Crystallography Open Database
Search results
Result: there are 466 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 journal of publication like 'Acta Crystallographica Section E' volume of publication is 76
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
---|---|---|---|---|---|---|
2243308 | CIF HKL Paper | C11 H16 N2 O | P n a 21 | 6.9683; 7.9683; 18.975 90; 90; 90 | 1053.6 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts Acta Crystallographica Section E, 2020, 76, 488-495 |
2243309 | CIF HKL Paper | C18 H20 N4 O7 | P -1 | 7.4365; 10.6276; 13.27 92.238; 97.057; 108.618 | 982.92 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts Acta Crystallographica Section E, 2020, 76, 488-495 |
2243310 | CIF HKL Paper | C17 H19 N5 O8 | P 1 21/n 1 | 8.7568; 6.6292; 34.024 90; 96.987; 90 | 1960.4 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts Acta Crystallographica Section E, 2020, 76, 488-495 |
2243311 | CIF HKL Paper | C18 H25 N3 O4 | P -1 | 6.259; 7.4549; 19.269 83.28; 84.74; 85.38 | 886.94 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts Acta Crystallographica Section E, 2020, 76, 488-495 |
2243312 | CIF HKL Paper | C7 H11 Cl3 N4 O3 Zn | P 1 21/c 1 | 8.0932; 13.744; 12.429 90; 92.29; 90 | 1381.4 | El Hamdani, Hicham; El Amane, Mohamed; Saadi, Mohamed; El Ammari, Lahcen Crystal structure and Hirshfeld surface analysis of (C~7~H~9~N~4~O~2~)[ZnCl~3~(H~2~O)] Acta Crystallographica Section E, 2020, 76, 506-509 |
2243313 | CIF HKL Paper | C14 H36 Cl4 Cr2 N4 O6 | P -1 | 7.061; 8.674; 10.775 77.61; 88.2; 79.39 | 633.5 | Moon, Dohyun; Choi, Jong-Ha Crystal structure of 1,4,8,11-tetramethyl-1,4,8,11-tetraazoniacyclotetradecane bis[chloridochromate(VI)] dichloride from synchrotron X-ray data Acta Crystallographica Section E, 2020, 76, 523-526 |
2243314 | CIF HKL | C6 H17 Mo2 N O12 | P 1 21 1 | 8.1775; 6.7722; 12.305 90; 99.664; 90 | 671.8 | Mirzaei, Masoud; Tahmasebi, Morteza; Mague, Joel T. A redetermination of the crystal structure of the mannitol complex NH~4~[Mo~2~O~5~(C~6~H~11~O~6~)]·H~2~O: hydrogen-bonding scheme and Hirshfeld surface analysis Acta Crystallographica Section E, 2020, 76, 518-522 |
2243315 | CIF HKL Paper | C16 H22 N2 O3 | C 1 2/c 1 | 19.77; 9.477; 17.62 90; 105.78; 90 | 3177 | Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R. Bis(4-hydroxy-<i>N</i>-isopropyl-<i>N</i>-methyltryptammonium) fumarate: a new crystalline form of miprocin Acta Crystallographica Section E, 2020, 76, 514-517 |
2243316 | CIF HKL Paper | C22 H24 F2 N4 Ni O9 | C 1 2/c 1 | 12.1175; 18.7705; 12.3246 90; 110.232; 90 | 2630.29 | Politeo, Nives; Pisačić, Mateja; Daković, Marijana; Sokol, Vesna; Kukovec, Boris-Marko The first coordination compound of 6-fluoronicotinate: the crystal structure of a one-dimensional nickel(II) coordination polymer containing the mixed ligands 6-fluoronicotinate and 4,4'-bipyridine Acta Crystallographica Section E, 2020, 76, 500-505 |
2243317 | CIF HKL Paper | C8 H8 N2 S2 | P 1 21/n 1 | 4.1027; 12.1789; 8.1014 90; 95.78; 90 | 402.74 | Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine Acta Crystallographica Section E, 2020, 76, 539-546 |
2243318 | CIF HKL Paper | C12 H16 N2 S4 | C 1 2/c 1 | 21.1618; 7.0585; 9.5057 90; 94.47; 90 | 1415.55 | Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine Acta Crystallographica Section E, 2020, 76, 539-546 |
2243319 | CIF HKL Paper | C8 H8 Ag N3 O3 S2 | P 1 2/n 1 | 3.8995; 6.3902; 20.5741 90; 93.121; 90 | 511.92 | Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine Acta Crystallographica Section E, 2020, 76, 539-546 |
2243320 | CIF HKL Paper | C12 H16 Ag N3 O3 S4 | P 1 21/c 1 | 7.0777; 12.0654; 19.5725 90; 90.446; 90 | 1671.3 | Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine Acta Crystallographica Section E, 2020, 76, 539-546 |
2243321 | CIF HKL Paper | C13 H16 Cl N O | P -1 | 6.6286; 8.1569; 12.0061 96.803; 101.506; 98.511 | 621.73 | Srividya, J.; Reuben Jonathan, D.; Revathi, B. K.; Divya Bharathi, M.; Anbalagan, G. Crystal structure of (4-chlorophenyl)(4-methylpiperidin-1-yl)methanone Acta Crystallographica Section E, 2020, 76, 534-538 |
2243322 | CIF HKL | C15 H20 Mo N3 O3 P | P 1 21/c 1 | 9.7919; 14.5757; 12.114 90; 107.694; 90 | 1647.2 | Anstey, Mitchell R.; Bost, John L.; Grumman, Anna S.; Kennedy, Nicholas D.; Whited, Matthew T. Crystal structures of <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(1,3,5-triaza-7-phosphaadamantane)molybdenum(II) and <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(3,7-diacetyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane)molybdenum(II) Acta Crystallographica Section E, 2020, 76, 547-551 |
2243323 | CIF HKL | C18 H24 Mo N3 O5 P | P 1 21/n 1 | 12.8674; 11.6366; 14.4655 90; 113.224; 90 | 1990.45 | Anstey, Mitchell R.; Bost, John L.; Grumman, Anna S.; Kennedy, Nicholas D.; Whited, Matthew T. Crystal structures of <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(1,3,5-triaza-7-phosphaadamantane)molybdenum(II) and <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(3,7-diacetyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane)molybdenum(II) Acta Crystallographica Section E, 2020, 76, 547-551 |
2243324 | CIF HKL Paper | C11 H9 N3 O S | P 1 21/n 1 | 12.06; 4.4531; 19.9528 90; 102.228; 90 | 1047.24 | Mossine, Valeri V.; Kelley, Steven P.; Mawhinney, Thomas P. Intramolecular 1,5-S···N σ-hole interaction in (<i>E</i>)-<i>N</i>'-(pyridin-4-ylmethylidene)thiophene-2-carbohydrazide Acta Crystallographica Section E, 2020, 76, 557-561 |
2243325 | CIF HKL Paper | C5 H10 O3 S | P 1 21/c 1 | 16.094; 8.8747; 10.558 90; 105.654; 90 | 1452.1 | Mawhinney, Thomas P.; Li, Yiyi; Chance, Deborah L.; Kelley, Steven P.; Mossine, Valeri V. Crystal structure of (<i>R</i>,<i>S</i>)-2-hydroxy-4-(methylsulfanyl)butanoic acid Acta Crystallographica Section E, 2020, 76, 562-566 |
2243326 | CIF HKL Paper | C6 H11 B F4 N2 O2 S | P 1 21/n 1 | 8.1049; 11.6979; 12.081 90; 90.069; 90 | 1145.4 | Gelbrich, Thomas; Lampl, Martin; Laus, Gerhard; Kahlenberg, Volker; Huppertz, Hubert; Schottenberger, Herwig Synthesis and crystal structures of two 1,3-di(alkyloxy)-2-(methylsulfanyl)imidazolium tetrafluoridoborates Acta Crystallographica Section E, 2020, 76, 552-556 |
2243327 | CIF HKL Paper | C18 H19 B F4 N2 O2 S | P c 21 b | 7.9117; 11.476; 20.9659 90; 90; 90 | 1903.59 | Gelbrich, Thomas; Lampl, Martin; Laus, Gerhard; Kahlenberg, Volker; Huppertz, Hubert; Schottenberger, Herwig Synthesis and crystal structures of two 1,3-di(alkyloxy)-2-(methylsulfanyl)imidazolium tetrafluoridoborates Acta Crystallographica Section E, 2020, 76, 552-556 |
2243328 | CIF HKL Paper | C17 H12 O4 | P 1 21/n 1 | 4.2951; 16.7714; 18.0537 90; 95.941; 90 | 1293.51 | Zazouli, Sofia; Chigr, Mohammed; Jouaiti, Ahmed; Kyritsakas, Nathalie; Ketatni, El Mostafa Crystal structure and Hirshfeld surface analysis of 3,4-dihydro-2<i>H</i>-anthra[1,2-<i>b</i>][1,4]dioxepine-8,13-dione Acta Crystallographica Section E, 2020, 76, 576-580 |
2243329 | CIF HKL Paper | C9 H11 N3 O5 S | P -1 | 7.1676; 9.1175; 10.1554 66.174; 80.225; 71.803 | 576.01 | Kansiz, Sevgi; Faizi, Md. Serajul Haque; Aydin, Tansu Merve; Dege, Necmi; Icbudak, Hasan; Golenya, Irina A. Crystal structure and Hirshfeld surface analysis of 2-amino-3-hydroxypyridin-1-ium 6-methyl-2,2,4-trioxo-2<i>H</i>,4<i>H</i>-1,2,3-oxathiazin-3-ide Acta Crystallographica Section E, 2020, 76, 572-575 |
2243330 | CIF HKL Paper | C11 H14 N2 O | P 1 21/c 1 | 9.406; 8.8436; 12.144 90; 100.601; 90 | 992.9 | Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R. Norpsilocin: freebase and fumarate salt Acta Crystallographica Section E, 2020, 76, 589-593 |
2243331 | CIF HKL Paper | C13 H16 N2 O3 | P -1 | 7.7363; 9.7146; 9.7854 105.524; 110.554; 97.167 | 643.69 | Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R. Norpsilocin: freebase and fumarate salt Acta Crystallographica Section E, 2020, 76, 589-593 |
2243332 | CIF HKL Paper | C12 H13 N O3 S | P 1 21/n 1 | 8.3252; 17.1485; 9.3505 90; 116.249; 90 | 1197.26 | Agnimonhan, Finagnon Hyacinthe; Bendeif, El-Eulmi; Akanni, Léon Ahoussi; Gbaguidi, Ahokannou Fernand; Martin, Eddy; Wenger, Emmanuel; Lecomte, Claude Crystal structure of a new phenyl(morpholino)methanethione derivative: 4-[(morpholin-4-yl)carbothioyl]benzoic acid Acta Crystallographica Section E, 2020, 76, 581-584 |
2243333 | CIF HKL Paper | C32 H37 N O4 | P 1 21/n 1 | 10.578; 18.419; 14.398 90; 108.791; 90 | 2655.73 | Suresh Babu, N.; Sughanya, V.; Dhandapani, A.; Kalaivanan, R. Crystal structure, Hirshfeld surface and frontier molecular orbital analysis of 10-benzyl-9-(3-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione Acta Crystallographica Section E, 2020, 76, 585-588 |
2243334 | CIF HKL Paper | C9 H10 Cl N O S | P b c a | 9.6659; 14.0682; 14.4869 90; 90; 90 | 1970 | Mongkholkeaw, Sitthichok; Songsasen, Apisit; Duangthongyou, Tanwawan; Chainok, Kittipong; Suramitr, Songwut; Wattanathana, Worawat; Wannalerse, Boontana Crystal structure, Hirshfeld surface analysis and computational study of 2-chloro-<i>N</i>-[4-(methylsulfanyl)phenyl]acetamide Acta Crystallographica Section E, 2020, 76, 594-598 |
2243335 | CIF HKL Paper | C31 H29 Ga N4 O3 | P 1 21/c 1 | 13.359; 20.413; 9.747 90; 98.326; 90 | 2630 | Ventura, Dominic L.; Brennessel, William W.; Durfee, William S. Crystal structures of {1,1,1-tris[(salicylaldimino)methyl]ethane}gallium as both a pyridine solvate and an acetonitrile 0.75-solvate and {1,1,1-tris[(salicylaldimino)methyl]ethane}indium dichloromethane solvate Acta Crystallographica Section E, 2020, 76, 615-620 |
2243336 | CIF HKL Paper | C27.5 H26.25 Ga N3.75 O3 | P -1 | 10.9053; 14.1157; 16.2324 93.915; 103.12; 97.6 | 2399.6 | Ventura, Dominic L.; Brennessel, William W.; Durfee, William S. Crystal structures of {1,1,1-tris[(salicylaldimino)methyl]ethane}gallium as both a pyridine solvate and an acetonitrile 0.75-solvate and {1,1,1-tris[(salicylaldimino)methyl]ethane}indium dichloromethane solvate Acta Crystallographica Section E, 2020, 76, 615-620 |
2243337 | CIF HKL Paper | C27 H26 Cl2 In N3 O3 | P 1 21/c 1 | 10.0704; 16.2514; 16.1749 90; 99.13; 90 | 2613.62 | Ventura, Dominic L.; Brennessel, William W.; Durfee, William S. Crystal structures of {1,1,1-tris[(salicylaldimino)methyl]ethane}gallium as both a pyridine solvate and an acetonitrile 0.75-solvate and {1,1,1-tris[(salicylaldimino)methyl]ethane}indium dichloromethane solvate Acta Crystallographica Section E, 2020, 76, 615-620 |
2243338 | CIF HKL Paper | C18 H16 N2 O2 | P b c a | 12.7245; 9.5887; 23.7276 90; 90; 90 | 2895 | Daouda, Ballo; Tuo, Nanou Tiéba; Hökelek, Tuncer; Niameke Jean-Baptiste, Kangah; Charles Guillaume, Kodjo; Claude, Kablan Ahmont Landry; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 2-(2,3-dihydro-1<i>H</i>-perimidin-2-yl)-6-methoxyphenol Acta Crystallographica Section E, 2020, 76, 605-610 |
2243339 | CIF HKL | C18 H28 I Ir N4 | C 1 2/m 1 | 26.6519; 8.307; 9.7852 90; 100.241; 90 | 2131.9 | Bernier, Chad M.; DuChane, Christine M.; Merola, Joseph S. Crystal structures of (η^4^-cycloocta-1,5-diene)bis(1,3-dimethylimidazol-2-ylidene)iridium(I) iodide and (η^4^-cycloocta-1,5-diene)bis(1,3-diethylimidazol-2-ylidene)iridium(I) iodide Acta Crystallographica Section E, 2020, 76, 611-614 |
2243340 | CIF HKL | C22 H36 I Ir N4 | P c c n | 10.6041; 12.3058; 18.2513 90; 90; 90 | 2381.65 | Bernier, Chad M.; DuChane, Christine M.; Merola, Joseph S. Crystal structures of (η^4^-cycloocta-1,5-diene)bis(1,3-dimethylimidazol-2-ylidene)iridium(I) iodide and (η^4^-cycloocta-1,5-diene)bis(1,3-diethylimidazol-2-ylidene)iridium(I) iodide Acta Crystallographica Section E, 2020, 76, 611-614 |
2243341 | CIF HKL Paper | C14 H9 I2 N | C 1 2/c 1 | 24.292; 4.8348; 24.8761 90; 116.272; 90 | 2619.8 | Cui, Yu-Jin; Su, Feng; Jin, Wei-Jun Structural and luminescent properties of co-crystals of tetraiodoethylene with two azaphenanthrenes Acta Crystallographica Section E, 2020, 76, 438-442 |
2243342 | CIF HKL | C14 H9 I2 N | P -1 | 7.3179; 8.1089; 11.3252 97.05; 92.059; 95.579 | 663.02 | Cui, Yu-Jin; Su, Feng; Jin, Wei-Jun Structural and luminescent properties of co-crystals of tetraiodoethylene with two azaphenanthrenes Acta Crystallographica Section E, 2020, 76, 438-442 |
2243343 | CIF HKL Paper | C18 H18 Cl N3 O2 S | P 1 21/a 1 | 8.9995; 16.7778; 12.3595 90; 98.892; 90 | 1843.8 | Rao, H. Surya Prakash; Gunasundari, Ramalingam; Muthukumaran, Jayaraman Crystal structure analysis of ethyl 3-(4-chlorophenyl)-1,6-dimethyl-4-methylsulfanyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine-5-carboxylate Acta Crystallographica Section E, 2020, 76, 443-445 |
2243344 | CIF HKL Paper | C19 H16 N2 O3 | P 1 21/n 1 | 10.55; 9.3679; 16.5606 90; 93.886; 90 | 1632.9 | Daoui, Said; Baydere, Cemile; Chelfi, Tarik; El Kalai, Fouad; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine Polymorphism of 2-(5-benzyl-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl)acetic acid with two monoclinic modifications: crystal structures and Hirshfeld surface analyses Acta Crystallographica Section E, 2020, 76, 432-437 |
2243345 | CIF HKL Paper | C19 H16 N2 O3 | P 1 21/c 1 | 10.5976; 15.55; 10.3731 90; 109.12; 90 | 1615.11 | Daoui, Said; Baydere, Cemile; Chelfi, Tarik; El Kalai, Fouad; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine Polymorphism of 2-(5-benzyl-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl)acetic acid with two monoclinic modifications: crystal structures and Hirshfeld surface analyses Acta Crystallographica Section E, 2020, 76, 432-437 |
2243346 | CIF HKL Paper | C22 H48 N4 Ni O5 Si2 | P 1 21/c 1 | 13.033; 12.877; 9.028 90; 101.31; 90 | 1485.7 | Gavrish, Sergey P.; Shova, Sergiu; Cazacu, Maria; Dascalu, Mihaela; Lampeka, Yaroslaw D. Syntheses and crystal structures of the one-dimensional coordination polymers formed by [Ni(cyclam)]^2+^ cations and 1,3-bis(3-carboxypropyl)tetramethyldisiloxane anions in different degrees of deprotonation Acta Crystallographica Section E, 2020, 76, 446-451 |
2243347 | CIF HKL Paper | C22 H49 Cl N4 Ni O9 Si2 | P -1 | 9.3815; 12.9009; 14.7604 99.309; 100.343; 99.232 | 1700.9 | Gavrish, Sergey P.; Shova, Sergiu; Cazacu, Maria; Dascalu, Mihaela; Lampeka, Yaroslaw D. Syntheses and crystal structures of the one-dimensional coordination polymers formed by [Ni(cyclam)]^2+^ cations and 1,3-bis(3-carboxypropyl)tetramethyldisiloxane anions in different degrees of deprotonation Acta Crystallographica Section E, 2020, 76, 446-451 |
2243348 | CIF HKL Paper | C98 H126 Ir N3 O3 | P -1 | 16.488; 17.0003; 17.0288 91.9252; 97.8137; 117.349 | 4175.2 | M'hamedi, Ahmed; Batsanov, Andrei S. Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants Acta Crystallographica Section E, 2020, 76, 392-399 |
2243349 | CIF HKL Paper | C121.5 H143.6 Cl2 F4 Ir2 N4 | P -1 | 12.2744; 17.6132; 25.3966 105.119; 93.787; 90.779 | 5286.2 | M'hamedi, Ahmed; Batsanov, Andrei S. Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants Acta Crystallographica Section E, 2020, 76, 392-399 |
2243350 | CIF HKL Paper | C131 H164 Ir2 N6 O6 | P 1 21/c 1 | 38.976; 21.615; 28.759 90; 108.92; 90 | 22919 | M'hamedi, Ahmed; Batsanov, Andrei S. Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants Acta Crystallographica Section E, 2020, 76, 392-399 |
2243351 | CIF HKL Paper | C113.8 H94.3 Cl2.3 F12 Ir2 N6 O2 | P -1 | 11.8734; 14.2267; 16.6076 110.386; 106.524; 96.303 | 2452 | M'hamedi, Ahmed; Batsanov, Andrei S. Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants Acta Crystallographica Section E, 2020, 76, 392-399 |
2243352 | CIF HKL Paper | C19 H16 Cl N O3 S | P 1 21/c 1 | 11.6882; 9.0903; 16.9533 90; 105.105; 90 | 1739.04 | Sebbar, Ghizlane; Mohamed, Ellouz; Hökelek, Tuncer; Mague, Joel T.; Sebbar, Nada Kheira; Essassi, El Mokhtar; Belkadi, Bouchra Crystal structure, Hirshfeld surface analysis and interaction energy, DFT and antibacterial activity studies of ethyl 2-[(2<i>Z</i>)-2-(2-chlorobenzylidene)-3-oxo-3,4-dihydro-2<i>H</i>-1,4-benzothiazin-4-yl]acetate Acta Crystallographica Section E, 2020, 76, 629-636 |
2243353 | CIF HKL Paper | C22 H31 N O3 | P 1 21/c 1 | 17.6928; 13.2512; 8.5916 90; 90.184; 90 | 2014.3 | Bouzian, Younos; Kansiz, Sevgi; Mahi, Lhassane; Ahabchane, Noureddine Hamou; Mague, Joel T.; Dege, Necmi; Karrouchi, Khalid; Essassi, El Mokhtar Crystal structure and Hirshfeld surface analysis of hexyl 1-hexyl-2-oxo-1,2-dihydroquinoline-4-carboxylate Acta Crystallographica Section E, 2020, 76, 642-645 |
2243354 | CIF HKL Paper | C18 H21 N O3 | P 1 21/c 1 | 11.4982; 5.0086; 26.724 90; 97.683; 90 | 1525.22 | Ezawa, Toshinari; Inoue, Yutaka; Murata, Isamu; Suzuki, Mitsuaki; Takao, Koichi; Sugita, Yoshiaki; Kanamoto, Ikuo Syntheses and crystal structures of two piperine derivatives Acta Crystallographica Section E, 2020, 76, 646-650 |
2243355 | CIF HKL Paper | C16 H17 N O3 | P b c a | 11.8747; 7.2485; 30.392 90; 90; 90 | 2616 | Ezawa, Toshinari; Inoue, Yutaka; Murata, Isamu; Suzuki, Mitsuaki; Takao, Koichi; Sugita, Yoshiaki; Kanamoto, Ikuo Syntheses and crystal structures of two piperine derivatives Acta Crystallographica Section E, 2020, 76, 646-650 |
2243356 | CIF HKL Paper | C21 H23 F2 N O | P 1 21/c 1 | 5.4945; 25.0707; 12.9811 90; 93.497; 90 | 1784.83 | Anitha, K.; Sivakumar, S.; Arulraj, R.; Rajkumar, K.; Kaur, Manpreet; Jasinski, Jerry P. Synthesis, crystal structure, DFT calculations and Hirshfeld surface analysis of 3-butyl-2,6-bis(4-fluorophenyl)piperidin-4-one Acta Crystallographica Section E, 2020, 76, 651-655 |
2243357 | CIF HKL Paper | C14 H17 N3 O3 | P 1 21/c 1 | 12.9328; 11.2551; 9.8092 90; 106.245; 90 | 1370.82 | Sylla-Gueye, Rokhaya; Thiam, Ibrahima Elhadji; Orton, James; Coles, Simon; Gaye, Mohamed Crystal structure of <i>N</i>'-[4-(dimethylamino)benzylidene]furan-2-carbohydrazide monohydrate Acta Crystallographica Section E, 2020, 76, 660-663 |
2243358 | CIF HKL Paper | C18 H16 N2 O3 S | P 1 21/n 1 | 11.8865; 5.1298; 28.2942 90; 93.667; 90 | 1721.72 | Nguyen Tien, Cong; Nguyen Tan, Quang; Pham Duc, Dung; Tran Hoang, Phuong; Nguyen Dang, Dat; Truong Minh, Luong; Van Meervelt, Luc Synthesis and structure of ethyl 2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate Acta Crystallographica Section E, 2020, 76, 668-672 |
2243359 | CIF HKL Paper | C24 H30 Br2 N4 O2 | P -1 | 6.3291; 9.8911; 21.133 76.48; 84.965; 73.891 | 1235.4 | Jabri, Zainab; Jarmoni, Karim; Hökelek, Tuncer; Mague, Joel T.; Sabir, Safia; Kandri Rodi, Youssef; Misbahi, Khalid Crystal structure, Hirshfeld surface analysis and DFT studies of 6-bromo-3-(12-bromododecyl)-2-(4-nitrophenyl)-4<i>H</i>-imidazo[4,5-<i>b</i>]pyridine Acta Crystallographica Section E, 2020, 76, 677-682 |
2243360 | CIF HKL Paper | C17 H16 N2 O3 S | P -1 | 7.9782; 8.1711; 12.6661 92.214; 93.423; 114.274 | 749.55 | Izuogu, David Chukwuma; Asegbeloyin, Jonnie Niyi; Jotani, Mukesh M.; Tiekink, Edward R. T. 2-[(2,4,6-Trimethylbenzene)sulfonyl]phthalazin-1(2<i>H</i>)-one: crystal structure, Hirshfeld surface analysis and computational study Acta Crystallographica Section E, 2020, 76, 697-702 |
2243361 | CIF HKL Paper | C23 H22 B N O2 | P c a 21 | 17.854; 11.5361; 18.5366 90; 90; 90 | 3817.9 | Gubler, Joël; Chen, Peter Structure of a push‒pull olefin prepared by ynamine hydroboration with a borandiol ester Acta Crystallographica Section E, 2020, 76, 710-714 |
2243362 | CIF HKL Paper | C44 H52 N8 Na4 O4 | P -1 | 10.9545; 11.8785; 18.8415 105.266; 97.446; 106.12 | 2217.2 | Gajecki, Leah; Twamley, Brendan; Berg, David J. Synthesis and crystal structures of tetrameric [2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]sodium and tris[2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]ytterbium(III) Acta Crystallographica Section E, 2020, 76, 703-709 |
2243363 | CIF HKL Paper | C33 H39 N6 O3 Yb | P 1 21/n 1 | 10.9428; 9.8253; 28.6089 90; 94.722; 90 | 3065.5 | Gajecki, Leah; Twamley, Brendan; Berg, David J. Synthesis and crystal structures of tetrameric [2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]sodium and tris[2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]ytterbium(III) Acta Crystallographica Section E, 2020, 76, 703-709 |
2243364 | CIF HKL Paper | C28 H21 Cl N2 O3 | P -1 | 9.909; 10.193; 12.024 90.94; 106.27; 92.75 | 1163.9 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples Acta Crystallographica Section E, 2020, 76, 683-691 |
2243365 | CIF HKL Paper | C28 H21 Cl N2 O3 | P -1 | 8.9959; 9.738; 13.637 95.901; 94.122; 95.959 | 1177.8 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples Acta Crystallographica Section E, 2020, 76, 683-691 |
2243366 | CIF HKL Paper | C32 H24 N2 O3 | P -1 | 8.8615; 10.4973; 13.6588 79.006; 89.412; 80.971 | 1231.54 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples Acta Crystallographica Section E, 2020, 76, 683-691 |
2243367 | CIF HKL Paper | C26 H21 N5 O2 | P -1 | 9.8432; 11.7441; 12.3005 114.12; 111.139; 96.537 | 1152.06 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples Acta Crystallographica Section E, 2020, 76, 683-691 |
2243368 | CIF HKL Paper | C25 H17 Cl2 N5 O2 | C 1 2/c 1 | 28.1916; 8.0537; 22.0446 90; 109.07; 90 | 4730.5 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples Acta Crystallographica Section E, 2020, 76, 683-691 |
2243369 | CIF HKL Paper | C29 H21 N5 O2 | P 1 21/n 1 | 9.846; 22.4303; 11.049 90; 104.157; 90 | 2366 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples Acta Crystallographica Section E, 2020, 76, 683-691 |
2243370 | CIF HKL Paper | C25 H20 O2 | P 1 21/n 1 | 10.2365; 9.7989; 19.3759 90; 103.333; 90 | 1891.14 | Naghiyev, Farid N.; Akkurt, Mehmet; Askerov, Rizvan K.; Mamedov, Ibrahim G.; Rzayev, Rovnag M.; Chyrka, Taras; Maharramov, Abel M. Crystal structure and Hirshfeld surface analysis of 6-benzoyl-3,5-diphenylcyclohex-2-en-1-one Acta Crystallographica Section E, 2020, 76, 720-723 |
2243371 | CIF HKL Paper | C25 H24 N2 O3 | P 1 21/n 1 | 10.6878; 8.9088; 21.9503 90; 99.049; 90 | 2064 | Ahmed, Adeeba; Ahmad, Aiman; Ahmad, Musheer; Kalibabchuk, Valentina A. Crystal structure and Hirshfeld surface analysis of 4-{[(anthracen-9-yl)methyl]amino}benzoic acid dimethylformamide monosolvate Acta Crystallographica Section E, 2020, 76, 728-731 |
2243372 | CIF HKL Paper | C22 H15 F6 N O4 | P 1 21/c 1 | 25.5453; 13.4125; 11.8879 90; 91.644; 90 | 4071.4 | Sugiyama, Haruki Hydrogen-bonding patterns in 2,2-bis(4-methylphenyl)hexafluoropropane pyridinium and ethylenediammonium salt crystals Acta Crystallographica Section E, 2020, 76, 742-746 |
2243373 | CIF HKL Paper | C19 H20 F6 N2 O5 | P b c a | 13.2518; 12.1773; 25.8419 90; 90; 90 | 4170.14 | Sugiyama, Haruki Hydrogen-bonding patterns in 2,2-bis(4-methylphenyl)hexafluoropropane pyridinium and ethylenediammonium salt crystals Acta Crystallographica Section E, 2020, 76, 742-746 |
2243374 | CIF HKL Paper | C28 H20 N2 O2 | P 1 21/n 1 | 9.4693; 8.7384; 24.5049 90; 91.792; 90 | 2026.7 | Ahmed, Ruby; Doğan, Onur Erman; Ali, Farman; Ahmad, Musheer; Ahmed, Adeeba; Dege, Necmi; Golenia, Irina A. Crystal structure and Hirshfeld surface analysis of 2-phenyl-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazol-3-ium benzoate Acta Crystallographica Section E, 2020, 76, 724-727 |
2243375 | CIF HKL | C23 H28 F3 N O | P 1 21/c 1 | 15.6783; 15.788; 8.7054 90; 91.217; 90 | 2154.4 | Kan Kaynar, Nihal; Tanak, Hasan; Macit, Mustafa; Özdemir, Namık Crystal structure and DFT computational studies of (<i>E</i>)-2,4-di-<i>tert</i>-butyl-6-{[3-(trifluoromethyl)benzyl]iminomethyl}phenol Acta Crystallographica Section E, 2020, 76, 732-735 |
2243376 | CIF HKL Paper | C35 H34 Cl Co N3 P S4 | P -1 | 9.0954; 13.4319; 14.7905 97.074; 94.68; 107.354 | 1698.1 | Williams, DaShawn; Brannon, Jacob P.; Chandrasekaran, Perumalreddy; Stieber, S. Chantal E. A five-coordinate cobalt bis(dithiolene)‒phosphine complex [Co(pdt)~2~(PTA)] (pdt = phenyldithiolene; PTA = 1,3,5-triaza-7-phosphaadamantane) Acta Crystallographica Section E, 2020, 76, 736-741 |
2243377 | CIF HKL Paper | C43 H55 Cu5 Mn N9 O19 | P 1 21/n 1 | 19.0669; 14.2943; 19.345 90; 95.1476; 90 | 5251.2 | Van Trieste III, Gerard P.; Zeller, Matthias; Zaleski, Curtis M. Synthesis and crystal structure of a pentacopper(II) 12-metallacrown-4: <i>cis</i>-diaquatetrakis(dimethylformamide-κ<i>O</i>)manganese(II) tetrakis(μ~3~-<i>N</i>,2-dioxidobenzene-1-carboximidate)pentacopper(II) dimethylformamide monosolvate Acta Crystallographica Section E, 2020, 76, 747-751 |
2243378 | CIF HKL Paper | C19 H17 Cl N4 O2 | P 1 21/n 1 | 10.5673; 8.0182; 21.2318 90; 95.282; 90 | 1791.35 | Pokhodylo, Nazariy; Slyvka, Yurii; Pavlyuk, Volodymyr Synthesis, crystal structure and Hirshfeld surface analysis of <i>N</i>-(4-chlorophenyl)-5-cyclopropyl-1-(4-methoxyphenyl)-1<i>H</i>-1,2,3-triazole-4-carboxamide Acta Crystallographica Section E, 2020, 76, 756-760 |
2243379 | CIF HKL Paper | C9 H9 N O4 | P 21 21 21 | 4.9279; 10.635; 15.8788 90; 90; 90 | 832.18 | Greene, John; Kopplin, Noa; Roireau, Jack; Bezpalko, Mark; Kassel, Scott; Giuliano, Michael W.; Giuliano, Robert Synthesis and crystal structure of (2<i>S</i>,4a<i>R</i>,8a<i>R</i>)-6-oxo-2,4a,6,8a-tetrahydropyrano[3,2-<i>b</i>]pyran-2-carboxamide Acta Crystallographica Section E, 2020, 76, 761-764 |
2243380 | CIF HKL Paper | C7 H12 F5 N6 O V | P 1 21/n 1 | 6.5915; 12.1969; 15.5669 90; 97.617; 90 | 1240.47 | Senchyk, Ganna A.; Lysenko, Andrey B.; Krautscheid, Harald; Domasevitch, Kostiantyn V. Crystal structure and Hirshfeld surface analysis of 4,4'-(propane-1,3-diyl)bis(4<i>H</i>-1,2,4-triazol-1-ium) pentafluoridooxidovanadate(V) Acta Crystallographica Section E, 2020, 76, 780-784 |
2243381 | CIF HKL Paper | C24 H18 N6 O3 | P 1 21/n 1 | 8.2807; 14.1554; 17.502 90; 98.92; 90 | 2026.71 | Senior, Levi; Linden, Anthony The missing crystal structure in the series of <i>N</i>,<i>N</i>',<i>N</i>''-tris(pyridin-2-yl)benzene-1,3,5-tricarboxamides: the 2-pyridinyl derivative Acta Crystallographica Section E, 2020, 76, 776-779 |
2243382 | CIF HKL Paper | C14 H16 Cl4 Cu2 N4 | P -1 | 7.7054; 7.724; 8.5606 103.659; 98.803; 110.273 | 448.74 | Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Melnyk, Andrii K.; Skelton, Brian W. Crystal structure and characterization of a new copper(II) chloride dimer with methyl(pyridin-2-ylmethylidene)amine Acta Crystallographica Section E, 2020, 76, 790-793 |
2243383 | CIF HKL Paper | C17 H14 N2 O | P 1 21/c 1 | 9.071; 12.0526; 24.612 90; 95.999; 90 | 2676.1 | Daouda, Ballo; Tuo, Nanou Tiéba; Kangah, Niameke Jean-Baptiste; Hökelek, Tuncer; Kodjo, Charles Guillaume; Retailleau, Pascal; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and DFT studies of 2-(2,3-dihydro-1<i>H</i>-perimidin-2-yl)phenol Acta Crystallographica Section E, 2020, 76, 798-802 |
2243384 | CIF HKL Paper | C14 H16 | P 1 21/c 1 | 11.3214; 6.7426; 14.9478 90; 107.234; 90 | 1089.82 | Domasevitch, Kostiantyn V.; Degtyarenko, Anna S. Crystal structure and Hirshfeld surface analysis of 1,3-diethynyladamantane Acta Crystallographica Section E, 2020, 76, 807-810 |
2243385 | CIF HKL | C17 H27 N O2 | P 1 21/c 1 | 6.8817; 28.249; 8.1369 90; 99.649; 90 | 1559.4 | Tiouabi, Mustapha; Tabacchi, Raphaël; Stoeckli-Evans, Helen The crystal structure and Hirshfeld surface analysis of 1-(2,5-dimethoxyphenyl)-2,2,6,6-tetramethylpiperidine Acta Crystallographica Section E, 2020, 76, 794-797 |
2243386 | CIF HKL Paper | C16 H14 Cl2 F N3 | P 21 21 21 | 6.073; 15.9782; 16.386 90; 90; 90 | 1590.03 | Özkaraca, Kadriye; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Suleymanova, Gulnar T.; Shikhaliyeva, Irada M.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of 4-{2,2-dichloro-1-[(<i>E</i>)-(4-fluorophenyl)diazenyl]ethenyl}-<i>N</i>,<i>N</i>-dimethylaniline Acta Crystallographica Section E, 2020, 76, 811-815 |
2243387 | CIF HKL Paper | C18 H22 N2 O4 S | P 1 21 1 | 4.7274; 17.782; 10.734 90; 98.994; 90 | 891.23 | Gelbrich, Thomas; Kahlenberg, Volker; Adamer, Verena; Nerdinger, Sven; Griesser, Ulrich J. Febuxostat ethanol monosolvate Acta Crystallographica Section E, 2020, 76, 816-819 |
2243388 | CIF HKL Paper | C15 H19 N O5 V | C 1 2/c 1 | 7.882; 15.2092; 13.9871 90; 103.367; 90 | 1631.33 | Rood, Jeffrey A.; Reehl, Steven R.; Jacoby, Kaitlyn A.; Oliver, Allen Crystal structures of a series of bis(acetylacetonato)oxovanadium(IV) complexes containing N-donor pyridyl ligands Acta Crystallographica Section E, 2020, 76, 826-830 |
2243389 | CIF HKL Paper | C16 H18 N2 O5 V | C 1 2/c 1 | 9.193; 13.508; 13.3651 90; 99.03; 90 | 1639.1 | Rood, Jeffrey A.; Reehl, Steven R.; Jacoby, Kaitlyn A.; Oliver, Allen Crystal structures of a series of bis(acetylacetonato)oxovanadium(IV) complexes containing N-donor pyridyl ligands Acta Crystallographica Section E, 2020, 76, 826-830 |
2243390 | CIF HKL Paper | C16 H21 N O6 V | P 1 21/n 1 | 9.6619; 11.9922; 15.344 90; 94.651; 90 | 1772 | Rood, Jeffrey A.; Reehl, Steven R.; Jacoby, Kaitlyn A.; Oliver, Allen Crystal structures of a series of bis(acetylacetonato)oxovanadium(IV) complexes containing N-donor pyridyl ligands Acta Crystallographica Section E, 2020, 76, 826-830 |
2243391 | CIF HKL Paper | C48 H20 Cu F20 O10 S3 | P 1 21/c 1 | 7.7343; 46.8973; 13.258 90; 99.211; 90 | 4746.9 | Habuka, Yusuke; Takeuchi, Emily Ami; Hori, Akiko Co-crystal structure, Hirshfeld surface analysis and DFT studies of 3,4-ethylenedioxythiophene solvated bis[1,3-bis(pentafluorophenyl)propane-1,3-dionato]copper(II) Acta Crystallographica Section E, 2020, 76, 820-825 |
2243392 | CIF HKL Paper | C17 H17 F N4 O7 | P 1 21/c 1 | 10.6829; 13.1701; 13.5563 90; 108.97; 90 | 1803.71 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions Acta Crystallographica Section E, 2020, 76, 841-847 |
2243393 | CIF HKL Paper | C12 H15 F N2 O4 | P 1 21/c 1 | 17.0606; 5.782; 12.5815 90; 102.761; 90 | 1210.44 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions Acta Crystallographica Section E, 2020, 76, 841-847 |
2243394 | CIF HKL Paper | C14 H21 F N2 O7 | P 21 21 21 | 7.0961; 7.4967; 30.757 90; 90; 90 | 1636.19 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions Acta Crystallographica Section E, 2020, 76, 841-847 |
2243395 | CIF HKL Paper | C60 H66.01 Cl2 Mn4 N10 Na2 O22 | P -1 | 12.0423; 12.3722; 12.6875 102.839; 111.628; 90.722 | 1704 | Zaleski, Curtis M.; Zeller, Matthias Synthesis and crystal structure of two manganese-based 12-metallacrown-4 complexes: Na~2~(3-chlorobenzoate)~2~[12-MC~Mn(III)N(shi)~-4](DMF)~6~ and MnNa(3-chlorobenzoate)~3~[12-MC~Mn(III)N(shi)~-4](DMF)(H~2~O)~4~·4DMF·0.72H~2~O Acta Crystallographica Section E, 2020, 76, 848-856 |
2243396 | CIF HKL | C64 H72.44 Cl3 Mn5 N9 Na O27.72 | P 1 n 1 | 14.1955; 16.3349; 16.6144 90; 94.235; 90 | 3842.1 | Zaleski, Curtis M.; Zeller, Matthias Synthesis and crystal structure of two manganese-based 12-metallacrown-4 complexes: Na~2~(3-chlorobenzoate)~2~[12-MC~Mn(III)N(shi)~-4](DMF)~6~ and MnNa(3-chlorobenzoate)~3~[12-MC~Mn(III)N(shi)~-4](DMF)(H~2~O)~4~·4DMF·0.72H~2~O Acta Crystallographica Section E, 2020, 76, 848-856 |
2243397 | CIF HKL Paper | C14 H12 Cl N2 O3 | P -1 | 7.7817; 9.5743; 11.1516 113.721; 90.064; 112.397 | 691.47 | Tan, Sang Loon; Tiekink, Edward R. T. Crystal structure, Hirshfeld surface analysis and computational study of the 1:2 co-crystal formed between <i>N</i>,<i>N</i>'-bis[(pyridin-4-yl)methyl]ethanediamide and 3-chlorobenzoic acid Acta Crystallographica Section E, 2020, 76, 870-876 |
2243398 | CIF HKL Paper | C15 H11.15 N O5.07 | C 1 2/c 1 | 26.225; 7.9955; 13.772 90; 111.08; 90 | 2694.5 | Bogdanov, Georgii; Bustos, Jenna; Glebov, Viktor; Oskolkov, Evgenii; Tillotson, John P.; Timofeeva, Tatiana V. Molecular and crystal structure, lattice energy and DFT calculations of two 2'-(nitrobenzoyloxy)acetophenone isomers Acta Crystallographica Section E, 2020, 76, 857-861 |
2243399 | CIF HKL | C15 H11 N O5 | P 1 21/c 1 | 12.209; 14.307; 7.418 90; 92.815; 90 | 1294.2 | Bogdanov, Georgii; Bustos, Jenna; Glebov, Viktor; Oskolkov, Evgenii; Tillotson, John P.; Timofeeva, Tatiana V. Molecular and crystal structure, lattice energy and DFT calculations of two 2'-(nitrobenzoyloxy)acetophenone isomers Acta Crystallographica Section E, 2020, 76, 857-861 |
2243400 | CIF HKL Paper | C21 H18 | P b c a | 12.9844; 11.9583; 19.3729 90; 90; 90 | 3008.06 | Brown, Loren C.; Iacono, Scott T.; Balaich, Gary J. Crystal structures of 6-cyclopropyl-1,3-diphenylfulvene and 6-(2,3-dimethoxynaphthyl)-1,3-diphenylfulvene Acta Crystallographica Section E, 2020, 76, 896-899 |
2243401 | CIF HKL | C30 H24 O2 | P 21 21 21 | 7.3431; 11.5468; 25.7555 90; 90; 90 | 2183.79 | Brown, Loren C.; Iacono, Scott T.; Balaich, Gary J. Crystal structures of 6-cyclopropyl-1,3-diphenylfulvene and 6-(2,3-dimethoxynaphthyl)-1,3-diphenylfulvene Acta Crystallographica Section E, 2020, 76, 896-899 |
2243402 | CIF HKL Paper | C31 H40 Cl F N4 O7 | P 1 21/n 1 | 10.7716; 7.4153; 38.175 90; 92.311; 90 | 3046.7 | George, Christy P.; Sangtani, Ekta; Gonnade, Rajesh G. Crystal structure of a 1:1 co-crystal of the anticancer drug gefitinib with azelaic acid Acta Crystallographica Section E, 2020, 76, 884-888 |
2243403 | CIF HKL Paper | C22 H25 N O S | P -1 | 8.8581; 9.183; 13.021 106.474; 109.398; 93.383 | 944.2 | Sebbar, Ghizlane; Hni, Brahim; Hökelek, Tuncer; Mague, Joel T.; Sebbar, Nada Kheira; Belkadi, Bouchra; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and interaction energy, DFT and antibacterial activity studies of (<i>Z</i>)-4-hexyl-2-(4-methylbenzylidene)-2<i>H</i>-benzo[<i>b</i>][1,4]thiazin-3(4<i>H</i>)-one Acta Crystallographica Section E, 2020, 76, 889-895 |
2243404 | CIF HKL | C30 H30 N4 O6 | P 1 21/n 1 | 16.326; 8.0566; 20.565 90; 104.497; 90 | 2618.8 | Tojiboev, Akmal; Zhurakulov, Sherzod; Vinogradova, Valentina; Englert, Ulli; Wang, Ruimin Stereochemistry of the methylidene-bridged quinazoline-isoquinoline alkaloid 3-{[6,7-dimethoxy-1-(4-nitrophenyl)-1,2,3,4-tetrahydroisoquinolin-2-yl]methylidene}-1,2,3,9-tetrahydropyrrolo[2,1-<i>b</i>]quinazolin-9-one methanol monosolvate Acta Crystallographica Section E, 2020, 76, 914-919 |
2243405 | CIF HKL Paper | C19 H17 N O5 | P 1 21/c 1 | 9.3581; 10.5306; 17.0141 90; 91.967; 90 | 1675.69 | Muslim, Mohd; Ali, Arif; Kamaal, Saima; Ahmad, Musheer; Afzal, Mohd; Plutenko, Maksym O. Crystal structure and Hirshfeld surface analysis of diethyl 5-(2-cyanophenoxy)isophthalate Acta Crystallographica Section E, 2020, 76, 905-908 |
2243406 | CIF HKL Paper | C14 H14 Mn N4 O4 | P 1 21/n 1 | 11.5171; 4.4212; 13.9752 90; 104.698; 90 | 688.32 | Khosa, Muhammad Kaleem; Wood, Paul T.; Humphrey, Simon M.; Harrison, William T. A. Hydrothermal synthesis and crystal structure of poly[bis(μ~3~-3,4-diaminobenzoato)manganese], a layered coordination polymer Acta Crystallographica Section E, 2020, 76, 909-913 |
2243407 | CIF HKL Paper | C72 H90 N8 Ni2 O11 Si2 | C 1 2/c 1 | 25.39; 7.3865; 18.2424 90; 98.161; 90 | 3386.6 | Gavrish, Sergey P.; Shova, Sergiu; Cazacu, Maria; Lampeka, Yaroslaw D. Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)]^2+^ cation and the dianion of diphenylsilanediylbis(4-benzoic acid) Acta Crystallographica Section E, 2020, 76, 929-932 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!