Crystallography Open Database
Search results
Result: there are 923 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 1 n 1'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 2000429 | CIF Paper | C24 H21 B F4 N P | P 1 n 1 | 24.6077; 9.0071; 10.069 90; 100.824; 90 | 2192 | Llamas-Saiz, A. L.; Foces-Foces, C.; Elguero, J.; Molina, P.; Alajarín, M.; Vidal, A. Effect of the protonation and of the <i>ortho</i> substitution on the structure of aryliminophosphoranes Acta Crystallographica Section C, 1992, 48, 1940-1945 |
| 2000799 | CIF Paper | C7 H13 N O4 | P 1 n 1 | 8.767; 7.117; 7.26 90; 110.23; 90 | 425.04 | Vinković, M.; Dumić, M.; Kamenar, B. (±)-<i>cis</i>-6-Acetylamino-5-hydroxy-1,3-dioxepane Acta Crystallographica Section C, 1992, 48, 1352-1354 |
| 2003270 | CIF Paper | C18 H15 N O2 | P 1 n 1 | 16.092; 7.906; 11.889 90; 115.2; 90 | 1368.6 | Kubicki, M.; Borowiak, T.; Antkowiak, W. Z. Hindered Cavity-Shaped <i>N</i>-Oxides Acta Crystallographica Section C, 1995, 51, 458-461 |
| 2005065 | CIF HKL Paper | C21 H22 N2 O8 Si | P 1 n 1 | 7.2309; 29.517; 20.717 90; 101.98; 90 | 4325.4 | White, J. M.; Tham, W.-Y.; Green, A. J. Bis(<i>p</i>-nitrobenzoate) Ester of <i>cis</i>-1,1-Dimethylsilacyclohexane-3,4-diol Acta Crystallographica Section C, 1996, 52, 1493-1496 |
| 2006502 | CIF HKL Paper | C23 H31 Cl2 N O5 S | P 1 n 1 | 14.4318; 10.2646; 17.997 90; 103.689; 90 | 2590.3 | Görbitz, Carl Henrik; Kazmaier, Uli; Grandel, Roland (±)-<i>tert</i>-Butyl 3-Hydroxy-4-phenyl-2-(<i>p</i>-toluenesulfonylamino)pentanoate–Dichloromethane (1/1): a Pseudo Centre of Symmetry in an Enantiomeric Pair Acta Crystallographica Section C, 1997, 53, 1302-1305 |
| 2006648 | CIF Paper | C13 H12 Cl N O3 | P 1 n 1 | 3.9241; 13.0404; 12.4181 90; 92.21; 90 | 634.98 | Moreno-Fuquen, Rodolfo; Grajales-Tamayo, Mario; Gambardella, Maria Teresa do Prado The 1:1 Complex Formed by 2-Picoline <i>N</i>-Oxide and 3-Chlorobenzoic Acid Acta Crystallographica Section C, 1997, 53, 1635-1637 |
| 2008800 | CIF HKL Paper | C42 H34 O2 P2 Pt | P 1 n 1 | 9.0064; 10.8717; 17.585 90; 103.717; 90 | 1672.7 | Lesley, M.J. Gerald; Clegg, William; Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Scott, Andrew J.; Starbuck, Jonathan Three Pt^II^ catecholate and 1,2-dithiocatecholate complexes Acta Crystallographica Section C, 1999, 55, 1272-1275 |
| 2008801 | CIF Paper | C42 H34 P2 Pt S2 | P 1 n 1 | 9.0177; 10.9977; 17.9351 90; 102.093; 90 | 1739.2 | Lesley, M.J. Gerald; Clegg, William; Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Scott, Andrew J.; Starbuck, Jonathan Three Pt^II^ catecholate and 1,2-dithiocatecholate complexes Acta Crystallographica Section C, 1999, 55, 1272-1275 |
| 2008958 | CIF HKL Paper | Ge Na2 O4 Zn | P 1 n 1 | 7.1535; 5.5819; 5.3279 90; 89.934; 90 | 212.74 | Healey, Adam M.; Webster, Michael; Weller, Mark T. Disodium zinc germanium tetraoxide Acta Crystallographica Section C, 1999, 55, IUC9900099 |
| 2009176 | CIF HKL Paper | C4 H6 N2 O2 | P 1 n 1 | 7.9452; 3.9485; 8.7627 90; 102.119; 90 | 268.77 | Kresge, A. J.; Lough, Alan J.; Popik, V. V. 2-Hydroxy-<i>N</i>-methylcyanoacetamide Acta Crystallographica Section C, 1999, 55, IUC9900140 |
| 2010018 | CIF Paper | Ba Co S2 | P 1 n 1 | 4.573; 8.937; 4.57 90; 90.43; 90 | 186.77 | Norman C. Baenziger; Larry Grout; Lee S. Martinson; John W. Schweitzer BaCoS~2~ Acta Crystallographica Section C, 1994, 50, 1375-1377 |
| 2010330 | CIF Paper | C40 H30 N2 P2 Pd S2 | P 1 n 1 | 9.119; 11.039; 17.971 90; 101.07; 90 | 1775.4 | Ebihara, Masahiro; Tsuchiya, Masaki; Kawamura, Takashi A distorted planar palladium complex with maleonitriledithiolato and triphenylphosphine ligands, [Pd(PPh~3~)~2~(mnt)] Acta Crystallographica Section C, 1994, 50, 1880-1882 |
| 2010735 | CIF HKL Paper | C12 H24 Br2 N2 O2 Sn | P 1 n 1 | 7.475; 8.03; 14.977 90; 91.98; 90 | 898.4 | König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel Complexes of dimethyltin dihalides with <i>N</i>-methylpyrrolidinone, C~12~H~24~N~2~O~2~<i>X</i>~2~Sn (<i>X</i> = Cl, Br or I) Acta Crystallographica Section C, 2000, 56, 324-326 |
| 2010736 | CIF HKL Paper | C12 H24 I2 N2 O2 Sn | P 1 n 1 | 7.396; 8.327; 15.406 90; 90.31; 90 | 948.8 | König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel Complexes of dimethyltin dihalides with <i>N</i>-methylpyrrolidinone, C~12~H~24~N~2~O~2~<i>X</i>~2~Sn (<i>X</i> = Cl, Br or I) Acta Crystallographica Section C, 2000, 56, 324-326 |
| 2012660 | CIF Paper | C21 H15 Ir3 Mo O11 | P 1 n 1 | 10.922; 10.226; 11.725 90; 104.64; 90 | 1267 | Lucas, Nigel T.; Whittall, Ian R.; Humphrey, Mark G. Undecacarbonyl(methylcyclopentadienyl)-<i>tetrahedro</i>-triiridiummolybdenum, undecacarbonyl(tetramethylcyclopentadienyl)-<i>tetrahedro</i>-triiridiummolybdenum and undecacarbonyl(pentamethylcyclopentadienyl)-<i>tetrahedro</i>-triiridiummolybdenum Acta Crystallographica Section C, 2002, 58, m249-m251 |
| 2012692 | CIF HKL Paper | Nb2 P Rb S10 | P 1 n 1 | 12.773; 7.529; 7.108 90; 104.37; 90 | 662.2 | Changkeun Kim; Hoseop Yun A new quaternary thiophosphate, RbNb~2~(S~2~)~3~(PS~4~) Acta Crystallographica Section C, 2002, 58, i53-i54 |
| 2012957 | CIF HKL Paper | C38 H21 N5 O10 S4 | P 1 n 1 | 7.707; 16.1001; 14.3067 90; 95.077; 90 | 1768.26 | Bowes, Katharine F.; Ferguson, George; Glidewell, Christopher; Low, John N.; Quesada, Antonio <i>N</i>,<i>N</i>'-Dithiobisphthalimide–nitrobenzene (2/1): a <i>Pn</i> solvate with localized solvent molecules ordered head-to-tail in channels Acta Crystallographica Section C, 2002, 58, o551-o554 |
| 2013367 | CIF HKL Paper | C19 H30 Co N5 O4 | P 1 n 1 | 8.268; 11.757; 11.0253 90; 93.721; 90 | 1069.5 | Pickin, Kerry A.; Day, Cynthia S.; Wright, Marcus W.; Welker, Mark E. <i>trans</i>-Bis(dimethylglyoximato-κ^2^<i>N</i>,<i>N</i>')(1-hexenyl)(pyridine-κ<i>N</i>)cobalt(III): a cobaloxime-substituted terminal alkene that rapidly isomerizes to a cobaloxime-substituted internal alkenyl complex Acta Crystallographica Section C, 2003, 59, m193-m195 |
| 2013647 | CIF HKL Paper | C4 H9 N O4 S | P 1 n 1 | 7.0429; 4.8135; 10.9047 90; 96.885; 90 | 367.01 | Maurin, Jan K.; Pawłowski, Michał; Czarnocki, Zbigniew Pseudosymmetry in ammonium [(carboxymethyl)sulfanyl]acetate Acta Crystallographica Section C, 2003, 59, o656-o658 |
| 2013802 | CIF HKL Paper | C14 H8 N2 O4 | P 1 n 1 | 6.665; 3.6962; 23.639 90; 95.208; 90 | 579.95 | Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L. A three-dimensional hydrogen-bonded framework in <i>N</i>-(3-nitrophenyl)phthalimide, and hydrogen-bonded chains of rings in <i>N</i>-(3,5-dinitrophenyl)phthalimide, linked into sheets by dipolar interactions Acta Crystallographica Section C, 2004, 60, o24-o27 |
| 2014315 | CIF Paper | C18 H16 N2 O3 | P 1 n 1 | 4.9402; 5.6847; 25.9862 90; 94.495; 90 | 727.54 | Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A. 1-(1<i>H</i>-Indol-3-ylcarbonyl)-<i>N</i>-(4-methoxybenzyl)formamide Acta Crystallographica Section C, 2006, 62, o153-o154 |
| 2014475 | CIF | C8 H9 N O6 | P 1 n 1 | 4.0607; 13.144; 8.696 90; 101.99; 90 | 454 | Fukunaga, Takeo; Kashino, Setsuo; Ishida, Hiroyuki 2-Pyridone–tartronic acid (1/1), 3-hydroxypyridinium hydrogen tartronate and 4-hydroxypyridinium hydrogen tartronate Acta Crystallographica, Section C: Crystal Structure Communications, 2004, 60, o717-o722 |
| 2014732 | CIF HKL Paper | C11 H17 N3 O3 | P 1 n 1 | 4.1085; 8.4497; 17.1272 90; 94.721; 90 | 592.56 | da Silva, Emerson T.; Ribiero, Rodrigo S.; Lima, Edson L. S.; Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher 5-(1-Hydroxyethylidene)-1,3-dimethylpyrimidine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trione and four amino derivatives Acta Crystallographica Section C, 2005, 61, o15-o20 |
| 2015603 | CIF HKL Paper | C47 H28 N8 O Zn | P 1 n 1 | 9.2505; 9.66; 21.1032 90; 101.422; 90 | 1848.43 | Sankar Muniappan; Sophia Lipstman; Israel Goldberg Supramolecular assembly of (methanol)[10,15,20-tris(4-cyanophenyl)-5-(4-pyridyl)porphyrinato]zinc(II) by intermolecular hydrogen bonding and weak coordination Acta Crystallographica Section C, 2006, 62, m477-m479 |
| 2015735 | CIF HKL Paper | C27 H30 Cl N O2 P2 Pd S | P 1 n 1 | 11.5432; 9.5417; 13.1351 90; 101.904; 90 | 1415.61 | Elsegood, Mark R. J.; Smith, Martin B.; Dale, Sophie H. Two square-planar palladium(II) complexes with <i>P</i>,<i>O</i>-bidentate hybrid ligands Acta Crystallographica Section C, 2007, 63, m7-m9 |
| 2017437 | CIF HKL Paper | C22 H14 N2 O5 | P 1 n 1 | 5.3881; 8.3227; 18.6514 90; 90.3794; 90 | 836.38 | Titi, Hatem M.; Goldberg, Israel Hydrogen bonding and π–π interactions in 1-benzofuran-2,3-dicarboxylic acid and its 1:1 cocrystals with pyridine, phenazine and 1,4-phenylenediamine Acta Crystallographica Section C, 2009, 65, o639-o644 |
| 2018157 | CIF HKL Paper | C22 H20 Cd N4 O6 | P 1 n 1 | 11.58; 8.4221; 11.6393 90; 113.354; 90 | 1042.16 | Zhou, Shi; Li, Chuan-Bi; Wang, Qing-Wei; Ng, Seik Weng Poly[aqua[μ~2~-1,4-bis(imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^](μ~2~-5-hydroxybenzene-1,3-dicarboxylato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^3^,<i>O</i>^3'^)cadmium(II)], a twofold interpenetrated CdSO~4~-like metal‒organic polymer Acta Crystallographica Section C, 2011, 67, m224-m226 |
| 2018537 | CIF HKL Paper | C13 H10 Cl N3 O2 | P 1 n 1 | 9.7426; 6.1015; 21.7139 90; 96.175; 90 | 1283.28 | Ojala, William H.; Arola, Trina M.; Brigino, Ann M.; Leavell, Jeremy D.; Ojala, Charles R. Competing intermolecular interactions in some `bridge-flipped' isomeric phenylhydrazones Acta Crystallographica Section C, 2012, 68, o270-o278 |
| 2019011 | CIF HKL Paper | C32 H76 B Li O4 Si4 | P 1 n 1 | 10.5661; 11.7334; 18.1342 90; 93.153; 90 | 2244.8 | Scholz, Stefan; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram An approach to creating novel anions: silylated triel compounds with –CH~2~– and –O– linkers, [InCl~2~{O(HO)Si(<i>t</i>-Bu)~2~}]~2~ and Li[B(CH~2~SiMe~3~)~4~] Acta Crystallographica Section C, 2013, 69, 569-572 |
| 2019678 | CIF HKL Paper | C62 H42 Cu F20 O4 | P 1 n 1 | 13.8034; 14.2545; 14.9313 90; 108.061; 90 | 2793.1 | Hori, Akiko; Nakajima, Kyosuke; Yuge, Hidetaka Three <i>p</i>-xylene-solvated pseudopolymorphs of bis[1,3-bis(pentafluorophenyl)propane-1,3-dionato]copper(II) Acta Crystallographica Section C, 2014, 70, 960-964 |
| 2019731 | CIF HKL Paper | C6 H5 Cl N2 O2 | P 1 n 1 | 12.726; 7.9721; 15.0098 90; 110.352; 90 | 1427.73 | Fábry, Jan; Dušek, Michal; Vaněk, Přemysl; Rafalovskyi, Iegor; Hlinka, Jiří; Urban, Jiří High- and low-temperature phases in isostructural 4-chloro-3-nitroaniline and 4-iodo-3-nitroaniline Acta Crystallographica Section C, 2014, 70 |
| 2019733 | CIF HKL Paper | C6 H5 I N2 O2 | P 1 n 1 | 12.5188; 8.2955; 15.9287 90; 111.141; 90 | 1542.86 | Fábry, Jan; Dušek, Michal; Vaněk, Přemysl; Rafalovskyi, Iegor; Hlinka, Jiří; Urban, Jiří High- and low-temperature phases in isostructural 4-chloro-3-nitroaniline and 4-iodo-3-nitroaniline Acta Crystallographica Section C, 2014, 70 |
| 2020157 | CIF | Be F3 H4 N | P 1 n 1 | 5.77; 4.619; 12.819 90; 90.12; 90 | 341.646 | Waskowska, A. Ammonium trifluoroberyllate(II), (N H4) (Be F3), at room temperature Acta Crystallographica C (39,1983-), 1983, 39, 1167-1169 |
| 2021725 | CIF HKL Paper | C44 H34 Co2 N8 O8 | P 1 n 1 | 10.4597; 12.798; 15.0545 90; 98.709; 90 | 1992 | Su, Feng; Zhou, Cheng-Yong; Wu, Lin-Tao; Wu, Xi; Su, Jing; Han, Chun; Wang, Zhi-Jun Two Co^II^ coordination polymers of biphenyl-2,2',5,5'-tetracarboxylic acid with flexible N-donor ligands: syntheses, structures and magnetic properties Acta Crystallographica Section C, 2019, 75 |
| 2021746 | CIF HKL Paper | C39 H41 B N2 O | P 1 n 1 | 10.673; 10.0539; 15.0271 90; 96.095; 90 | 1603.37 | Wang, Shengpei; Yu, Shasha; Feng, Jianxiang; Liu, Shenggao A highly efficient antioxidant based on boron and a Schiff base bridged phenolic diphenylamine: synthesis, crystal structure and thermal and antioxidant properties Acta Crystallographica Section C, 2019, 75 |
| 2021804 | CIF HKL Paper | C16 H9 N3 O3 | P 1 n 1 | 3.7788; 9.9655; 16.899 90; 93.466; 90 | 635.2 | Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D. Polymorphism of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)- and 3-[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]-2<i>H</i>-chromen-2-ones Acta Crystallographica Section C, 2019, 75 |
| 2022743 | CIF HKL Paper | C28 H35 N O5 | P 1 n 1 | 6.2398; 14.7216; 13.5383 90; 94.229; 90 | 1240.24 | Vinaya, ?; Anil Kumar, Haleyur G.; Mohan Kumar, Thaluru M.; Lakshmana, Beliyaiah; Basavaraju, Yeriyur B.; Yathirajan, Hemmige S.; Parkin, Sean Syntheses, crystal structures and Hirshfeld surface analyses of four mol-ecular salts of amitriptynol. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 451-457 |
| 2022831 | CIF HKL Paper | C16 H12 Cl N3 | P 1 n 1 | 7.7968; 12.0926; 14.8738 90; 100.601; 90 | 1378.42 | Nasr, Tamer; Kariuki, Benson M.; Elansary, Mai M.; Elhaggar, Radwan; Zaghary, Wafaa Synthesis and crystal structures of (E)-N′-(4-chloro-3-nitrobenzylidene)acetohydrazide and (E)-2-(4-chlorobenzylidene)-1-(quinolin-8-yl)hydrazine Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 762-766 |
| 2101908 | CIF Paper | C17 H16 N4 | P 1 n 1 | 6.97; 14.233; 7.633 90; 107.91; 90 | 720.5 | Cole, J. C.; Cole, J. M.; Cross, G. H.; Farsari, M.; Howard, J. A. K.; Szablewski, M. Structural Studies of a Series of Organic Non-Linear Optical Materials Acta Crystallographica Section B, 1997, 53, 812-821 |
| 2102931 | CIF Paper | C4 Br4 S | P 1 n 1 | 12.419; 4.0397; 8.824 90; 109.181; 90 | 418.1 | Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing Acta Crystallographica Section B, 2007, 63, 783-790 |
| 2102934 | CIF Paper | C4 Br4 S | P 1 n 1 | 12.376; 4.004; 8.816 90; 109.452; 90 | 411.9 | Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing Acta Crystallographica Section B, 2007, 63, 783-790 |
| 2103114 | CIF Paper | C26 H24 Cl3 N4 P3 | P 1 n 1 | 11.657; 8.5838; 13.783 90; 96.41; 90 | 1370.5 | Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin Structural investigations of phosphorus–nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene Acta Crystallographica, Section B: Structural Science, 2002, 58, 545-552 |
| 2103292 | CIF HKL Paper | C42 H42 I2 P2 Pt | P 1 n 1 | 11.256; 9.985; 18.126 90; 105.05; 90 | 1967.3 | Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke Structures of <i>trans</i>-[PtCl~2~(PBz~3~)~2~], <i>trans</i>-[PtI~2~(PBz~3~)~2~], <i>trans</i>-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and <i>trans</i>-[PdI~2~(PBz~3~)~2~] Acta Crystallographica Section B, 2002, 58, 244-250 |
| 2103294 | CIF HKL Paper | C42 H42 I2 P2 Pd | P 1 n 1 | 11.274; 9.994; 18.073 90; 104.88; 90 | 1968 | Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke Structures of <i>trans</i>-[PtCl~2~(PBz~3~)~2~], <i>trans</i>-[PtI~2~(PBz~3~)~2~], <i>trans</i>-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and <i>trans</i>-[PdI~2~(PBz~3~)~2~] Acta Crystallographica Section B, 2002, 58, 244-250 |
| 2106243 | CIF | Mg Na2 O4 Si | P 1 n 1 | 7.015; 5.484; 5.26 90; 89.97; 90 | 202.354 | Baur, W.H.; Shannon, R.D.; Ohta, T. Structure of magnesium disodium silicate Na2 Mg Si O4 and ionic conductivity in tetrahedral structures Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1483-1491 |
| 2106906 | CIF | B5 H12 N O12 | P 1 n 1 | 7.115; 11.301; 7.183 90; 99.92; 90 | 568.926 | Domenech, M. V.; Solans, X.; Solans, J. The alpha Phase of Ammonium Pentaborate Tetrahydrate Acta Crystallographica B (24,1968-38,1982), 1981, 37, 643-645 |
| 2107041 | CIF | D3 Li O6 Se2 | P 1 n 1 | 6.2473; 7.903; 5.4471 90; 104.995; 90 | 259.779 | Liminga, R.; Tellgren, R. A Neutron Diffraction Study of the Ferroelectric State of Deuterated Lithium Trihydrogenselenite, Li D3 (Se O3)2 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1551-1554 |
| 2107072 | CIF | Li O3 P | P 1 n 1 | 16.453; 5.405; 13.086 90; 98.99; 90 | 1149.42 | Guitel, J.C.; Tordjman, I. Structure cristalline du polyphosphate de lithium, Li P O3 Acta Crystallographica B (24,1968-38,1982), 1976, 32, 2960-2966 |
| 2108013 | CIF HKL Paper | H O4 Rb S | P 1 n 1 | 14.2651; 4.5853; 14.2789 90; 117.999; 90 | 824.66 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108018 | CIF HKL | H O4 Rb S | P 1 n 1 | 14.166; 4.5982; 14.326 90; 117.68; 90 | 826.4 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108541 | CIF HKL | F7 H12 N5 O Ru Si | P 1 n 1 | 6.7036; 7.426; 10.1296 90; 107.469; 90 | 481 | Mikhailov, Artem; Vuković, Vedran; Kijatkin, Christian; Wenger, Emmanuel; Imlau, Mirco; Woike, Theo; Kostin, Gennadiy; Schaniel, Dominik Combining photoinduced linkage isomerism and nonlinear optical properties in ruthenium nitrosyl complexes Acta Crystallographica Section B, 2019, 75 |
| 2108637 | CIF HKL | C22 H17 F4 N O | P 1 n 1 | 7.6714; 7.1287; 16.428 90; 100.298; 90 | 883.9 | Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies Acta Crystallographica Section B, 2020, 76 |
| 2200154 | CIF HKL Paper | C40 H46 Cl4 Cu N6 O | P 1 n 1 | 12.809; 8.608; 19.482 90; 95.81; 90 | 2137 | Braitenbach, Kristin; Parvez, Masood Chlorobis(clemizole)copper(II) chloride ethanol solvate Acta Crystallographica Section E, 2001, 57, m67-m69 |
| 2200462 | CIF HKL Paper | C47 H44 N O4 P3 | P 1 n 1 | 15.3382; 8.6418; 15.9748 90; 105.034; 90 | 2045 | Kruszynski, Rafal; Wieczorek, Wanda Polymorphic form of 1,3,5-tris[(diphenylphosphine oxide)methyl]benzene acetonitrile solvate monohydrate Acta Crystallographica Section E, 2001, 57, o624-o626 |
| 2201563 | CIF HKL Paper | C8 H6 Cl3 N O | P 1 n 1 | 3.9015; 12.658; 9.6687 90; 101.186; 90 | 468.42 | Mahalakshmi, L.; Upadhyaya, V.; Guru Row, T. N. 2,4,5-Trichloroacetanilide Acta Crystallographica Section E, 2002, 58, o946-o947 |
| 2201569 | CIF HKL Paper | C11 H15 N O | P 1 n 1 | 8.2; 8.538; 8.295 90; 113.626; 90 | 532.1 | Upadhyaya, V.; Mahalakshmi, L.; Guru Row, T. N. 2,4,6-Trimethylacetanilide Acta Crystallographica Section E, 2002, 58, o997-o998 |
| 2201593 | CIF HKL Paper | C17 H19 N2 O2 P S2 | P 1 n 1 | 9.905; 19.091; 20.384 90; 99.18; 90 | 3805.2 | Sheng-Lou Deng; Dong-Zhi Liu; Wei Li 2-(<i>p</i>-Methoxyphenyl)-3-[<i>o</i>-(methylaminothiocarbonyl)phenyl]-1,3,2-oxazaphospholidine 2-sulfide Acta Crystallographica Section E, 2002, 58, o1430-o1431 |
| 2203181 | CIF HKL Paper | C7 H19 Cl2 Ir O P2 | P 1 n 1 | 6.472; 13.156; 8.598 90; 97.157; 90 | 726.4 | Jonathan P. H. Charmant; Nicholas C. Norman; A. Guy Orpen; George R. Whittell Carbonyldichlorohydridobis(trimethylphosphine)iridium(III) Acta Crystallographica Section E, 2004, 60, m164-m165 |
| 2203197 | CIF Paper | C34 H40 Ag B F4 S4 | P 1 n 1 | 9.209; 10.182; 19.158 90; 103.507; 90 | 1746.7 | Miao Du; Xiao-Jun Zhao The two-dimensional coordination polymer poly[[silver(I)-di-μ-1,5-bis(phenylsulfanyl)pentane] tetrafluoroborate] Acta Crystallographica Section E, 2004, 60, m193-m195 |
| 2204166 | CIF HKL Paper | C21 H30 N2 O | P 1 n 1 | 5.917; 16.5865; 9.9576 90; 104.128; 90 | 947.7 | Parrish, Damon A.; Deschamps, Jeffrey R.; Jiang, Faming; Zaveri, Nurulain T. A novel receptor ligand: 1-(1-cyclooctylpiperidin-4-yl)indolin-2-one Acta Crystallographica Section E, 2004, 60, o1571-o1572 |
| 2204194 | CIF HKL Paper | C10 H12 N2 O4 | P 1 n 1 | 9.3056; 4.84; 11.843 90; 100.181; 90 | 525 | Efrén V. García-Báez; Beatriz A. López-Romero; Francisco J. Martínez-Martínez; Herbert Höpfl; Itzia I. Padilla-Martínez Dimethyl <i>N,N</i>'-(1,2-phenylene)dicarbamate Acta Crystallographica Section E, 2004, 60, o1488-o1490 |
| 2206189 | CIF HKL Paper | C4 H17 N2 O12 P3 Zn2 | P 1 n 1 | 11.892; 5.1318; 12.3063 90; 98.125; 90 | 743.48 | Zabukovec Logar, Nataša; Rajić, Nevenka; Stojaković, Djordje; Šajić, Sanja; Golobič, Amalija; Kaučič, Venčeslav (C~4~H~12~N~2~)[Zn~2~(PO~4~)(HPO~4~)(H~2~PO~4~)], a layered zinc phosphate with intercalated <i>N</i>-methylpropane-1,3-diaminium cations Acta Crystallographica Section E, 2005, 61, m1354-m1356 |
| 2206897 | CIF HKL Paper | C15 H25 F2 N O4 | P 1 n 1 | 7.9651; 6.4632; 15.445 90; 90.136; 90 | 795.1 | John Fawcett; Jonathan M Percy; Stéphane Pintat; Clive A Smith; Emi Uneyama (1<i>S</i>*,2<i>S</i>*,4<i>S</i>*)-3,3-Difluoro-2,4-dihydroxy-5,5-dimethylcyclooct-5(<i>Z</i>)-en-1-yl <i>N</i>,<i>N</i>-diethylcarbamate Acta Crystallographica Section E, 2005, 61, o3319-o3321 |
| 2209750 | CIF HKL Paper | C16 H19 N2 O5 P S | P 1 n 1 | 8.4692; 10.889; 9.69 90; 92.514; 90 | 892.8 | Demoin, Dustin Wayne; Pluth, Michael; Soo, Han Sen; Xu, Yue Dimethoxyphosphinoyl phenyl ketone <i>p</i>-tolylsulfonylhydrazone Acta Crystallographica Section E, 2006, 62, o3551-o3552 |
| 2210600 | CIF HKL Paper | C13 H8 Br Cl O S | P 1 n 1 | 17.955; 3.9563; 17.973 90; 99.646; 90 | 1258.7 | Yathirajan, H. S.; Ashalatha, B.; Narayana, B.; Bindya, S.; Bolte, Michael (2<i>E</i>)-1-(3-Bromo-2-thienyl)-3-(4-chlorophenyl)prop-2-en-1-one, a twinned crystal structure Acta Crystallographica Section E, 2006, 62, o4551-o4553 |
| 2210904 | CIF HKL Paper | C12 H9 Cl N4 O | P 1 n 1 | 6.7912; 3.8852; 22.113 90; 95.999; 90 | 580.26 | Xue-Fang Shi; Cui-Cui Yuan <i>N</i>'-(2-Chlorobenzylidene)pyrazine-2-carbohydrazide Acta Crystallographica Section E, 2006, 62, o5232-o5233 |
| 2211284 | CIF HKL Paper | C10 H11 Cl2 N O2 | P 1 n 1 | 8.35; 4.5282; 15.37 90; 103.118; 90 | 566 | Chen, Yun-Feng; Cao, Li-Ping; Qin, Jing 1,2-Bis(chloromethyl)-4,5-dimethyl-3-nitrobenzene Acta Crystallographica Section E, 2006, 62, o5724-o5725 |
| 2211881 | CIF HKL Paper | C22 H22 Br Cu N3 O5 | P 1 n 1 | 11.12; 5.3808; 18.393 90; 93.47; 90 | 1098.5 | Liu, Zheng; Zhang, Shu-Hua; Feng, Xiao-Zhen; Li, Guang-Zhao; Lin, Yuan-Bin {3-[(<i>E</i>)-(5-Bromo-2-oxidophenyl)methylamino]propanoato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) dihydrate Acta Crystallographica Section E, 2007, 63, m156-m158 |
| 2212109 | CIF HKL Paper | C16 H19 O P | P 1 n 1 | 8.1289; 5.9814; 14.6 90; 93.326; 90 | 708.69 | Caddy, Judy; Coyanis, E. Mabel; Lemmerer, Andreas; Khanye, Setshaba D.; Omondi, Bernard Butyldiphenylphosphine oxide Acta Crystallographica Section E, 2007, 63, o1032-o1033 |
| 2212471 | CIF HKL Paper | F H6 N Na O4 P | P 1 n 1 | 6.0515; 9.0167; 4.9402 90; 90.737; 90 | 269.54 | Fábry, Jan; Dušek, Michal; Krupková, Radmila Ammonium sodium fluorotrioxophosphate monohydrate Acta Crystallographica Section E, 2007, 63, i92-i94 |
| 2213147 | CIF HKL Paper | C12 H18 O5 | P 1 n 1 | 7.598; 8.813; 9.169 90; 91.26; 90 | 613.8 | Burton, Sylvester; Fronczek, Frank R.; Maverick, Andrew W. 1,1',1''-[(5<i>RS</i>,6<i>RS</i>)-6-Hydroxy-6-methyl-3,4,5,6-tetrahydro-2<i>H</i>-pyran-3,3,5-triyl]triethanone Acta Crystallographica Section E, 2007, 63, o2661-o2662 |
| 2214016 | CIF HKL Paper | C16 H22 Cl2 O2 S2 Sn | P 1 n 1 | 9.8877; 7.9766; 12.588 90; 95.506; 90 | 988.24 | Sadiq-ur-Rehman; Saeed, Sadia; Ali, Saqib; Shahzadi, Saira; Helliwell, Madeleine Dichloridobis(dimethyl sulfoxide-κ<i>O</i>)diphenyltin(IV) Acta Crystallographica Section E, 2007, 63, m1788-m1788 |
| 2215608 | CIF HKL Paper | C8 H22 Cl Cr N4 O5 | P 1 n 1 | 8.9532; 12.038; 13.645 90; 99.973; 90 | 1448.4 | Zhang, Li-Fang; Kou, Jian-Yi; Kou, Hui-Zhong (Oxalato-κ^2^<i>O</i>,<i>O</i>')bis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')chromium(III) chloride monohydrate Acta Crystallographica Section E, 2007, 63, m2457-m2458 |
| 2215676 | CIF HKL Paper | C17.97 H18.91 Br0.03 N O3.97 | P 1 n 1 | 4.2227; 12.2001; 15.4865 90; 97.506; 90 | 790.99 | Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash 1-(4-Aminophenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one‒1-(4-aminophenyl)-3-(3-bromo-4,5-trimethoxyphenyl)prop-2-en-1-one (0.972/0.028) Acta Crystallographica Section E, 2007, 63, o3970-o3970 |
| 2217444 | CIF HKL Paper | C8 H15 Cl2 Co N4 O4 | P 1 n 1 | 8.1901; 8.1261; 10.4463 90; 102.007; 90 | 680.03 | P. Ramesh; A. SubbiahPandi; P. Jothi; C. Revathi; A. Dayalan Dichlorido(dimethylglyoximato-κ^2^<i>N</i>,<i>N</i>')(dimethylglyoxime-κ^2^<i>N</i>,<i>N</i>')cobalt(III) Acta Crystallographica Section E, 2008, 64, m300-m301 |
| 2218690 | CIF HKL Paper | C4 H6 Cl2 Cu N2 O2 | P 1 n 1 | 9.6104; 3.7942; 10.7375 90; 107.991; 90 | 372.39 | Kurawa, Mukhtar A.; Adams, Christopher J.; Orpen, A. Guy <i>cis</i>-Aquadichlorido[pyrimidin-2(1<i>H</i>)-one-κ<i>N</i>^3^]copper(II) Acta Crystallographica Section E, 2008, 64, m969 |
| 2219461 | CIF HKL Paper | C12 H14 N2 O2 | P 1 n 1 | 10.854; 4.7959; 11.842 90; 111.42; 90 | 573.9 | Xu, Guang-Hai; Wang, Wei Ethyl 2-(2-methyl-1<i>H</i>-benzimidazol-1-yl)acetate Acta Crystallographica Section E, 2008, 64, o1811 |
| 2219539 | CIF HKL Paper | C15 H16 N2 O5 | P 1 n 1 | 4.891; 12.171; 12.371 90; 95.724; 90 | 732.8 | Lu, Jiu-Fu 4-Hydroxy-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)benzohydrazide monohydrate Acta Crystallographica Section E, 2008, 64, o2032 |
| 2219630 | CIF HKL Paper | C12 H10 N2 O | P 1 n 1 | 5.7469; 6.2382; 14.0158 90; 94.752; 90 | 500.74 | Zhuang, Yu-Guo; Jiang, Hua-Jiang; Hong, Zhi; Qiu, Fang-Li <i>N</i>-Phenylpyridine-2-carbamide Acta Crystallographica Section E, 2008, 64, o1904 |
| 2220119 | CIF HKL Paper | C21 H26 N2 O4 | P 1 n 1 | 10.294; 11.8173; 31.5327 90; 93.373; 90 | 3829.22 | Yeap, Chin Sing; Kargar, Hadi; Kia, Reza; Fun, Hoong-Kun 5,5'-Dimethoxy-2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethylidyne)]diphenol Acta Crystallographica Section E, 2008, 64, o2389-o2390 |
| 2220637 | CIF HKL Paper | C16 H17 Co N3 O6 | P 1 n 1 | 6.7884; 12.0903; 10.4945 90; 108.357; 90 | 817.49 | Ng, Hwa Loong; Ng, Chew Hee; Ng, Seik Weng Aqua(iminodiacetato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II) monohydrate Acta Crystallographica Section E, 2009, 65, m41 |
| 2223113 | CIF HKL Paper | C16 H12 N2 O3 | P 1 n 1 | 4.176; 7.395; 21.513 90; 94.08; 90 | 662.7 | Zhang, Yuan; Li, Yong Hua 8-(4-Nitrobenzyloxy)quinoline Acta Crystallographica Section E, 2009, 65, o2270 |
| 2223561 | CIF HKL Paper | C16 H10 O5 | P 1 n 1 | 4.4449; 6.4937; 22.222 90; 91.334; 90 | 641.24 | Li, Wenkuan; Yin, Handong; Wen, Liyuan; Li, Kang; Fan, Weidong 3,3'-Oxybi[isobenzofuran-1(3<i>H</i>)-one] Acta Crystallographica Section E, 2009, 65, o2577 |
| 2224486 | CIF HKL Paper | C32 H27 N3 O5 Zn | P 1 n 1 | 8.3959; 15.564; 10.702 90; 102.23; 90 | 1366.7 | Li, Wei; Lu, Zhan Guo Diacetato{4'-[4-(benzyloxy)phenyl]-2,2':6',2''-terpyridine}zinc(II) Acta Crystallographica Section E, 2009, 65, m1672 |
| 2225170 | CIF HKL Paper | C27 H27 N7 O6 | P 1 n 1 | 13.3411; 10.4347; 19.8517 90; 103.446; 90 | 2687.8 | Habibi, Mohammad Hossein; Abarghooei-Shirazi, Narges; Yamane, Yuki; Suzuki, Takayoshi <i>N</i>,<i>N</i>'-Bis(3-nitrobenzylidene)-2,2'-[2-(3-nitrophenyl)imidazolidine-1,3-diyl]diethanamine Acta Crystallographica Section E, 2010, 66, o501 |
| 2226617 | CIF HKL Paper | C14 H10 N2 O S | P 1 n 1 | 8.6391; 6.2313; 11.4459 90; 108.893; 90 | 582.97 | Asiri, Abdullah M.; Khan, Salman A.; Tan, Kong Wai; Ng, Seik Weng A monoclinic modification of 2-[(1,3-benzothiazol-2-yl)iminomethyl]phenol Acta Crystallographica Section E, 2010, 66, o1826 |
| 2226754 | CIF HKL Paper | C22 H38 Cu F6 N4 P3 | P 1 n 1 | 11.0357; 9.2129; 14.4282 90; 96.723; 90 | 1456.8 | Öztopcu, Özgür; Kirchner, Karl; Mereiter, Kurt Bis{2-[(diisopropylphosphanyl)amino]pyridine-κ^2^<i>N</i>^1^,<i>P</i>}copper(I) hexafluoridophosphate Acta Crystallographica Section E, 2010, 66, m729-m730 |
| 2227006 | CIF HKL Paper | C10 H20 N2 O8 | P 1 n 1 | 9.2055; 6.8314; 11.2443 90; 112.047; 90 | 655.41 | Liu, Ling-Li Piperazine-1,4-diium 2-(carboxymethyl)-2-hydroxybutanedioate monohydrate Acta Crystallographica Section E, 2010, 66, o2191 |
| 2227419 | CIF HKL Paper | C10 H8 Br4 N2 Pt | P 1 n 1 | 8.3146; 6.901; 12.5873 90; 102.94; 90 | 703.91 | Ha, Kwang (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')tetrabromidoplatinum(IV) Acta Crystallographica Section E, 2010, 66, m1213 |
| 2229903 | CIF HKL Paper | C37 H56 Ag Cl3 O4 P2 | P 1 n 1 | 9.591; 13.4369; 15.129 90; 94.706; 90 | 1943.15 | Munyaneza, Apollinaire; Meijboom, Reinout; Omondi, Bernard Bis[dicyclohexyl(phenyl)phosphane-κ<i>P</i>]silver(I) perchlorate dichloromethane monosolvate Acta Crystallographica Section E, 2011, 67, m483-m484 |
| 2230917 | CIF HKL Paper | C88 H56 N8 Nb2 O3 | P 1 n 1 | 14.4823; 18.4007; 14.6257 90; 117.823; 90 | 3446.9 | Soury, Raoudha; Belkhiria, Mohamed Salah; Daran, Jean-Claude; Nasri, Habib Tri-μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)niobium(V)] Acta Crystallographica Section E, 2011, 67, m862-m863 |
| 2233527 | CIF HKL Paper | C17 H28 Co N5 O4 | P 1 n 1 | 8.365; 10.408; 11.487 90; 91.768; 90 | 999.6 | Kumar, Sarvendra; Thapa, Suresh Butylbis(dimethylglyoximato-κ^2^<i>N</i>,<i>N</i>')(pyridine-κ<i>N</i>)cobalt(III) Acta Crystallographica Section E, 2012, 68, m156-m157 |
| 2233753 | CIF HKL Paper | C16 H11 Br O | P 1 n 1 | 6.1359; 4.7512; 21.31 90; 96.195; 90 | 617.62 | Asiri, Abdullah M.; Faidallah, Hassan M.; Al-Nemari, Khulud F.; Ng, Seik Weng; Tiekink, Edward R. T. (2<i>E</i>)-2-(4-Bromobenzylidene)-2,3-dihydro-1<i>H</i>-inden-1-one Acta Crystallographica Section E, 2012, 68, o755 |
| 2233890 | CIF HKL Paper | C4 O S5 | P 1 n 1 | 3.9638; 11.0211; 8.711 90; 101.344; 90 | 373.11 | Wen, Hua-Wen; Fan, Li-Xia; Liu, Li; Li, Ao; Fang, Qi 5-Sulfanylidene-2<i>H</i>,5<i>H</i>-1,3-dithiolo[4,5-<i>d</i>][1,3]dithiol-2-one Acta Crystallographica Section E, 2012, 68, o721 |
| 2235586 | CIF HKL Paper | C14 H24 N2 Ni O12 | P 1 n 1 | 10.998; 7.4536; 12.271 90; 95.86; 90 | 1000.7 | Wang, Huan-Huan; Duan, Guang-He; Wang, Lin; Xie, Ya-Bo Tetraaqua{5-[(pyridin-2-ylmethylidene)amino]benzene-1,3-dicarboxylato-κ^2^<i>N</i>,<i>N</i>'}nickel(II) tetrahydrate Acta Crystallographica Section E, 2012, 68, m964 |
| 2235800 | CIF HKL Paper | C14 H21 N3 O6 | P 1 n 1 | 7.8393; 9.7462; 10.9147 90; 103.251; 90 | 811.72 | Loos, Stefan; Seichter, Wilhelm; Weber, Edwin; Mertens, Florian 2-Aminoterephthalic acid <i>N</i>,<i>N</i>-dimethylformamide disolvate Acta Crystallographica Section E, 2012, 68, o2501 |
| 2236858 | CIF HKL Paper | C15 H18 N O3 P | P 1 n 1 | 8.4432; 5.303; 16.3443 90; 90.453; 90 | 731.78 | Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Nečas, Marek; Babiak, Michal Diphenyl (isopropylamido)phosphate Acta Crystallographica Section E, 2012, 68, o3459 |
| 2238632 | CIF Paper | C26 H35 Cl2 N O8 | P 1 n 1 | 11.1738; 9.39846; 13.6046 90; 105.109; 90 | 1379.32 | Kaur, Manpreet; Jasinski, Jerry P.; Butcher, Ray J.; Yathirajan, H. S.; Byrappa, K. Desvenlafaxinium chloranilate ethyl acetate solvate Acta Crystallographica Section E, 2013, 69, o1556-o1557 |
| 2238741 | CIF Paper | C14 H18 N4 | P 1 n 1 | 7.563; 6.5593; 13.2319 90; 100.072; 90 | 646.29 | Kavitha, Channappa N.; Jasinski, Jerry P.; Anderson, Brian J.; Yathirajan, H. S.; Kaur, Manpreet <i>N</i>-(1<i>H</i>-Indol-3-ylmethylidene)-4-methylpiperazin-1-amine Acta Crystallographica Section E, 2013, 69, o1706 |
| 2239008 | CIF HKL Paper | C24 H17 Br N2 O5 S | P 1 n 1 | 10.1823; 8.0932; 13.8111 90; 102.749; 90 | 1110.08 | Kanchanadevi, J.; Anbalagan, G.; Saravanan, V.; Mohanakrishnan, A. K.; Gunasekaran, B.; Manivannan, V. (<i>E</i>)-2-Bromo-1-[2-(2-nitrostyryl)-1-phenylsulfonyl-1<i>H</i>-indol-3-yl]ethanone Acta Crystallographica Section E, 2014, 70, o149 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

