Crystallography Open Database
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|---|---|---|---|---|---|---|
| 2233123 | CIF HKL Paper | C10 H16 Cu K3 N2 O12 P | P 21 21 2 | 11.88; 8.332; 9.681 90; 90; 90 | 958.3 | Liu, Liyan; Zhang, Rui; Fan, Ping; Yu, Zhan; Zhang, Xiangdong Tripotassium (bis{[bis(carboxylatomethyl)amino]methyl}phosphinato)cuprate(II) dihydrate Acta Crystallographica Section E, 2012, 68, m73 |
| 2233209 | CIF HKL Paper | C34 H51 N9 O8 S2 | P 21 21 2 | 18.2019; 10.4667; 11.0695 90; 90; 90 | 2108.89 | Asano, Akiko; Doi, Mitsunobu The desoxazoline asidiacyclamide analogue <i>cyclo</i>(Gly‒Thr‒D-Val‒Thz‒Ile‒Thr‒D-Val‒Thz) acetonitrile monosolvate Acta Crystallographica Section E, 2012, 68, o54-o55 |
| 2233494 | CIF HKL Paper | C18.5 H25 Cl3 N2 Pd2 Se2 | P 21 21 2 | 14.2119; 14.7895; 12.0968 90; 90; 90 | 2542.59 | Chakravorty, Tapash; Singh, Harkesh B.; Butcher, Ray J. Bis{μ-2-[(dimethylamino)methyl]benzeneselenolato}bis[chloridopalladium(II)] dichloromethane hemisolvate Acta Crystallographica Section E, 2012, 68, m113-m114 |
| 2233540 | CIF Paper | C18.5 H25 Cl3 N2 Pd2 Te2 | P 21 21 2 | 14.035; 14.842; 12.3188 90; 90; 90 | 2566.1 | Butcher, Ray J.; Chakravorty, Tapash; Singh, Harkesh B. Bis{μ-2-[(dimethylamino)methyl]benzenetellurolato}bis[chloridopalladium(II)] dichloromethane hemisolvate Acta Crystallographica Section E, 2012, 68, m141-m142 |
| 2233811 | CIF HKL Paper | C56 H68 O15 P2 Si | P 21 21 2 | 10.4052; 53.019; 10.0786 90; 90; 90 | 5560.1 | Anderson, Regan J.; Gainsford, Graeme J. 1<small>D</small>-1-<i>O</i>-<i>tert</i>-Butyldiphenylsilyl-2,3,6-<i>O</i>-tris(methoxymethylene)-<i>myo</i>-inositol 4,5-bis(dibenzylphosphate) Acta Crystallographica Section E, 2012, 68, o900 |
| 2233908 | CIF HKL Paper | C13 H9 Cl2 N O | P 21 21 2 | 9.7438; 9.9953; 12.1342 90; 90; 90 | 1181.78 | Şahin, Zarife Sibel; Işık, Şamil 2-Chloro-4-{(<i>E</i>)-[(4-chlorophenyl)imino]methyl}phenol Acta Crystallographica Section E, 2012, 68, o678 |
| 2234081 | CIF HKL Paper | C7 H6.5 O5.25 | P 21 21 2 | 11.8364; 32.598; 3.7306 90; 90; 90 | 1439.4 | Li, Jin-Hang; Dong, Fu-Yue; Cai, Fang; Yuan, Xiao-Feng; Jiang, Ren-Wang 2,3,4-Trihydroxybenzoic acid 0.25-hydrate Acta Crystallographica Section E, 2012, 68, o825-o826 |
| 2234271 | CIF HKL Paper | C42 H52 Fe2 O5 P2 S4 Ti | P 21 21 2 | 15.9784; 30.6984; 8.7072 90; 90; 90 | 4270.98 | Karakus, Mehmet; Woollins, J. Derek; Lönnecke, Peter; Hey-Hawkins, Evamarie [Disulfanediylbis(ferrocenylthiophosphinato)-κ^2^<i>O</i>,<i>O</i>]titanocene tetrahydrofuran trisolvate Acta Crystallographica Section E, 2012, 68, m428 |
| 2234445 | CIF HKL Paper | Ca5 F22 Zr3 | P 21 21 2 | 9.9844; 7.4059; 9.9046 90; 90; 90 | 732.38 | Oudahmane, Abdelghani; El-Ghozzi, Malika; Avignant, Daniel Ca~5~Zr~3~F~22~ Acta Crystallographica Section E, 2012, 68, i23 |
| 2234835 | CIF HKL Paper | C33 H36 Cl2 N6 Ti | P 21 21 2 | 11.1952; 13.8545; 10.4651 90; 90; 90 | 1623.18 | Chen, Zhou; Wu, Jian; Li, Yahong; Hu, Bin Bis{2-[(4-chlorophenyl)iminomethyl]pyrrol-1-ido-κ^2^<i>N</i>,<i>N</i>'}bis(dimethylamido-κ<i>N</i>)titanium(IV) toluene monosolvate Acta Crystallographica Section E, 2012, 68, m596-m597 |
| 2234946 | CIF HKL Paper | C11 H10 Cl2 N2 O9 | P 21 21 2 | 8.5315; 15.1772; 5.6107 90; 90; 90 | 726.5 | Zhang, Ya; Li, Ai-min; Wang, Zhi-wei; Wan, Chong-Qing 3,3'-Carbonyldipyridinium bis(perchlorate) Acta Crystallographica Section E, 2012, 68, o1896 |
| 2238186 | CIF HKL Paper | C17 H25 N3 O2 S | P 21 21 2 | 13.987; 15.7103; 8.5532 90; 90; 90 | 1879.48 | Selvakumaran, N.; Karvembu, R.; Ng, Seik Weng; Tiekink, Edward R. T. 3-({[Bis(2-methylpropyl)carbamothioyl]amino}carbonyl)benzamide Acta Crystallographica Section E, 2013, 69, o1183 |
| 2238249 | CIF HKL Paper | C23 H30 N2 O2 | P 21 21 2 | 18.5417; 6.0597; 8.9415 90; 90; 90 | 1004.64 | Rivera, Augusto; Osorio, Héctor Jairo; Maldonado, Mauricio; Ríos-Motta, Jaime; Bolte, Michael 4,4'-Dimethyl-2,2'-{[2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-benzimidazole-1,3-diyl]bis(methylene)}diphenol Acta Crystallographica Section E, 2013, 69, o1059 |
| 2238329 | CIF HKL Paper | C17 H22.5 O5.25 | P 21 21 2 | 10.5508; 28.371; 10.5228 90; 90; 90 | 3149.9 | Knight, Kyle S.; Smith, Cole T.; Waddell, Thomas G.; Noll, Bruce Tenulin 0.25-hydrate, a sesquiterpene lactone isolated from <i>Helenium amarum</i> Acta Crystallographica Section E, 2013, 69, o1237-o1238 |
| 2238486 | CIF HKL Paper | C18 H28 O8 | P 21 21 2 | 21.5802; 15.3758; 5.73626 90; 90; 90 | 1903.36 | Zhang, Qiurong; Zhou, Guangqiang; He, Peng; Chen, Xuebin; Liu, Hongmin 1,2:1',2'-Di-<i>O</i>-isopropylidenedifuranose-C12 higher carbon sugar Acta Crystallographica Section E, 2013, 69, o1399 |
| 2238665 | CIF Paper | C30 H35 N O8 | P 21 21 2 | 17.3582; 18.5489; 8.9213 90; 90; 90 | 2872.4 | Jagadeesan, G.; Sethusankar, K.; Prasanna, R.; Raghunathan, R. Ethyl 1'-methyl-2-oxo-4'-[(3a<i>R</i>,5<i>R</i>,5a<i>S</i>,8a<i>S</i>,8b<i>R</i>)-2,2,7,7-tetramethyltetrahydro-3a<i>H</i>-bis[1,3]dioxolo[4,5-<i>b</i>:4',5'-<i>d</i>]pyran-5-yl]-2<i>H</i>-spiro[acenaphthylene-1,2'-pyrrolidine]-3'-carboxylate Acta Crystallographica Section E, 2013, 69, o1517-o1518 |
| 2239028 | CIF HKL Paper | C19 H14 N2 O | P 21 21 2 | 15.0686; 24.327; 3.8986 90; 90; 90 | 1429.1 | Mague, Joel T.; Abdel-Aziz, Alaa A.-M.; El-Azab, Adel S.; Al-Swaidan, Ibrahim A. 2-Methoxy-4,6-diphenylnicotinonitrile Acta Crystallographica Section E, 2014, 70, o228 |
| 2239482 | CIF HKL | C6 H13 N O7 P | P 21 21 2 | 11.1482; 13.0903; 7.0432 90; 90; 90 | 1027.84 | Bialek, Sebastian; Clemens, Rebecca; Reiss, Guido J. (Dimethylphosphoryl)methanaminium hydrogen oxalate‒oxalic acid (2/1) Acta Crystallographica Section E, 2014, 70, o312 |
| 2240346 | CIF HKL | C8 H11 N O5 | P 21 21 2 | 7.9337; 20.581; 5.8405 90; 90; 90 | 953.7 | Kanazawa, Hitoshi; Inada, Aya Crystal structure of γ-ethyl-<small>L</small>-glutamate <i>N</i>-carboxy anhydride Acta Crystallographica Section E, 2015, 71, 110-112 |
| 2240437 | CIF HKL | Nb1.18 P S10 V0.82 | P 21 21 2 | 12.8472; 13.6212; 7.1972 90; 90; 90 | 1259.47 | Sun, Joobin; Heo, Jiyun; Yun, Hoseop Crystal structure of the mixed-metal thiophosphate Nb~1.18~V~0.82~PS~10~ Acta Crystallographica Section E, 2015, 71, 278-280 |
| 2240978 | CIF HKL Paper | C5 H13 K O9 S | P 21 21 2 | 23.3536; 9.0434; 4.9939 90; 90; 90 | 1054.69 | Haines, Alan H.; Hughes, David L. Crystal structure of potassium (1<i>S</i>)-<small>D</small>-lyxit-1-ylsulfonate monohydrate Acta Crystallographica Section E, 2015, 71, 993-996 |
| 2241060 | CIF HKL Paper | C12 H18 Cl2 N4 | P 21 21 2 | 8.895; 17.676; 4.436 90; 90; 90 | 697.46 | Trischler, Aaron; Oshin, Kayode; Pintauer, Tomislav Crystal structure of ammonium bis[(pyridin-2-yl)methyl]ammonium dichloride Acta Crystallographica Section E, 2015, 71, o692-o693 |
| 2241257 | CIF HKL Paper | C21 H18 Br N3 O | P 21 21 2 | 7.271; 41.901; 5.952 90; 90; 90 | 1813.3 | Moriwaki, Ryoji; Akitsu, Takashiro Crystal structure of 2-{(<i>R</i>)-[1-(4-bromophenyl)ethyl]iminomethyl}-4-(phenyldiazenyl)phenol, a chiral photochromic Schiff base Acta Crystallographica Section E, 2015, 71, o886-o887 |
| 2241261 | CIF HKL Paper | C24 H35 Cl N4 O5 | P 21 21 2 | 18.8408; 20.2263; 6.7923 90; 90; 90 | 2588.41 | Maxson, Tucker; Bertke, Jeffery A.; Gray, Danielle L.; Mitchell, Douglas A. Crystal structure and absolute configuration of (3<i>S</i>,4a<i>S</i>,8a<i>S</i>)-<i>N</i>-<i>tert</i>-butyl-2-[(<i>S</i>)-3-(2-chloro-4-nitrobenzamido)-2-hydroxypropyl]decahydroisoquinoline-3-carboxamide and (3<i>S</i>,4a<i>S</i>,8a<i>S</i>)-<i>N</i>-<i>tert</i>-butyl-2-{(<i>S</i>)-2-[(<i>S</i>)-1-(2-chloro-4-nitrobenzoyl)pyrrolidin-2-yl]-2-hydroxyethyl}decahydroisoquinoline-3-carboxamide Acta Crystallographica Section E, 2015, 71, 1401-1407 |
| 2241422 | CIF HKL Paper | C8 H24 Cl4 Cu N2 | P 21 21 2 | 14.8766; 29.903; 7.3102 90; 90; 90 | 3252 | Aldrich, Emily P.; Bussey, Katherine A.; Connell, Jennifer R.; Reinhart, Erin F.; Oshin, Kayode D.; Mercado, Brandon Q.; Oliver, Allen G. Crystal structure of the thermochromic bis(diethylammonium) tetrachloridocuprate(II) complex Acta Crystallographica Section E, 2016, 72, 40-43 |
| 2241561 | CIF HKL Paper | C22 H20 F2 N2 S | P 21 21 2 | 21.1153; 7.7846; 6.1343 90; 90; 90 | 1008.32 | Hernández-Téllez, Guadalupe; Bernès, Sylvain; Mendoza, Angel; Ríos-Merino, Francisco Javier; Moreno, Gloria E.; Portillo, Oscar; Gutiérrez, René Crystal structures of four chiral imine-substituted thiophene derivatives Acta Crystallographica Section E, 2016, 72, 350-354 |
| 2241562 | CIF HKL Paper | C22 H20 Cl2 N2 S | P 21 21 2 | 21.893; 7.9212; 6.2315 90; 90; 90 | 1080.66 | Hernández-Téllez, Guadalupe; Bernès, Sylvain; Mendoza, Angel; Ríos-Merino, Francisco Javier; Moreno, Gloria E.; Portillo, Oscar; Gutiérrez, René Crystal structures of four chiral imine-substituted thiophene derivatives Acta Crystallographica Section E, 2016, 72, 350-354 |
| 2241639 | CIF HKL Paper | C20 H20 N4 O3 S | P 21 21 2 | 18.2226; 13.7954; 15.5594 90; 90; 90 | 3911.4 | Penthala, Narsimha Reddy; Yadlapalli, Jaishankar K. B.; Parkin, Sean; Crooks, Peter A. Crystal structures of (<i>Z</i>)-5-[2-(benzo[<i>b</i>]thiophen-2-yl)-1-(3,5-dimethoxyphenyl)ethenyl]-1<i>H</i>-tetrazole and (<i>Z</i>)-5-[2-(benzo[<i>b</i>]thiophen-3-yl)-1-(3,4,5-trimethoxyphenyl)ethenyl]-1<i>H</i>-tetrazole Acta Crystallographica Section E, 2016, 72, 652-655 |
| 2241783 | CIF HKL Paper | C16 H24 Cl2 O | P 21 21 2 | 12.3075; 13.9332; 18.6716 90; 90; 90 | 3201.9 | Benzalim, Ahmed; Auhmani, Aziz; Bimoussa, Abdoullah; Ait Itto, My Youssef; Daran, Jean-Claude; Auhmani, Abdelwahed Crystal structure of (1<i>S</i>,3<i>R</i>,8<i>R</i>,9<i>R</i>)-2,2-dichloro-3,7,7-trimethyl-10-methylenetricyclo[6.4.0.0^1,3^]dodecan-9-ol Acta Crystallographica Section E, 2016, 72, 1163-1166 |
| 2241864 | CIF HKL | C7 H22 O4 Sn2 | P 21 21 2 | 11.0786; 18.9529; 6.699 90; 90; 90 | 1406.6 | Otte, Felix; Koller, Stephan G.; Golz, Christopher; Strohmann, Carsten Crystal structures of diaquadi-μ-hydroxido-tris[trimethyltin(IV)] diformatotrimethylstannate(IV) and di-μ-hydroxido-tris[trimethyltin(IV)] chloride monohydrate Acta Crystallographica Section E, 2016, 72, 1499-1502 |
| 2242213 | CIF HKL Paper | C16 H52 Br6 N8 O14 Pt2 S4 | P 21 21 2 | 14.3568; 27.0628; 5.5212 90; 90; 90 | 2145.18 | Matsushita, Nobuyuki; Taira, Ayako; Taoka, Yoshiya A one-dimensional bromide-bridged Pt^II^/Pt^IV^ mixed-valence complex with a 2-bromoethanesulfonate counter-ion Acta Crystallographica Section E, 2017, 73, 1108-1112 |
| 2242243 | CIF HKL | C8 H19 N O7 | P 21 21 2 | 11.0921; 14.8876; 7.207 90; 90; 90 | 1190.13 | Publicover, Ernlie A.; Kolwich, Jennifer; Stack, Darcie L.; Doué, Alyssa J.; Ylijoki, Kai E. O. Crystal structure of (<i>S</i>)-<i>sec</i>-butylammonium <small>L</small>-tartrate monohydrate Acta Crystallographica Section E, 2017, 73, 716-719 |
| 2300046 | CIF | C6 H14 O6 | P 21 21 2 | 24.30122; 20.57261; 4.86719 90; 90; 90 | 2433.3 | Rukiah, Mwaffak; Lefebvre, Jacques; Hernandez, Olivier; van Beek, Wouter; Serpelloni, Michel Ab initiostructure determination of the Γ form of D-sorbitol (D-glucitol) by powder synchrotron X-ray diffraction Journal of Applied Crystallography, 2004, 37, 766-772 |
| 2310163 | CIF HKL Paper | C4 H16 Ca O12 | P 21 21 2 | 7.739; 12.803; 5.829 90; 90; 90 | 577.551 | Ventruti, Gennaro; Scordari, Fernando; Bellatreccia, Fabio; Della Ventura, Giancarlo; Sodo, Armida Calcium tartrate esahydrate, CaC4H4O6·6H2O: a structural and spectroscopic study. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 68-73 |
| 2310538 | CIF | C H7 N7 | P 21 21 2 | 13.64; 9.67; 3.86 90; 90; 90 | 509.129 | Bryden, J. H. The Crystal Structure of the Hydrazine Salt of 5-Aminotetrazol Acta Crystallographica (1,1948-23,1967), 1958, 11, 31-37 |
| 2310720 | CIF | Ba H2 O S4 | P 21 21 2 | 9.67; 7.99; 7.81 90; 90; 90 | 603.426 | Abrahams, S. C. The crystal structure of barium tetrasulfide monohydrate Acta Crystallographica (1,1948-23,1967), 1954, 7, 423-429 |
| 2310958 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.017; 10.309; 3.735 90; 90; 90 | 308.687 | Robertson, J.H. Ammonium oxalate monohydrate: structure refinement at 30 K Acta Crystallographica (1,1948-23,1967), 1965, 18, 410-417 |
| 2311257 | CIF | C18 H25 O2.5 | P 21 21 2 | 12.056; 19.225; 6.519 90; 90; 90 | 1511 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311526 | CIF Paper | C3 H6 Cl2 Cs N O3 Pd | P 21 21 2 | 11.594; 17.072; 4.4739 90; 90; 90 | 885.5 | Bhadbhade, Mohan Madhav; Charlson, Alexander J. Crystal structure of poly[[μ<sub>3</sub>-(<i>S</i>)-2-amino-3-hydroxy-propano-ato]-<i>cis</i>-di-μ-chlorido-caesium-palladium(II)]. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1898-1902 |
| 2311790 | CIF | C14 H26 N4 S7 Sn3 | P 21 21 2 | 13.2299; 22.2673; 9.0772 90; 90; 90 | 2674.09 | Filsø, Mette Ø; Chaaban, Iman; Al Shehabi, Amer; Skibsted, Jørgen; Lock, Nina The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 931-940 |
| 2311791 | CIF | C14 H26 N4 S7 Sn3 | P 21 21 2 | 13.1724; 22.2035; 8.9383 90; 90; 90 | 2614.2 | Filsø, Mette Ø; Chaaban, Iman; Al Shehabi, Amer; Skibsted, Jørgen; Lock, Nina The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 931-940 |
| 2312349 | CIF HKL Paper | C30 H26 Cl3 N O4 | P 21 21 2 | 9.27898; 32.3574; 9.96336 90; 90; 90 | 2991.44 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
| 4000065 | CIF | C28 H22 N2 O5 Zn | P 21 21 2 | 7.6251; 25.4296; 5.8625 90; 90; 90 | 1136.76 | Chemistry of Materials, 2001 |
| 4000404 | CIF | Se5 Sn Sr2 | P 21 21 2 | 12.057; 16.583; 8.639 90; 90; 90 | 1727.2 | Chemistry of Materials, 2004 |
| 4002035 | CIF | C12 F6 I4 | P 21 21 2 | 8.067; 23.1; 4.34 90; 90; 90 | 808.7 | Lu, Weigang; Wei, Zhangwen; Yuan, Daqiang; Tian, Jian; Fordham, Stephen; Zhou, Hong-Cai Rational Design and Synthesis of Porous Polymer Networks: Toward High Surface Area Chemistry of Materials, 2014, 26, 4589 |
| 4002437 | CIF | O2 Si | P 21 21 2 | 11.6; 11.6; 5.2 90; 90; 90 | 699.712 | Wojdel, J.C.; Zwijnenburg, M.A.; Bromley, S.T. Magic silica clusters as nanoscale building units for super-(tris)tetrahedral materials Chemistry of Materials (1,1989-), 2006, 18, 1464-1469 |
| 4002713 | CIF | C26 H36 Cu2 N12 O9 | P 21 21 2 | 18.71; 7.807; 10.452 90; 90; 90 | 1526.7 | Li, Rong; Wang, Shuai-Hua; Chen, Xu-Xing; Lu, Jian; Fu, Zhi-Hua; Li, Yan; Xu, Gang; Zheng, Fa-Kun; Guo, Guo-Cong Highly Anisotropic and Water Molecule-Dependent Proton Conductivity in a 2D Homochiral Copper(II) Metal‒Organic Framework Chemistry of Materials, 2017, 29, 2321 |
| 4002714 | CIF | C26 H30 Cu2 N12 O6 | P 21 21 2 | 18.7672; 7.6504; 10.1885 90; 90; 90 | 1462.83 | Li, Rong; Wang, Shuai-Hua; Chen, Xu-Xing; Lu, Jian; Fu, Zhi-Hua; Li, Yan; Xu, Gang; Zheng, Fa-Kun; Guo, Guo-Cong Highly Anisotropic and Water Molecule-Dependent Proton Conductivity in a 2D Homochiral Copper(II) Metal‒Organic Framework Chemistry of Materials, 2017, 29, 2321 |
| 4003345 | CIF | C52 H88 Br2 Cu2 N2 O26 P2 S2 Ti6 | P 21 21 2 | 24.2854; 26.7805; 12.2991 90; 90; 90 | 7999 | Fang, Wei-Hui; Wang, Jian-Fang; Zhang, Lei; Zhang, Jian Titanium‒Oxo Cluster Based Precise Assembly for Multidimensional Materials Chemistry of Materials, 2017, 29, 2681 |
| 4003660 | CIF | C6 H21 Bi Cl6 F3 N3 | P 21 21 2 | 11.8809; 20.2321; 8.0349 90; 90; 90 | 1931.39 | Chu, Lu-Lu; Zhang, Tie; Gao, Ya-Fang; Zhang, Wan-Ying; Shi, Ping-Ping; Ye, Qiong; Fu, Da-Wei Fluorine Substitution in Ethylamine Triggers Second Harmonic Generation in Noncentrosymmetric Crystalline [NH3CH2CH2F]3BiCl6 Chemistry of Materials, 2020 |
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