for Textured Thin Film Chemistry of Materials, 2014, 26, 4494 |
4002658 | CIF | Al Li O2 | P 41 21 2 | 5.1965; 5.1965; 6.3464 90; 90; 90 | 171.376 | Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers Chemistry of Materials, 2016, 28, 915 |
4002659 | CIF | Al Li O2 | P 41 21 2 | 5.15885; 5.15885; 6.27 90; 90; 90 | 166.868 | Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers Chemistry of Materials, 2016, 28, 915 |
4002660 | CIF | Al Li O2 | P 41 21 2 | 5.2252; 5.2252; 6.4038 90; 90; 90 | 174.841 | Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers Chemistry of Materials, 2016, 28, 915 |
4003642 | CIF | C H6 Au Br3 N | P 41 21 2 | 7.9115; 7.9115; 23.385 90; 90; 90 | 1463.7 | Ghosh, Biplab; Febriansyah, Benny; Harikesh, Padinhare Cholakkal; Koh, Teck Ming; Hadke, Shreyash; Wong, Lydia H.; England, Jason; Mhaisalkar, Subodh G.; Mathews, Nripan Direct Band Gap Mixed-Valence Organic‒inorganic Gold Perovskite as Visible Light Absorbers Chemistry of Materials, 2020 |
4020037 | CIF | C40 H56 Fe2 I2 N2 O2 Pd2 Si2 | P 41 21 2 | 12.5501; 12.5501; 29.4265 90; 90; 90 | 4634.8 | Carolyn E. Anderson; Yariv Donde; Christopher J. Douglas; Larry E. Overman Journal of Organic Chemistry, 2005, 70, 648-657 |
4021205 | CIF | C15 H19 N O | P 41 21 2 | 6.5986; 6.5986; 53.743 90; 90; 90 | 2340 | Daniele Casarini; Carmine Coluccini; Lodovico Lunazzi; Andrea Mazzanti; Romina Rompietti Conformational Studies by Dynamic NMR. 100. Enantiomerization Process of Stereolabile Atropisomers in Pyridine-Substituted Adamantane Derivatives Journal of Organic Chemistry, 2004, 69, 5746-5748 |
4021283 | CIF | C47 H55 Cl2 N2 O5 P2 Rh | P 41 21 2 | 10.495; 10.495; 42.528 90; 90; 90 | 4684.1 | Yu Fu; Xun-Xiang Guo; Shou-Fei Zhu; Ai-Guo Hu; Jian-Hua Xie; Qi-Lin Zhou Rhodium-Catalyzed Asymmetric Hydrogenation of Functionalized Olefins Using Monodentate Spiro Phosphoramidite Ligands Journal of Organic Chemistry, 2004, 69, 4648-4655 |
4021396 | CIF | C16 H24 N O3 P S | P 41 21 2 | 13.787; 13.787; 41.256 90; 90; 90 | 7842 | Yuka Kobayashi; Fumi Morisawa; Kazuhiko Saigo Enantiopure O-Substituted Phenylphosphonothioic Acids: Chiral Recognition Ability during Salt Crystallization and Chiral Recognition Mechanism Journal of Organic Chemistry, 2006, 71, 606-615 |
4022020 | CIF | C25 H16 O | P 41 21 2 | 8.6562; 8.6562; 22.961 90; 90; 90 | 1720.5 | Bin Wang; Minxiong Li; Shansheng Xu; Haibin Song; Baiquan Wang A General Synthetic Route to 6,6-Substituted-6H-dibenzo[b,d]pyrans from Dibenzofuran Journal of Organic Chemistry, 2006, 71, 8291-8293 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!