Crystallography Open Database
Search results
Result: there are 294 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 77
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2022294 | CIF HKL Paper | C11 H22 Br2 N4 | P 1 21/n 1 | 8.7897; 14.8937; 11.1294 90; 101.742; 90 | 1426.47 | Mulrooney, David Z. T.; Müller-Bunz, Helge; Keene, Tony D. Crystal structure and halogen‒hydrogen bonding of a Delépine reaction intermediate Acta Crystallographica Section E Crystallographic Communications, 2021, 77, 1-4 |
| 2022339 | CIF HKL Paper | C36 H74.68 Cl32 Cu32 N12 O25.97 S12 | C 1 2 1 | 29.4665; 22.1299; 28.9371 90; 97.3964; 90 | 18712.6 | Gizatullin, Amir; Becker, Jonathan; Islamov, Daut; Serov, Nikita; Schindler, Siegfried; Klimovitskii, Alexander; Shtyrlin, Valery Synthesis and structure of a complex of copper(I) with L-cysteine and chloride ions containing Cu12S6 nanoclusters Acta Crystallographica Section E Crystallographic Communications, 2021, 77, 324-330 |
| 2022377 | CIF Paper | Mg O7 V2 Zn | C 1 2/m 1 | 10.32882; 8.50126; 9.30814 90; 98.5748; 90 | 808.193 | Hong, Stephanie J.; Li, Jun; Subramanian, Mas A. Crystal structure refinement of magnesium zinc divanadate, MgZnV2O7, from powder X-ray diffraction data Acta Crystallographica Section E Crystallographic Communications, 2021, 77, 588-591 |
| 2022386 | CIF HKL Paper | H2 Hg I3 K O | P n a 21 | 8.581; 9.2648; 11.4073 90; 90; 90 | 906.89 | Chocolatl Torres, Misael; Bernès, Sylvain; Salazar Kuri, Ulises Refinement of K[HgI3]·H2O using non-spherical atomic form factors Acta Crystallographica Section E Crystallographic Communications, 2021, 77, 681-685 |
| 2022437 | CIF HKL Paper | C68 H113.12 Cl2 N18 O10 Th6 | C 1 2/m 1 | 17.6783; 17.2647; 16.383 90; 121.867; 90 | 4246.6 | Kelley, Steven P.; Rungthanaphatsophon, Pokpong; Walensky, Justin R. Crystal structure of [Th3(Cp*)3(O)(OH)3]2Cl2(N3)6: a discrete molecular capsule built from multinuclear organothorium cluster cations Acta Crystallographica Section E Crystallographic Communications, 2021, 77 |
| 2022482 | CIF HKL Paper | C17 H7 F8 N3 O | P 21 21 21 | 6.7605; 15.065; 16.0849 90; 90; 90 | 1638.2 | Pokhodylo, Nazariy T.; Slyvka, Yurii; Goreshnik, Evgeny; Lytvyn, Roman Synthesis, crystal structure and Hirshfeld surface analysis of (4-methylphenyl)[1-(pentafluorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazol-4-yl]methanone Acta Crystallographica Section E Crystallographic Communications, 2021, 77 |
| 2022483 | CIF HKL Paper | C15 H21 N O5 S Se | P 1 21 1 | 10.4266; 6.0539; 14.2168 90; 90.261; 90 | 897.38 | Rajegowda, H. R.; Suchetan, P. A.; Butcher, R. J.; Raghavendra Kumar, P. Synthesis and absolute structure of (R)-2-(benzylselanyl)-1-phenylethanaminium hydrogen sulfate monohydrate: crystal structure and Hirshfeld surface analyses Acta Crystallographica Section E Crystallographic Communications, 2021, 77 |
| 2243692 | CIF HKL Paper | C18 H19 F N2 O2 | P 21 21 21 | 7.3286; 11.3388; 20.304 90; 90; 90 | 1687.21 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243693 | CIF HKL Paper | C18 H19 Cl N2 O2 | P c a 21 | 29.769; 11.3173; 20.4028 90; 90; 90 | 6873.8 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243694 | CIF HKL Paper | C18 H19 Br N2 O2 | P c a 21 | 15.0779; 11.2868; 20.5297 90; 90; 90 | 3493.8 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243695 | CIF HKL Paper | C18 H19 I N2 O2 | P 1 21/c 1 | 10.9626; 11.3258; 14.8234 90; 104.52; 90 | 1781.69 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243696 | CIF HKL Paper | C18 H19 I N2 O2 | P 21 21 21 | 7.4528; 17.1306; 27.903 90; 90; 90 | 3562.4 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243697 | CIF HKL Paper | C18 H19 F N2 O2 | P 1 21/n 1 | 7.451; 11.199; 19.138 90; 99.59; 90 | 1574.6 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243698 | CIF HKL Paper | C16 H14 N2 O | P 1 21/n 1 | 9.2572; 9.0531; 15.0557 90; 99.329; 90 | 1245.1 | Al Ati, Gamal; Chkirate, Karim; Mashrai, Ashraf; Mague, Joel T.; Ramli, Youssef; Achour, Redouane; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and DFT study of 1-ethyl-3-phenyl-1,2-dihydroquinoxalin-2-one Acta Crystallographica Section E, 2021, 77, 18-22 |
| 2243699 | CIF HKL Paper | C19 H14 Cl2 N2 O | P 1 21/n 1 | 10.1306; 10.7019; 15.7749 90; 97.715; 90 | 1694.78 | Daoui, Said; Cinar, Emine Berrin; Dege, Necmi; Chelfi, Tarik; El Kalai, Fouad; Abudunia, Abdulmalik; Karrouchi, Khalid; Benchat, Noureddine Crystal structure and Hirshfeld surface analysis of 4-(2,6-dichlorobenzyl)-6-[(<i>E</i>)-2-phenylethenyl]pyridazin-3(2<i>H</i>)-one Acta Crystallographica Section E, 2021, 77, 23-27 |
| 2243700 | CIF HKL Paper | C10 H11 N5 O7 | P -1 | 6.6864; 8.1857; 12.649 79.424; 85.583; 75.586 | 658.78 | Archana, Sreeramapura D.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Two 3-amino-1<i>H</i>-pyrazol-2-ium salts containing organic anions, and an orthorhombic polymorph of 3-amino-1<i>H</i>-pyrazol-2-ium nitrate Acta Crystallographica Section E, 2021, 77, 34-41 |
| 2243701 | CIF HKL Paper | C14 H18 N6 O8 | P 1 21/c 1 | 8.541; 14.0507; 7.5137 90; 98.827; 90 | 891.02 | Archana, Sreeramapura D.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Two 3-amino-1<i>H</i>-pyrazol-2-ium salts containing organic anions, and an orthorhombic polymorph of 3-amino-1<i>H</i>-pyrazol-2-ium nitrate Acta Crystallographica Section E, 2021, 77, 34-41 |
| 2243702 | CIF HKL Paper | C3 H6 N4 O3 | P n a 21 | 7.27; 9.907; 8.551 90; 90; 90 | 615.9 | Archana, Sreeramapura D.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Two 3-amino-1<i>H</i>-pyrazol-2-ium salts containing organic anions, and an orthorhombic polymorph of 3-amino-1<i>H</i>-pyrazol-2-ium nitrate Acta Crystallographica Section E, 2021, 77, 34-41 |
| 2243703 | CIF HKL Paper | C20 H21 N3 O7 | P 1 21/c 1 | 6.0686; 19.2791; 16.3795 90; 94.185; 90 | 1911.2 | Bouzian, Younos; Baydere, Cemile; Dege, Necmi; Ahabchane, Noureddine Hamou; Mague, Joel T.; Abudunia, Abdulmalik; Karrouchi, Khalid; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis, DFT and molecular docking investigation of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl 2-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]quinoline-4-carboxylate Acta Crystallographica Section E, 2021, 77, 28-33 |
| 2243704 | CIF HKL Paper | C53 H38 Cl8 Cu4 N4 O | P -1 | 12.7166; 14.4366; 16.4038 105.024; 105.935; 102.999 | 2650.82 | Al Balushi, Rayya A.; Khan, Muhammad S.; Faizi, Md. Serajul Haque; Haque, Ashanul; Molloy, Kieran; Raithby, Paul R. Synthesis and structural characterization of hexa-μ~2~-chlorido-μ~4~-oxido-tetrakis{[4-(phenylethynyl)pyridine-κ<i>N</i>]copper(II)} dichloromethane monosolvate Acta Crystallographica Section E, 2021, 77, 42-46 |
| 2243705 | CIF HKL Paper | C13 H12 N2 O2 | P n a 21 | 8.284; 8.006; 31.637 90; 90; 90 | 2098.2 | Tojiboev, Akmal; Zhurakulov, Sherzod; Vinogradova, Valentina; Englert, Ulli; Wang, Ruimin Crystal structure, Hirshfeld surface analysis and energy framework study of 6-formyl-7,8,9,11-tetrahydro-5<i>H</i>-pyrido[2,1-<i>b</i>]quinazolin-11-one Acta Crystallographica Section E, 2021, 77, 47-51 |
| 2243706 | CIF HKL Paper | C22 H18 Cl2 N P Pd | C 1 2/c 1 | 13.8153; 15.5676; 18.9683 90; 108.733; 90 | 3863.4 | Mori, Masatoshi; Namioka, Atsushi; Suzuki, Takayoshi Crystal and molecular structures of dichloridopalladium(II) containing 2-methyl- or 2-phenyl-8-(diphenyphosphanyl)quinoline Acta Crystallographica Section E, 2021, 77, 52-57 |
| 2243707 | CIF HKL | C27 H20 Cl2 N P Pd | P -1 | 9.6582; 9.8765; 13.0748 102.011; 90.426; 109.827 | 1143.4 | Mori, Masatoshi; Namioka, Atsushi; Suzuki, Takayoshi Crystal and molecular structures of dichloridopalladium(II) containing 2-methyl- or 2-phenyl-8-(diphenyphosphanyl)quinoline Acta Crystallographica Section E, 2021, 77, 52-57 |
| 2243708 | CIF Paper | Al H16 N O15 S | P -1 | 6.088; 7.377; 13.721 77.34; 89.561; 82.712 | 596.3 | Svensson, Fredric G. Synthesis and crystal structures of [Al(H~2~O)~6~](SO~4~)NO~3~·2H~2~O and [Al(H~2~O)~6~](SO~4~)Cl·H~2~O Acta Crystallographica Section E, 2021, 77, 58-61 |
| 2243709 | CIF Paper | Al Cl H14 O11 S | P 1 21/c 1 | 6.164; 22.933; 7.2876 90; 97.328; 90 | 1021.8 | Svensson, Fredric G. Synthesis and crystal structures of [Al(H~2~O)~6~](SO~4~)NO~3~·2H~2~O and [Al(H~2~O)~6~](SO~4~)Cl·H~2~O Acta Crystallographica Section E, 2021, 77, 58-61 |
| 2243710 | CIF HKL Paper | C14 H13 N O2 | C 1 2/c 1 | 24.3559; 10.7032; 8.9667 90; 93.22; 90 | 2333.8 | Akduran, Nurcan Crystal structure of 2-hydroxy-2-phenylacetophenone oxime Acta Crystallographica Section E, 2021, 77, 66-69 |
| 2243711 | CIF HKL Paper | H6 K2 Mg3 O16 S3 | C m c 21 | 17.8228; 7.4879; 9.7686 90; 90; 90 | 1303.7 | Weil, Matthias Redetermination of K~2~Mg~3~(OH)~2~(SO~4~)~3~(H~2~O)~2~ from single-crystal X-ray data revealing the correct hydrogen-atom positions Acta Crystallographica Section E, 2021, 77, 62-65 |
| 2243712 | CIF HKL Paper | C30 H44 Ca N6 O6 S2 | P -1 | 8.6686; 10.519; 18.998 75.488; 76.847; 80.905 | 1623.7 | Butcher, Ray J.; Purdy, Andrew P.; Brown, Paul A.; Gunlycke, Daniel Synthesis, structure, and theoretical studies of a calcium complex of a unique dianion derived from 1-methylpyrrolidin-2-one Acta Crystallographica Section E, 2021, 77, 70-74 |
| 2243713 | CIF HKL Paper | C17 H14 O5 | I 1 2 1 | 18.9581; 6.6461; 22.4043 90; 94.163; 90 | 2815.4 | Suthiphasilp, Virayu; Meesakul, Pornphimol; Richardson, Christopher; Pyne, Stephen G.; Laphookhieo, Surat Isolation and crystal structure of lawinal Acta Crystallographica Section E, 2021, 77, 75-78 |
| 2243714 | CIF Paper | C29 H26 N4 O6 | P -1 | 7.8576; 12.3468; 14.1147 94.295; 104.603; 101.042 | 1289.6 | Holmberg, Ryne; Franz, Vanessa; Moser, Kristen M.; Solano, Ricardo; Moore, Curtis; Rheingold, Arnold L.; Smith, Gary L. N. Crystal structure of 2,2'-{[(2-nitrobenzyl)azanediyl]bis(propane-3,1-diyl)}bis[1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione] Acta Crystallographica Section E, 2021, 77, 83-85 |
| 2243715 | CIF HKL Paper | C6 H7 Cl2 N O Sn | P 1 21/c 1 | 11.7934; 9.4895; 8.617 90; 106.455; 90 | 924.86 | Henkel, Felix; Reuter, Hans Two coordination compounds of SnCl~2~ with 4-methylpyridine <i>N</i>-oxide Acta Crystallographica Section E, 2021, 77, 91-95 |
| 2243716 | CIF HKL | C12 H14 Cl2 N2 O2 Sn | P b c n | 19.9848; 10.3723; 14.4644 90; 90; 90 | 2998.3 | Henkel, Felix; Reuter, Hans Two coordination compounds of SnCl~2~ with 4-methylpyridine <i>N</i>-oxide Acta Crystallographica Section E, 2021, 77, 91-95 |
| 2243717 | CIF HKL Paper | C16 H11 N3 | P 1 21/c 1 | 13.5479; 5.0242; 17.3881 90; 101.382; 90 | 1160.29 | Kalle, Paulina; Tatarin, Sergei V.; Zakharov, Alexander Yu.; Kiseleva, Marina A.; Bezzubov, Stanislav I. Synthesis and comparative structural study of 2-(pyridin-2-yl)-1<i>H</i>-perimidine and its mono- and di-<i>N</i>-methylated analogues Acta Crystallographica Section E, 2021, 77, 96-100 |
| 2243718 | CIF HKL | C17 H13 N3 | P 1 21/c 1 | 7.5095; 12.1216; 13.5616 90; 92.547; 90 | 1233.25 | Kalle, Paulina; Tatarin, Sergei V.; Zakharov, Alexander Yu.; Kiseleva, Marina A.; Bezzubov, Stanislav I. Synthesis and comparative structural study of 2-(pyridin-2-yl)-1<i>H</i>-perimidine and its mono- and di-<i>N</i>-methylated analogues Acta Crystallographica Section E, 2021, 77, 96-100 |
| 2243719 | CIF HKL | C18 H16 I N3 | P 1 21/n 1 | 9.8821; 9.7125; 17.9839 90; 103.676; 90 | 1677.16 | Kalle, Paulina; Tatarin, Sergei V.; Zakharov, Alexander Yu.; Kiseleva, Marina A.; Bezzubov, Stanislav I. Synthesis and comparative structural study of 2-(pyridin-2-yl)-1<i>H</i>-perimidine and its mono- and di-<i>N</i>-methylated analogues Acta Crystallographica Section E, 2021, 77, 96-100 |
| 2243720 | CIF HKL Paper | C20 H19 N O5 | P -1 | 8.81; 9.9182; 11.165 81.205; 70.657; 72.642 | 877 | Zaytsev, Vladimir P.; Chervyakova, Lala V.; Sorokina, Elena A.; Vasilyev, Kirill A.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of ethyl (4<i>R</i>,4a<i>S</i>)-2-methyl-5,8-dioxo-6-phenyl-4a,5,6,7,7a,8-hexahydro-4<i>H</i>-furo[2,3-<i>f</i>]isoindole-4-carboxylate Acta Crystallographica Section E, 2021, 77, 86-90 |
| 2243721 | CIF HKL Paper | C19 H24 N2 O6 | P 1 21 1 | 7.9555; 13.3696; 9.9708 90; 112.874; 90 | 977.12 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. Psilacetin derivatives: fumarate salts of the methyl‒ethyl, methyl‒allyl and diallyl variants of the psilocin prodrug Acta Crystallographica Section E, 2021, 77, 101-106 |
| 2243722 | CIF HKL Paper | C20 H24 N2 O6 | P 1 21 1 | 7.9702; 14.1788; 9.8035 90; 113.394; 90 | 1016.8 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. Psilacetin derivatives: fumarate salts of the methyl‒ethyl, methyl‒allyl and diallyl variants of the psilocin prodrug Acta Crystallographica Section E, 2021, 77, 101-106 |
| 2243723 | CIF HKL Paper | C44 H52 N4 O12 | C 1 2/c 1 | 23.6642; 8.4204; 23.4002 90; 111.614; 90 | 4334.9 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. Psilacetin derivatives: fumarate salts of the methyl‒ethyl, methyl‒allyl and diallyl variants of the psilocin prodrug Acta Crystallographica Section E, 2021, 77, 101-106 |
| 2243724 | CIF HKL Paper | C20 H20 B2 F4 N4 | P n m a | 20.2495; 6.8046; 13.4969 90; 90; 90 | 1859.73 | Liu, Xiaoxue; Li, Tuo; Yin, Zhenming Crystal structure and fluorescence study of (μ-<i>N</i>-[(3,5-dimethyl-1<i>H</i>-pyrrol-2-yl)methylidene]-<i>N</i>-{4-[(3,5-dimethyl-1<i>H</i>-pyrrol-2-yl)methylideneazaniumyl]phenyl}azanium)bis[difluoridoboron(IV)] Acta Crystallographica Section E, 2021, 77, 126-129 |
| 2243725 | CIF HKL Paper | C28 H27 N3 O3 S | P 1 21/n 1 | 12.0487; 13.9821; 15.0239 90; 106.606; 90 | 2425.46 | Al-Taifi, Elham A.; Maraei, Islam S.; Bakhite, Etify A.; Demirtas, Güneş; Mague, Joel. T.; Mohamed, Shaaban K.; Ramli, Youssef Crystallographic and spectroscopic characterization of 2-[(7-acetyl-4-cyano-6-hydroxy-1,6-dimethyl-8-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-<i>N</i>-phenylacetamide Acta Crystallographica Section E, 2021, 77, 121-125 |
| 2243726 | CIF HKL Paper | C11 H12 N6 O2 | C 1 2/c 1 | 27.7311; 7.1747; 11.7849 90; 94.101; 90 | 2338.7 | Heras Martinez, Hector Mario; Chavez Flores, David; Hillesheim, Patrick C.; Patil, Siddappa; Bugarin, Alejandro Crystal structure and spectroscopic properties of (<i>E</i>)-1,3-dimethyl-2-[3-(4-nitrophenyl)triaz-2-enylidene]-2,3-dihydro-1<i>H</i>-imidazole Acta Crystallographica Section E, 2021, 77, 130-133 |
| 2243727 | CIF HKL Paper | C8 H3 Cl F3 N O4 | P -1 | 4.7297; 7.8993; 13.044 91.57; 96.51; 104.79 | 467.35 | Richter, Adrian; Goddard, Richard; Schlegel, Tom; Imming, Peter; Seidel, Rüdiger W. 2-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid and -benzamide: structural characterization of two precursors for antitubercular benzothiazinones Acta Crystallographica Section E, 2021, 77, 142-147 |
| 2243728 | CIF HKL Paper | C8 H4 Cl F3 N2 O3 | P 1 21/c 1 | 8.3012; 28.23; 9.1522 90; 110.424; 90 | 2009.9 | Richter, Adrian; Goddard, Richard; Schlegel, Tom; Imming, Peter; Seidel, Rüdiger W. 2-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid and -benzamide: structural characterization of two precursors for antitubercular benzothiazinones Acta Crystallographica Section E, 2021, 77, 142-147 |
| 2243729 | CIF HKL Paper | C30 H36 N2 Na2 O10 | P -1 | 8.5404; 9.0144; 21.6217 92.922; 98.873; 113.038 | 1502.1 | Konovalova, Irina S.; Kovalenko, Sergiy M.; Kravchenko, Dmitry V.; Chuev, Vladimir P. Crystal structure of the non-steroidal anti-inflammatory drug (NSAID) tolmetin sodium Acta Crystallographica Section E, 2021, 77, 134-137 |
| 2243730 | CIF HKL Paper | C12 H9 N3 O4 S | P 21 21 21 | 7.1335; 11.7297; 15.4593 90; 90; 90 | 1293.54 | Kansiz, Sevgi; Dege, Necmi; Ozturk, Seyhan; Akdemir, Nesuhi; Tarcan, Erdoğan; Arslanhan, Ali; Saif, Eiad Crystal structure and Hirshfeld surface analysis of 2-methyl-3-nitro-<i>N</i>-[(<i>E</i>)-(5-nitrothiophen-2-yl)methylidene]aniline Acta Crystallographica Section E, 2021, 77, 138-141 |
| 2243731 | CIF HKL Paper | C26 H22 Cd N8 O4 | A e a 2 | 12.6654; 17.6394; 10.888 90; 90; 90 | 2432.49 | Yang, Ping; Xie, Xiao-Bao; Shi, Qing-Shan Crystal structure of bis{2-hydroxy-<i>N</i>'-[1-(pyrazin-2-yl)ethylidene]benzohydrazidato}cadmium(II) Acta Crystallographica Section E, 2021, 77, 153-157 |
| 2243732 | CIF HKL Paper | C24 H36 Cl2 F2 N6 Ni O8 | C 1 2/c 1 | 16.991; 15.5187; 13.8864 90; 126.189; 90 | 2955.1 | Kwak, Chee-Hun; Chang, Mee Crystal structure of [3,10-bis(4-fluorophenethyl)-1,3,5,8,10,12-hexaazacyclotetradecane]nickel(II) diperchlorate Acta Crystallographica Section E, 2021, 77, 148-152 |
| 2243733 | CIF HKL Paper | C18 H25 B O2 Sn | C 1 2/c 1 | 30.1386; 11.2948; 16.4726 90; 139.457; 90 | 3644.9 | Breitwieser, Kevin; Chen, Peter Crystal structure of a 1,1-dibutyl-1<i>H</i>,3<i>H</i>-naphtho[1,8-<i>cd</i>][1,2,6]oxastannaborinin-3-ol Acta Crystallographica Section E, 2021, 77, 180-183 |
| 2243734 | CIF HKL Paper | C30 H43 O2 P | P -1 | 9.616; 15.8209; 19.0324 71.2052; 85.1144; 87.9801 | 2731 | Carsch, Kurtis M.; Ho, William; Lui, Kai Hin; Valtierra, Gregory; Dogutan, Dilek K.; Nocera, Daniel G.; Zheng, Shao-Liang Crystal structure of the RuPhos ligand Acta Crystallographica Section E, 2021, 77, 171-174 |
| 2243735 | CIF HKL Paper | C27 H22 F2 O4 | P -1 | 10.14886; 11.1827; 11.6411 66.724; 77.693; 63.613 | 1086.06 | Iitsuka, Hiroaki; Li, Kun; Kobayashi, Miyuki; Iida, Kikuko; Yonezawa, Noriyuki; Okamoto, Akiko Crystal structure of 1,2-bis(4-fluorophenyl)-1-hydroxy-2,3,8-trimethoxyacenaphthene: formation of a five-membered intramolecular O—H···O hydrogen-bonded ring Acta Crystallographica Section E, 2021, 77, 175-179 |
| 2243736 | CIF HKL Paper | C24 H21 N O4 | C 1 c 1 | 20.3693; 10.0956; 39.1991 90; 98.443; 90 | 7973.6 | Nguyen Tien, Cong; Vu Quoc, Trung; Nguyen Dang, Dat; Le Duc, Giang; Van Meervelt, Luc Synthesis and structure of (<i>E</i>)-<i>N</i>-(4-methoxyphenyl)-2-[4-(3-oxo-3-phenylprop-1-en-1-yl)phenoxy]acetamide Acta Crystallographica Section E, 2021, 77, 184-189 |
| 2243737 | CIF HKL Paper | C16 H22 N2 O3 | P 1 21/n 1 | 7.7368; 12.1233; 17.5528 90; 102.154; 90 | 1609.47 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. 2,5-Dimethylbufotenine and 2,5-dimethylbufotenidine: novel derivatives of natural tryptamines found in <i>Bufo alvarius</i> toads Acta Crystallographica Section E, 2021, 77, 190-194 |
| 2243738 | CIF HKL | C15 H23 I N2 O | P 1 21/n 1 | 7.5067; 22.657; 10.0894 90; 97.225; 90 | 1702.4 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. 2,5-Dimethylbufotenine and 2,5-dimethylbufotenidine: novel derivatives of natural tryptamines found in <i>Bufo alvarius</i> toads Acta Crystallographica Section E, 2021, 77, 190-194 |
| 2243739 | CIF HKL | C15 H25 I N2 O2 | P 1 21/c 1 | 10.9091; 14.091; 11.4029 90; 100.338; 90 | 1724.4 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. 2,5-Dimethylbufotenine and 2,5-dimethylbufotenidine: novel derivatives of natural tryptamines found in <i>Bufo alvarius</i> toads Acta Crystallographica Section E, 2021, 77, 190-194 |
| 2243740 | CIF HKL Paper | C28 H21 N3 O | P 21 21 21 | 10.7038; 11.6096; 17.5182 90; 90; 90 | 2176.93 | Naghiyev, Farid N.; Grishina, Maria M.; Khrustalev, Victor N.; Khalilov, Ali N.; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 3-amino-1-oxo-2,6,8-triphenyl-1,2,7,8-tetrahydroisoquinoline-4-carbonitrile Acta Crystallographica Section E, 2021, 77, 195-199 |
| 2243741 | CIF HKL | C25 H27 Cl N4 O | P -1 | 8.4791; 10.4091; 13.6862 90.138; 94.833; 113.745 | 1100.9 | Ullah, Nisar; Stoeckli-Evans, Helen Crystal structure and Hirshfeld surface analysis of the hydrochloride salt of 8-{4-[(6-phenylpyridin-3-yl)methyl]piperazin-1-yl}-3,4-dihydroquinolin-2(1<i>H</i>)-one Acta Crystallographica Section E, 2021, 77, 208-212 |
| 2243742 | CIF HKL Paper | C22 H56 Cl4 N4 O4 | P 1 21/n 1 | 7.655; 23.533; 8.313 90; 102.45; 90 | 1462.3 | Moon, Dohyun; Choi, Jong-Ha Crystal structure of 3,14-diethyl-2,6,13,17-tetraazoniatricyclo[16.4.0.0^7,12^]docosane tetrachloride tetrahydrate from synchrotron X-ray data Acta Crystallographica Section E, 2021, 77, 213-216 |
| 2243743 | CIF HKL Paper | C20 H19 N3 O4 | C 1 2/c 1 | 33.888; 14.9497; 8.2021 90; 94.447; 90 | 4142.8 | Arderne, Charmaine; Fotsing, Marthe Carine Djuide; Ndinteh, Derek Tantoh Synthesis and structure of 4-{[(<i>E</i>)-(7-methoxy-1,3-benzodioxol-5-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one Acta Crystallographica Section E, 2021, 77, 200-203 |
| 2243744 | CIF HKL Paper | C4 H8 O4 S2 | P 1 n 1 | 4.9472; 9.9021; 7.1002 90; 91.464; 90 | 347.71 | Harlow, Richard L.; Oliver, Allen G.; Sammes, Michael P. C—H···O contacts in the crystal structure of 1,3-dithiane 1,1,3,3-tetraoxide Acta Crystallographica Section E, 2021, 77, 204-207 |
| 2243745 | CIF HKL Paper | C20 H27 N | P 21 21 21 | 10.05103; 10.62943; 15.64759 90; 90; 90 | 1671.74 | Acelas, Mauricio; Dugarte-Dugarte, Analio; Romero Bohórquez, Arnold R.; Henao, José Antonio; Delgado, José Miguel; Díaz de Delgado, Graciela Synthesis, crystal structure, Hirshfeld surface analysis and energy framework calculations of <i>trans</i>-3,7,9,9-tetramethyl-10-(prop-2-yn-1-yl)-1,2,3,4,4a,9,9a,10-octahydroacridine Acta Crystallographica Section E, 2021, 77, 226-232 |
| 2243746 | CIF HKL Paper | C54 H80 N8 O6 | P 1 21/c 1 | 13.8395; 20.0443; 9.6347 90; 102.8; 90 | 2606.3 | Amrhein, Felix; Schwarzer, Anke; Mazik, Monika Crystal structure of a methanol solvate of a macrocycle bearing two flexible side-arms Acta Crystallographica Section E, 2021, 77, 233-236 |
| 2243747 | CIF HKL Paper | C15 H15 Br2 N O2 | P -1 | 6.8064; 9.5045; 11.9482 79.551; 87.82; 77.083 | 740.89 | Mertsalov, Dmitriy F.; Nadirova, Maryana A.; Chervyakova, Lala V.; Grigoriev, Mikhail S.; Shelukho, Evgeniya R.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Mlowe, Sixberth Crystal structure and Hirshfeld surface analysis of 4,5-dibromo-6-methyl-2-phenyl-2,3,3a,4,5,6,7,7a-octahydro-3a,6-epoxy-1<i>H</i>-isoindol-1-one Acta Crystallographica Section E, 2021, 77, 237-241 |
| 2243748 | CIF HKL Paper | C20 H19 N3 O2 | P 1 21/c 1 | 13.8467; 15.8409; 8.0225 90; 104.814; 90 | 1701.2 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Albayati, Mustafa R.; Elgarhy, Sahar M. I.; Al-Taifi, Elham A. Crystal structures of two hydrazide derivatives of mefenamic acid, 3-(2,3-dimethylanilino)-<i>N</i>'-[(<i>E</i>)-(furan-2-yl)methylidene]benzohydrazide and <i>N</i>'-[(<i>E</i>)-benzylidene]-2-(2,3-dimethylanilino)benzohydrazide Acta Crystallographica Section E, 2021, 77, 242-246 |
| 2243749 | CIF HKL Paper | C22 H21 N3 O | P 1 21/c 1 | 14.3493; 15.7501; 8.3737 90; 106.285; 90 | 1816.55 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Albayati, Mustafa R.; Elgarhy, Sahar M. I.; Al-Taifi, Elham A. Crystal structures of two hydrazide derivatives of mefenamic acid, 3-(2,3-dimethylanilino)-<i>N</i>'-[(<i>E</i>)-(furan-2-yl)methylidene]benzohydrazide and <i>N</i>'-[(<i>E</i>)-benzylidene]-2-(2,3-dimethylanilino)benzohydrazide Acta Crystallographica Section E, 2021, 77, 242-246 |
| 2243750 | CIF HKL Paper | C27 H33 N O5 | P 1 21/n 1 | 9.5289; 18.6653; 13.8046 90; 96.41; 90 | 2439.93 | Allah, Omyma A. A. Abd; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Jasinski, Jerry P.; Elgarhy, Sahar M. I. Crystal structure and Hirshfeld surface analysis of ethyl 2-[9-(2-hydroxyphenyl)-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,4a,5,6,7,8a,9,9a,10,10a-dodecahydroacridin-10-yl]acetate Acta Crystallographica Section E, 2021, 77, 247-250 |
| 2243751 | CIF HKL Paper | C15 H15 Br2 N O2 | P 1 21/n 1 | 17.4839; 8.2993; 21.512 90; 106.115; 90 | 2998.83 | Mertsalov, Dmitriy F.; Zaytsev, Vladimir P.; Pokazeev, Kuzma M.; Grigoriev, Mikhail S.; Bachinsky, Alexander V.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Mlowe, Sixberth Crystal structure and Hirshfeld surface analysis of 2-benzyl-4,5-dibromo-2,3,3a,4,5,6,7,7a-octahydro-3a,6-epoxy-1<i>H</i>-isoindol-1-one Acta Crystallographica Section E, 2021, 77, 255-259 |
| 2243752 | CIF HKL Paper | C24 H24 N2 O5 S | P -1 | 11.821; 11.8395; 16.7336 77.949; 79.555; 77.511 | 2213.3 | Mertsalov, Dmitriy F.; Nadirova, Maryana A.; Sorokina, Elena A.; Vinokurova, Marina A.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Kolesnik, Irina A.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of (<i>RS</i>)-3-hydroxy-2-{[(3a<i>RS</i>,6<i>RS</i>,7a<i>RS</i>)-2-(4-methylphenylsulfonyl)-2,3,3a,6,7,7a-hexahydro-3a,6-epoxy-1<i>H</i>-isoindol-6-yl]methyl}isoindolin-1-one Acta Crystallographica Section E, 2021, 77, 260-265 |
| 2243753 | CIF HKL Paper | C14 H12 Cu N2 O6 | P -1 | 7.6516; 9.9272; 10.0722 95.204; 107.729; 111.462 | 660.34 | Gao, Sen; Fronczek, Frank R.; Maverick, Andrew W. A copper complex of an unusual hydroxy‒carboxylate ligand: [Cu(bpy)(C~4~H~4~O~6~)] Acta Crystallographica Section E, 2021, 77, 282-285 |
| 2243754 | CIF HKL Paper | C8 H14 O2 | P 1 21/n 1 | 6.2758; 23.6912; 7.776 90; 91.21; 90 | 1155.9 | Chan, Isa Y. H.; Bhadbhade, Mohan M.; Bishop, Roger Threefold helical assembly <i>via</i> hydroxy hydrogen bonds: the 2:1 co-crystal of bicyclo[3.3.0]octane-<i>endo</i>-3,<i>endo</i>-7-diol and bicyclo[3.3.0]octane-<i>endo</i>-3,<i>exo</i>-7-diol Acta Crystallographica Section E, 2021, 77, 270-276 |
| 2243755 | CIF HKL Paper | C26 H20 N2 O3 | C 1 2/c 1 | 26.8396; 5.1174; 17.2574 90; 121.764; 90 | 2015.27 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Hawaiz, Farouq E.; Elgarhy, Sahar M. I.; Al-Taifi, Elham A. Crystal structure and Hirshfeld surface analysis of 3-[(1<i>E</i>)-(4-{4-[(<i>E</i>)-(3-hydroxybenzylidene)amino]phenoxy}phenylimino)methyl]phenol Acta Crystallographica Section E, 2021, 77, 266-269 |
| 2243756 | CIF HKL Paper | C21 H16 F N3 O3 S | P 1 21/c 1 | 18.3849; 7.7063; 13.9216 90; 100.136; 90 | 1941.6 | Dey, Dhananjay; Shruti, I.; Chopra, Deepak; Mohan, T. P. Structural investigation of <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]benzamide and <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]-4-methoxybenzamide Acta Crystallographica Section E, 2021, 77, 277-281 |
| 2243757 | CIF HKL | C22 H18 F N3 O4 S | C 1 2/c 1 | 47.298; 4.8054; 18.4939 90; 100.429; 90 | 4134 | Dey, Dhananjay; Shruti, I.; Chopra, Deepak; Mohan, T. P. Structural investigation of <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]benzamide and <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]-4-methoxybenzamide Acta Crystallographica Section E, 2021, 77, 277-281 |
| 2243758 | CIF HKL Paper | C23 H31 N3 O2 S Sn | P 1 21/n 1 | 11.272; 16.1954; 14.2778 90; 111.18; 90 | 2430.41 | Yusof, Enis Nadia Md; Kwong, Huey Chong; Karunakaran, Thiruventhan; Ravoof, Thahira B. S. A.; Tiekink, Edward R. T. Di-<i>n</i>-butyl[<i>N</i>'-(3-methoxy-2-oxidobenzylidene)-<i>N</i>-phenylcarbamohydrazonothioato]tin(IV): crystal structure, Hirshfeld surface analysis and computational study Acta Crystallographica Section E, 2021, 77, 286-293 |
| 2243759 | CIF HKL Paper | C22 H22 Cl N3 O4 S | P -1 | 8.6739; 10.549; 12.4021 91.351; 101.065; 97.235 | 1103.51 | Shyshkina, Mariia O.; Lega, Dmitry A.; Goryachiy, Volodymyr D.; Shemchuk, Ludmila M.; Levashov, Dmitriy V.; Shemchuk, Leonid A. 2-Amino-4-(4-chloro-1-ethyl-2,2-dioxo-1<i>H</i>-benzo[<i>c</i>][1,2]thiazin-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4<i>H</i>-chromene-3-carbonitrile: single-crystal X-ray diffraction study and Hirshfeld surface analysis Acta Crystallographica Section E, 2021, 77, 294-297 |
| 2243760 | CIF HKL Paper | C14 H21.61 K4 N8 Ni2 O18.81 | P b c a | 15.0694; 16.9659; 22.192 90; 90; 90 | 5673.74 | Plutenko, Maksym O.; Haukka, Matti; Husak, Alina O.; Iskenderov, Turganbay S.; Mulloev, Nurullo U. Crystal structure and Hirshfeld surface analysis of poly[[bis[μ~4~-<i>N</i>,<i>N</i>'-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] Acta Crystallographica Section E, 2021, 77, 298-304 |
| 2243761 | CIF HKL Paper | C17 H20 Cl N O5 | P 1 21/c 1 | 14.654; 8.9148; 13.045 90; 102.581; 90 | 1663.2 | Anderson, Alan J.; Butcher, Ray J.; Ollie, Edward Syntheses and structures of two benzoyl amides: 2-chloro-4-ethoxy-3,5-dimethoxy-<i>N</i>-(3-oxocyclohex-1-en-1-yl)benzamide and 2-chloro-<i>N</i>-(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)-4-ethoxy-3,5-dimethoxybenzamide Acta Crystallographica Section E, 2021, 77, 314-318 |
| 2243762 | CIF HKL Paper | C19 H24 Cl N O5 | P 1 21/c 1 | 14.6986; 10.6309; 25.131 90; 90.1851; 90 | 3926.9 | Anderson, Alan J.; Butcher, Ray J.; Ollie, Edward Syntheses and structures of two benzoyl amides: 2-chloro-4-ethoxy-3,5-dimethoxy-<i>N</i>-(3-oxocyclohex-1-en-1-yl)benzamide and 2-chloro-<i>N</i>-(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)-4-ethoxy-3,5-dimethoxybenzamide Acta Crystallographica Section E, 2021, 77, 314-318 |
| 2243763 | CIF HKL Paper | C24 H22 Cu3 N4 O16 | P -1 | 7.8669; 9.71; 10.424 97.016; 110.701; 109.049 | 678.2 | Mirzaei, Masoud; Bazargan, Maryam; Ebtehaj, Pouria; Mague, Joel T. A redetermination of the structure and Hirshfeld surface analysis of poly[diaquadi-μ-hydroxido-tetrakis(μ-nicotinato <i>N</i>-oxide)tricopper(II)] Acta Crystallographica Section E, 2021, 77, 309-313 |
| 2243764 | CIF HKL Paper | C23 H19 Br N4 O2 | P 1 21/c 1 | 10.7812; 12.7877; 15.4575 90; 109.635; 90 | 2007.2 | Temesgen, Ayalew; Tskhovrebov, Alexander G.; Vologzhanina, Anna V.; Le, Tuan A.; Khrustalev, Victor N. Crystal structure of 2-[(<i>E</i>)-2-(4-bromophenyl)diazen-1-yl]-4,5-bis(4-methoxyphenyl)-1<i>H</i>-imidazole: the first example of a structurally characterized triarylazoimidazole Acta Crystallographica Section E, 2021, 77, 305-308 |
| 2243765 | CIF HKL Paper | C17 H19 N O4 | P 1 21/c 1 | 13.72487; 13.05333; 8.5597 90; 95.522; 90 | 1526.4 | Nowatschin, Vanessa; Näther, Christian; Lüning, Ulrich Synthesis and crystal structure of allyl 7-(diethylamino)-2-oxo-2<i>H</i>-chromene-3-carboxylate Acta Crystallographica Section E, 2021, 77, 331-334 |
| 2243766 | CIF HKL Paper | C23 H21 Cl N2 O3 | P b c a | 27.9446; 8.4311; 35.0101 90; 90; 90 | 8248.51 | Allah, Omyma A. Abd; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Tamam, Asmaa H. A.; Elgarhy, Sahar M. I.; Jasinski, Jerry P. Crystal structures of 1-(4-chlorophenyl)-4-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid and 4-(4-methoxyphenyl)-1-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile Acta Crystallographica Section E, 2021, 77, 351-355 |
| 2243767 | CIF HKL Paper | C24 H22 N2 O3 | P 1 21/c 1 | 10.3486; 13.9969; 27.5353 90; 93.797; 90 | 3979.69 | Allah, Omyma A. Abd; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Tamam, Asmaa H. A.; Elgarhy, Sahar M. I.; Jasinski, Jerry P. Crystal structures of 1-(4-chlorophenyl)-4-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid and 4-(4-methoxyphenyl)-1-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile Acta Crystallographica Section E, 2021, 77, 351-355 |
| 2243768 | CIF HKL Paper | C25 H23 N5 O S2 | P -1 | 8.6269; 9.8418; 14.9 90.588; 106.162; 101.441 | 1188.05 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products Acta Crystallographica Section E, 2021, 77, 335-340 |
| 2243769 | CIF HKL Paper | C48 H40 Cl4 N10 O3 S4 | P 1 2/c 1 | 15.037; 8.4266; 19.471 90; 96.246; 90 | 2452.5 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products Acta Crystallographica Section E, 2021, 77, 335-340 |
| 2243770 | CIF HKL Paper | C31 H27 N5 O4 S2 | P -1 | 10.783; 11.683; 13.577 93.54; 105.17; 113.2 | 1490.9 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products Acta Crystallographica Section E, 2021, 77, 335-340 |
| 2243771 | CIF HKL Paper | C32 H22 Br Cl2 N5 O S2 | P -1 | 12.32; 12.57; 12.7742 117.202; 102.879; 105.727 | 1548.4 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products Acta Crystallographica Section E, 2021, 77, 335-340 |
| 2243772 | CIF HKL Paper | C24 H20 Cl N O2 | P 1 21/c 1 | 10.5733; 22.848; 8.7151 90; 101.477; 90 | 2063.3 | Aydin, Abdullah; Akkurt, Mehmet; Turanli, Sumeyye; Lengerli, Deniz; Banoglu, Erden; Ozcelik, Nefise Dilek Crystal structure and Hirshfeld surface analysis of 4-(4-chlorophenyl)-5-methyl-3-{4-[(2-methylphenyl)methoxy]phenyl}-1,2-oxazole Acta Crystallographica Section E, 2021, 77, 346-350 |
| 2243773 | CIF HKL Paper | C20 H27 F N2 O2 | P 1 21 1 | 10.2576; 9.5127; 10.5318 90; 104.691; 90 | 994.07 | Gumireddy, Ashwini; DeBoyace, Kevin; Rupprecht, Alexander; Gupta, Mohit; Patel, Saloni; Flaherty, Patrick T.; Wildfong, Peter L. D. Crystal structure of <i>tert</i>-butyl 4-[4-(4-fluorophenyl)-2-methylbut-3-yn-2-yl]piperazine-1-carboxylate Acta Crystallographica Section E, 2021, 77, 360-365 |
| 2243774 | CIF HKL Paper | C12 H10 Br N O3 S | P 21 21 21 | 4.8436; 13.9149; 18.5479 90; 90; 90 | 1250.1 | Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O. Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one Acta Crystallographica Section E, 2021, 77, 341-345 |
| 2243775 | CIF HKL | C13 H11 Br N2 O4 S | P -1 | 6.8904; 8.3224; 12.8763 83.423; 80.393; 85.693 | 722.06 | Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O. Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one Acta Crystallographica Section E, 2021, 77, 341-345 |
| 2243776 | CIF HKL | C19 H23 Br N2 O5 S | P 1 21/c 1 | 7.7375; 15.9728; 16.7621 90; 93.055; 90 | 2068.68 | Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O. Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one Acta Crystallographica Section E, 2021, 77, 341-345 |
| 2243777 | CIF HKL Paper | C33 H26 N4 O4 | P -1 | 11.5014; 11.534; 11.7878 73.567; 74.613; 64.218 | 1332.1 | Mohamed, Shaaban K.; Said, Awad I.; Mague, Joel T.; El-Emary, Talaat I.; Akkurt, Mehmet; Elgarhy, Sahar M. I. Crystal structure and Hirshfeld surface analysis of (3<i>S</i>,3a<i>R</i>,6a<i>S</i>)-3-(1,3-diphenyl-1<i>H</i>-pyrazol-4-yl)-5-(4-methoxyphenyl)-2-phenyl-3,3a,4,5,6,6a-hexahydro-2<i>H</i>-pyrrolo[3,4-<i>d</i>][1,2]oxazole-4,6-dione Acta Crystallographica Section E, 2021, 77, 356-359 |
| 2243778 | CIF HKL Paper | C100 H88.32 N8 O12.16 S4 | P 1 21/c 1 | 12.049; 20.223; 9.1743 90; 100.91; 90 | 2195.1 | Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynov, Elnur Z.; Khalilov, Ali N.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 3-cyano-4-hydroxy-2-(4-methylphenyl)-6-oxo-<i>N</i>-phenyl-4-(thiophen-2-yl)cyclohexane-1-carboxamide 0.04-hydrate Acta Crystallographica Section E, 2021, 77, 366-371 |
| 2243779 | CIF HKL | C27 H30 N2 O | P -1 | 7.7099; 11.2838; 12.9539 89.413; 79.094; 82.27 | 1096.41 | Ullah, Nisar; Stoeckli-Evans, Helen The crystal structures, Hirshfeld surface analyses and energy frameworks of 8-{1-[3-(cyclopent-1-en-1-yl)benzyl]piperidin-4-yl}-2-methoxyquinoline and 8-{4-[3-(cyclopent-1-en-1-yl)benzyl]piperazin-1-yl}-2-methoxyquinoline Acta Crystallographica Section E, 2021, 77, 372-377 |
| 2243780 | CIF HKL | C26 H29 N3 O | P -1 | 7.9142; 10.9051; 12.8896 87.271; 79.29; 82.206 | 1082.7 | Ullah, Nisar; Stoeckli-Evans, Helen The crystal structures, Hirshfeld surface analyses and energy frameworks of 8-{1-[3-(cyclopent-1-en-1-yl)benzyl]piperidin-4-yl}-2-methoxyquinoline and 8-{4-[3-(cyclopent-1-en-1-yl)benzyl]piperazin-1-yl}-2-methoxyquinoline Acta Crystallographica Section E, 2021, 77, 372-377 |
| 2243781 | CIF HKL Paper | C9 H7 N O2 S | P 1 21/c 1 | 10.466; 12.1614; 14.7636 90; 110.362; 90 | 1761.71 | Laroum, Rima; Benouatas, Assia; Hamdouni, Noudjoud; Zemamouche, Wissame; Boudjada, Ali; Debache, Abdelmadjid Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-3-methyl-4-(thiophen-2-ylmethylidene)isoxazol-5(4<i>H</i>)-one Acta Crystallographica Section E, 2021, 77, 378-382 |
| 2243782 | CIF HKL Paper | C24 H43 B Si3 U | P -1 | 8.753; 12.217; 13.657 94.159; 96.016; 103.256 | 1406.6 | Windorff, Cory J.; Cross, Justin N.; Scott, Brian L.; Kozimor, Stosh A.; Evans, William J. Crystallographic characterization of (C~5~H~4~SiMe~3~)~3~U(BH~4~) Acta Crystallographica Section E, 2021, 77, 383-389 |
| 2243783 | CIF HKL Paper | C13 H13 N3 O | P b c a | 9.6545; 11.2437; 22.9108 90; 90; 90 | 2487 | Idrissi, Ahlam; Chkirate, Karim; Abad, Nadeem; Djerrari, Bahia; Achour, Redouane; Essassi, El Mokhtar; Van Meervelt, Luc Crystal structure, Hirshfeld surface analysis and density functional theory study of 6-methyl-2-[(5-methylisoxazol-3-yl)methyl]-1<i>H</i>-benzimidazole Acta Crystallographica Section E, 2021, 77, 396-401 |
| 2243784 | CIF HKL Paper | C20 H20 Cl N2 Na O8 S2 | P -1 | 5.7347; 10.9336; 18.4692 104.844; 97.478; 95.404 | 1100 | Tapmeyer, Lukas; Eisenbeil, Daniel; Bolte, Michael; Schmidt, Martin U. First crystal structure of a Pigment Red 52 compound: DMSO solvate hydrate of the monosodium salt Acta Crystallographica Section E, 2021, 77, 402-405 |
| 2243785 | CIF HKL Paper | C20 H24 Cu N4 O8 | C 1 2/c 1 | 12.7286; 7.4918; 22.8967 90; 98.395; 90 | 2160.04 | Kansiz, Sevgi; Qadir, Adnan M.; Dege, Necmi; Yongxin, Li; Saif, Eiad Crystal structure and Hirshfeld surface analysis of a copper(II) complex containing 2-nitrobenzoate and tetramethylethylenediamine ligands Acta Crystallographica Section E, 2021, 77, 412-415 |
| 2243786 | CIF HKL Paper | C19 H24 N2 O3 | P -1 | 7.8791; 9.2908; 13.5352 108.081; 104.365; 95.903 | 894.87 | Pham, Duyen N. K.; Sammeta, Vamshikrishna Reddy; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. `Foxtrot' fumarate: a water-soluble salt of <i>N</i>,<i>N</i>-diallyl-5-methoxytryptamine (5-MeO-DALT) Acta Crystallographica Section E, 2021, 77, 416-419 |
| 2243787 | CIF HKL Paper | C26 H24 Br N3 S | C 1 c 1 | 14.5474; 17.8777; 9.0803 90; 108.773; 90 | 2235.92 | Mohamed, Shaaban K.; Elgarhy, Sahar M. I.; Hassan, Alaa A.; Demirtaş, Güneş; Mague, Joel. T.; Ramli, Youssef Crystal structure of (<i>E</i>)-1-(3-benzyl-5-phenyl-1,3-thiazol-2-ylidene)-2-[(<i>E</i>)-1,2,3,4-tetrahydronaphthalen-1-ylidene]hydrazin-1-ium bromide Acta Crystallographica Section E, 2021, 77, 420-423 |
| 2243788 | CIF Paper | C6 H16 Cl4 Co N2 | C 1 2/c 1 | 7.6431; 11.9347; 14.0058 90; 95.519; 90 | 1271.66 | Landolsi, Meriem; Abid, Sonia Crystal structure and Hirshfeld surface analysis of <i>trans</i>-2,5-dimethylpiperazine-1,4-diium tetrachloridocobaltate(II) Acta Crystallographica Section E, 2021, 77, 424-427 |
| 2243789 | CIF HKL Paper | C36 H35.96 Br N2 O6.48 | C 1 2 1 | 15.7469; 13.2627; 17.8602 90; 106.376; 90 | 3578.7 | Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L. Maleate salts of bedaquiline Acta Crystallographica Section E, 2021, 77, 433-445 |
| 2243790 | CIF HKL Paper | C84 H94 Br2 N4 O15 | C 1 2 1 | 16.4119; 13.5643; 17.8475 90; 107.318; 90 | 3793 | Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L. Maleate salts of bedaquiline Acta Crystallographica Section E, 2021, 77, 433-445 |
| 2243791 | CIF HKL Paper | C39.28 H41.57 Br N2 O7.64 | P 1 21 1 | 16.1525; 13.5353; 17.8572 90; 107.359; 90 | 3726.3 | Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L. Maleate salts of bedaquiline Acta Crystallographica Section E, 2021, 77, 433-445 |
| 2243792 | CIF HKL Paper | C81 H89 Br2 N4 O14 | C 1 2 1 | 16.0678; 13.644; 17.872 90; 107.635; 90 | 3733.9 | Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L. Maleate salts of bedaquiline Acta Crystallographica Section E, 2021, 77, 433-445 |
| 2243793 | CIF HKL Paper | C36 H35 Br N2 O6 | C 1 2 1 | 15.7494; 13.3568; 17.8634 90; 106.5; 90 | 3603 | Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L. Maleate salts of bedaquiline Acta Crystallographica Section E, 2021, 77, 433-445 |
| 2243794 | CIF HKL Paper | C36 H35 Br N2 O6 | C 1 2 1 | 15.7494; 13.3568; 17.8634 90; 106.5; 90 | 3603 | Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L. Maleate salts of bedaquiline Acta Crystallographica Section E, 2021, 77, 433-445 |
| 2243795 | CIF HKL Paper | C14 H16 Co N6 S2 | P 1 21/n 1 | 8.2442; 11.9186; 8.9204 90; 100.807; 90 | 860.97 | Krebs, Christoph; Jess, Inke; Näther, Christian Synthesis, crystal structure and thermal properties of poly[bis[μ~2~-3-(aminomethyl)pyridine]bis(thiocyanato)cobalt(II)] Acta Crystallographica Section E, 2021, 77, 428-432 |
| 2243796 | CIF HKL Paper | C12 H16 Cl2 Cu N8 | P 1 21/n 1 | 8.8662; 13.3199; 13.919 90; 90.042; 90 | 1643.79 | Li, Ting Bin; Hu, Ya Li; Li, Ji Kun; He, Guo Fang Chloridotetrakis(imidazole)copper(II) chloride. Corrigendum Acta Crystallographica Section E, 2021, 77, 450-451 |
| 2243797 | CIF HKL Paper | C16 H15 N5 | P 1 21/c 1 | 8.2521; 10.2774; 16.2102 90; 92.07; 90 | 1373.89 | Naghiyev, Farid N.; Tereshina, Tatiana A.; Khrustalev, Victor N.; Akkurt, Mehmet; Khalilov, Ali N.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 6-amino-8-phenyl-1,3,4,8-tetrahydro-2<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidine-7,9-dicarbonitrile Acta Crystallographica Section E, 2021, 77, 512-515 |
| 2243798 | CIF HKL Paper | C16 H13 Cl2 N5 | C 1 c 1 | 8.6598; 16.0275; 11.659 90; 90.7364; 90 | 1618.08 | Naghiyev, Farid N.; Tereshina, Tatiana A.; Khrustalev, Victor N.; Akkurt, Mehmet; Rzayev, Rovnag M.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 6-amino-8-(2,6-dichlorophenyl)-1,3,4,8-tetrahydro-2<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidine-7,9-dicarbonitrile Acta Crystallographica Section E, 2021, 77, 516-521 |
| 2243799 | CIF HKL Paper | C15 H12 Br2 F3 N O2 | P 1 21/c 1 | 6.6543; 18.9031; 25.1995 90; 97.132; 90 | 3145.24 | Mertsalov, Dmitriy F.; Alekseeva, Kseniia A.; Daria, Magrycheva S.; Cheshigin, Maxim E.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Grigoriev, Mikhail S.; Mlowe, Sixberth (3a<i>S</i>,4<i>R</i>,5<i>R</i>,6<i>S</i>,7a<i>R</i>)-4,5-Dibromo-2-[4-(trifluoromethyl)phenyl]-2,3,3a,4,5,6,7,7a-octahydro-3a,6-epoxy-1<i>H</i>-isoindol-1-one: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E, 2021, 77, 466-472 |
| 2243800 | CIF HKL | C20 H28 N2 O8 S4 | P -1 | 5.5843; 9.0061; 12.739 101.537; 94.313; 103.701 | 604.8 | Pacifico, Jessica; Stoeckli-Evans, Helen A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks Acta Crystallographica Section E, 2021, 77, 480-490 |
| 2243801 | CIF HKL | C20 H28 N2 O8 S4 | P -1 | 4.9424; 8.993; 14.19 96.96; 97.14; 100.72 | 608.1 | Pacifico, Jessica; Stoeckli-Evans, Helen A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks Acta Crystallographica Section E, 2021, 77, 480-490 |
| 2243802 | CIF HKL | C20 H27 K N2 O8 S4 | C 1 2/c 1 | 30.08; 8.4716; 9.5908 90; 94.717; 90 | 2435.7 | Pacifico, Jessica; Stoeckli-Evans, Helen A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks Acta Crystallographica Section E, 2021, 77, 480-490 |
| 2243803 | CIF HKL | C20 H26 K2 N2 O8 S4 | C 1 2/c 1 | 27.908; 8.2916; 11.3035 90; 94.753; 90 | 2606.7 | Pacifico, Jessica; Stoeckli-Evans, Helen A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks Acta Crystallographica Section E, 2021, 77, 480-490 |
| 2243804 | CIF HKL Paper | C14 H9 Br N2 O S | P 1 21/c 1 | 24.221; 4.9481; 10.9981 90; 95.371; 90 | 1312.31 | Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Different patterns of supramolecular aggregation in three amides containing <i>N</i>-(benzo[<i>d</i>]thiazolyl) substituents Acta Crystallographica Section E, 2021, 77, 504-511 |
| 2243805 | CIF HKL Paper | C15 H11 N3 O4 S | P n a 21 | 20.085; 20.165; 7.322 90; 90; 90 | 2965.5 | Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Different patterns of supramolecular aggregation in three amides containing <i>N</i>-(benzo[<i>d</i>]thiazolyl) substituents Acta Crystallographica Section E, 2021, 77, 504-511 |
| 2243806 | CIF HKL Paper | C15 H13 N3 O3 S | C 1 2/c 1 | 18.72; 11.5255; 14.7905 90; 115.52; 90 | 2879.8 | Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher Different patterns of supramolecular aggregation in three amides containing <i>N</i>-(benzo[<i>d</i>]thiazolyl) substituents Acta Crystallographica Section E, 2021, 77, 504-511 |
| 2243807 | CIF HKL Paper | C17 H26 N2 O | P 1 21/n 1 | 6.2223; 13.0931; 19.7791 90; 91.825; 90 | 1610.57 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. 5-Methoxy-<i>N</i>,<i>N</i>-di-<i>n</i>-propyltryptamine (5-MeO-DPT): freebase and fumarate Acta Crystallographica Section E, 2021, 77, 522-526 |
| 2243808 | CIF HKL | C19 H28 N2 O3 | P -1 | 9.2956; 9.4443; 12.7427 78.552; 75.929; 60.806 | 943.06 | Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. 5-Methoxy-<i>N</i>,<i>N</i>-di-<i>n</i>-propyltryptamine (5-MeO-DPT): freebase and fumarate Acta Crystallographica Section E, 2021, 77, 522-526 |
| 2243809 | CIF HKL Paper | C28 H25 Cl2 N3 O3 S | P 1 21/c 1 | 18.2076; 14.2859; 10.2713 90; 98.245; 90 | 2644.1 | Akkurt, Mehmet; Marae, Islam S.; Mague, Joel T.; Mohamed, Shaaban K.; Bakhite, Etify A.; Al-Waleedy, Safiyyah A. H. Crystal structure and Hirshfeld surface analysis of 2-{[7-acetyl-8-(4-chlorophenyl)-4-cyano-6-hydroxy-1,6-dimethyl-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-<i>N</i>-(4-chlorophenyl)acetamide Acta Crystallographica Section E, 2021, 77, 527-531 |
| 2243810 | CIF HKL Paper | C15 H15 Br2 N O3 | P 1 21/c 1 | 12.0238; 6.4316; 19.463 90; 96.618; 90 | 1495.1 | Mertsalov, Dmitriy F.; Surina, Nataliya S.; Sorokina, Elena A.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Grigoriev, Mikhail S.; Mlowe, Sixberth Crystal structure and Hirshfeld surface analysis of 4,5-dibromo-2-(4-methoxyphenyl)-2,3,4,4a,5,6,7,7a-octahydro-1<i>H</i>-4,6-epoxy-1<i>H</i>-cyclopenta[<i>c</i>]pyridin-1-one Acta Crystallographica Section E, 2021, 77, 532-536 |
| 2243811 | CIF HKL Paper | C82 H105 Au3 F6 N O11 P3 S2 | P 1 21/n 1 | 24.0018; 12.4867; 28.4299 90; 103.767; 90 | 8275.76 | Hartgerink, Colin T.; Staples, Richard J.; Anderson, Carolyn E. Crystal structure of tris(2-dicyclohexylphosphino-2',6'-dimethoxy-1,1'-biphenyl-κ<i>P</i>)-μ-oxoethenylidene-<i>triangulo</i>-trigold(I) bis(trifluoromethanesulfonyl)imide Acta Crystallographica Section E, 2021, 77, 537-541 |
| 2243812 | CIF HKL Paper | C20 H42 Cl2 N4 O8 | P 1 21/n 1 | 10.689; 8.445; 14.02 90; 92.9; 90 | 1263.9 | Moon, Dohyun; Jeon, Sunghwan; Choi, Jong-Ha Crystal structure of 3,14-dimethyl-2,13-diaza-6,17-diazoniatricyclo[16.4.0.0^7,12^]docosane bis(perchlorate) from synchrotron X-ray data Acta Crystallographica Section E, 2021, 77, 551-554 |
| 2243813 | CIF HKL Paper | C14 H13 N5 O S | P 1 21/c 1 | 12.15369; 14.9466; 7.68691 90; 91.7607; 90 | 1395.72 | Mohamed-Ezzat, Reham A.; Elgemeie, Galal H.; Jones, Peter G. Crystal structures of (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-(1-phenylethylideneamino)-1,6-dihydropyrimidine-5-carbonitrile and (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-[1-(pyridin-2-yl)ethylideneamino]-1,6-dihydropyrimidine-5-carbonitrile Acta Crystallographica Section E, 2021, 77, 547-550 |
| 2243814 | CIF HKL Paper | C13 H12 N6 O S | P 1 21/n 1 | 13.4774; 7.6797; 14.2755 90; 112.401; 90 | 1366.05 | Mohamed-Ezzat, Reham A.; Elgemeie, Galal H.; Jones, Peter G. Crystal structures of (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-(1-phenylethylideneamino)-1,6-dihydropyrimidine-5-carbonitrile and (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-[1-(pyridin-2-yl)ethylideneamino]-1,6-dihydropyrimidine-5-carbonitrile Acta Crystallographica Section E, 2021, 77, 547-550 |
| 2243815 | CIF HKL | C23 H31 N3 O5 Zn | P n a 21 | 14.5937; 11.4425; 13.5794 90; 90; 90 | 2267.6 | Noor, Shabana; Suda, Shintaro; Haraguchi, Tomoyuki; Khatoon, Fehmeeda; Akitsu, Takashiro Chiral crystallization of a zinc(II) complex Acta Crystallographica Section E, 2021, 77, 542-546 |
| 2243816 | CIF HKL Paper | C17 H13 N O3 | C 1 2/c 1 | 20.3883; 7.5925; 17.9858 90; 95.791; 90 | 2769.96 | Benouatas, Assia; Laroum, Rima; Hamdouni, Noudjoud; Zemamouche, Wissame; Debache, Abdelmadjid; Boudjada, Ali Structural study and Hirshfeld surface analysis of (<i>Z</i>)-4-(2-methoxybenzylidene)-3-phenylisoxazol-5(4<i>H</i>)-one Acta Crystallographica Section E, 2021, 77, 564-568 |
| 2243817 | CIF HKL Paper | C17 H26 N2 O | P 1 21/c 1 | 17.3256; 5.5662; 16.7244 90; 97.433; 90 | 1599.31 | Ait Elmachkouri, Younesse; Saber, Asmaa; Irrou, Ezaddine; Amer, Bushra; Mague, Joel T.; Hökelek, Tuncer; Labd Taha, Mohamed; Sebbar, Nada Kheira; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and interaction energy calculation of 1-decyl-2,3-dihydro-1<i>H</i>-benzimidazol-2-one Acta Crystallographica Section E, 2021, 77, 559-563 |
| 2243818 | CIF HKL Paper | As H O7 Te Zn2 | C 1 m 1 | 6.904; 7.7212; 5.726 90; 101.196; 90 | 299.43 | Eder, Felix; Weil, Matthias Crystal structure of Zn~2~(HTeO~3~)(AsO~4~) Acta Crystallographica Section E, 2021, 77, 555-558 |
| 2243819 | CIF HKL Paper | C9 H18 Mo O6 S3 | P -1 | 8.2027; 8.4059; 13.465 78.58; 75.69; 63.94 | 803.9 | Elvers, Benedict J.; Fischer, Christian; Schulzke, Carola Molecular structure of <i>fac</i>-[Mo(CO)~3~(DMSO)~3~] Acta Crystallographica Section E, 2021, 77, 583-587 |
| 2243820 | CIF HKL Paper | C22 H56 Cl2 Cu N4 O6 | P -1 | 8.022; 10.02; 10.354 81.36; 72.84; 69.71 | 744.8 | Moon, Dohyun; Choi, Jong-Ha Crystal structure of diaqua(3,14-diethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane)copper(II) dichloride tetrahydrate Acta Crystallographica Section E, 2021, 77, 569-572 |
| 2243821 | CIF HKL | C30 H28 N5 O13 Sm | C 1 2 1 | 18.9105; 15.7993; 21.5738 90; 98.727; 90 | 6371 | Okumura, Yuta; Takiguchi, Yuji; Nakane, Daisuke; Akitsu, Takashiro Crystal structure and Hirshfeld surface analysis of ((<i>S</i>,<i>S</i>)-2,2'-{[(1,2-diphenylethane-1,2-diyl)bis[(azaniumylylidene)methanylylidene]}bis(6-methoxyphenolato))trinitratosamarium(III) Acta Crystallographica Section E, 2021, 77, 579-582 |
| 2243822 | CIF HKL Paper | C6 H16 B K | P 21 21 21 | 7.4758; 7.6682; 14.801 90; 90; 90 | 848.48 | Fecker, Ann Christin; Freytag, Matthias; Walter, Marc D.; Jones, Peter G. Crystal structure of potassium triethylhydridoborate (`superhydride') Acta Crystallographica Section E, 2021, 77, 592-595 |
| 2243823 | CIF Paper | C19 H13 N | C 1 2/c 1 | 6.0777; 20.9211; 10.2574 90; 102.476; 90 | 1273.45 | Zhao, Meng; Zhang, Gang; Zhang, Jingmiao; Huang, Shan; Liu, Xiuxia; Li, Fei Crystal structure of 4-(anthracen-9-yl)pyridine Acta Crystallographica Section E, 2021, 77, 605-608 |
| 2243824 | CIF HKL Paper | C30 H23 K O8 S2 | P -1 | 6.0036; 9.6432; 25.0966 92.412; 90.548; 105.808 | 1396.42 | Vu Quoc, Trung; Phan Thuy, Linh; Do Ba, Dai; Tran Thi Thuy, Duong; Nguyen Ngoc, Linh; Nguyen Thuy, Chinh; Duong Khanh, Linh; Ha Manh, Hung; Thai, Hoang; Le Van, Khoe; Van Meervelt, Luc Crystal structure of potassium hydrogen bis((<i>E</i>)-2-{4-[3-(thiophen-3-yl)acryloyl]phenoxy}acetate) Acta Crystallographica Section E, 2021, 77, 609-614 |
| 2243825 | CIF HKL Paper | C13 H11 N O2 | P 1 c 1 | 5.5391; 5.7873; 16.0859 90; 99.067; 90 | 509.21 | Mohamed, Shaaban K.; Said, Awad I.; Mague, Joel T.; Aly, Moustafa F.; Akkurt, Mehmet; Elgarhy, Sahar M. I. Crystal structure and Hirshfeld surface analysis of <i>N</i>-[(<i>Z</i>)-(2-hydroxyphenyl)methylidene]aniline <i>N</i>-oxide Acta Crystallographica Section E, 2021, 77, 596-599 |
| 2243826 | CIF HKL Paper | C23 H21 N5 O | P 1 21/n 1 | 8.5517; 18.781; 13.1925 90; 99.757; 90 | 2088.2 | Naghiyev, Farid N.; Mammadova, Gunay Z.; Khalilov, Ali N.; Atioğlu, Zeliha; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 5,7-diphenyl-1,2,3,5,6,7-hexahydroimidazo[1,2-<i>a</i>]pyridine-6,6,8-tricarbonitrile methanol monosolvate Acta Crystallographica Section E, 2021, 77, 600-604 |
| 2243827 | CIF HKL Paper | C13 H16 N4 O | P 1 21/c 1 | 7.1271; 8.9295; 19.2508 90; 94.683; 90 | 1221.06 | Al Ati, Gamal; Chkirate, Karim; Mague, Joel T.; Abad, Nadeem; Achour, Redouane; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and DFT study of <i>N</i>-(2-amino-5-methylphenyl)-2-(5-methyl-1<i>H</i>-pyrazol-3-yl)acetamide Acta Crystallographica Section E, 2021, 77, 638-642 |
| 2243828 | CIF HKL Paper | C14 H17 N3 O5 S | P 1 21/c 1 | 9.1398; 11.1525; 16.3795 90; 97.081; 90 | 1656.85 | Metwally, Nadia H.; Elgemeie, Galal H.; Jones, Peter G. Crystal structure of ethyl 2-(3-amino-5-oxo-2-tosyl-2,5-dihydro-1<i>H</i>-pyrazol-1-yl)acetate Acta Crystallographica Section E, 2021, 77, 615-617 |
| 2243829 | CIF HKL | Ba5 I2 O12 | P n m a | 19.7361; 5.8779; 10.5749 90; 90; 90 | 1226.76 | Bi, David Wenhua; Baral, Priya Ranjan; Magrez, Arnaud Ba~5~(IO~6~)~2~: crystal structure evolution from room temperature to 80K Acta Crystallographica Section E, 2021, 77, 634-637 |
| 2243830 | CIF HKL Paper | Ba5 I2 O12 | P n m a | 19.7568; 5.9003; 10.5869 90; 90; 90 | 1234.13 | Bi, David Wenhua; Baral, Priya Ranjan; Magrez, Arnaud Ba~5~(IO~6~)~2~: crystal structure evolution from room temperature to 80K Acta Crystallographica Section E, 2021, 77, 634-637 |
| 2243831 | CIF HKL Paper | C6 H5 K2 N O8 S | P 1 21/c 1 | 13.3366; 11.5467; 7.3078 90; 103.553; 90 | 1094.02 | Behrman, Edward J.; Parkin, Sean Synthesis and crystal structures of 3,6-dihydroxypicolinic acid and its labile intermediate dipotassium 3-hydroxy-6-(sulfonatooxy)pyridine-2-carboxylate monohydrate Acta Crystallographica Section E, 2021, 77, 623-628 |
| 2243832 | CIF HKL Paper | C6 H5 N O4 | A e m 2 | 10.2045; 6.1282; 9.7293 90; 90; 90 | 608.42 | Behrman, Edward J.; Parkin, Sean Synthesis and crystal structures of 3,6-dihydroxypicolinic acid and its labile intermediate dipotassium 3-hydroxy-6-(sulfonatooxy)pyridine-2-carboxylate monohydrate Acta Crystallographica Section E, 2021, 77, 623-628 |
| 2243833 | CIF HKL Paper | C26 H28 N2 O | P 1 21/n 1 | 14.3057; 9.6392; 16.3024 90; 108.977; 90 | 2125.8 | Smirnov, Daniil E.; Tatarin, Sergei V.; Bezzubov, Stanislav I. Synthesis and crystal structures of <i>N</i>-H, <i>N</i>-phenyl and <i>N</i>-benzyl-2-(4-hexyloxyphenyl)benzimidazoles Acta Crystallographica Section E, 2021, 77, 618-622 |
| 2243834 | CIF HKL | C25 H26 N2 O | P 1 21/n 1 | 9.0089; 16.6539; 13.84 90; 101.419; 90 | 2035.36 | Smirnov, Daniil E.; Tatarin, Sergei V.; Bezzubov, Stanislav I. Synthesis and crystal structures of <i>N</i>-H, <i>N</i>-phenyl and <i>N</i>-benzyl-2-(4-hexyloxyphenyl)benzimidazoles Acta Crystallographica Section E, 2021, 77, 618-622 |
| 2243835 | CIF HKL | C19 H22 N2 O | P b c a | 9.3802; 9.4076; 37.235 90; 90; 90 | 3285.8 | Smirnov, Daniil E.; Tatarin, Sergei V.; Bezzubov, Stanislav I. Synthesis and crystal structures of <i>N</i>-H, <i>N</i>-phenyl and <i>N</i>-benzyl-2-(4-hexyloxyphenyl)benzimidazoles Acta Crystallographica Section E, 2021, 77, 618-622 |
| 2243836 | CIF HKL Paper | C24 H30 Cl4 N4 Zn | P 1 21/n 1 | 9.291; 15.682; 17.275 90; 95.642; 90 | 2504.8 | Tojiboev, Akmaljon; Okmanov, Rasul; Englert, Ulli; Wang, Ruimin; Pan, Fangfang; Turgunov, Kambarali; Tashkhodjaev, Bakhodir Crystal structure and Hirshfeld surface analysis of bis(6,7,8,9-tetrahydro-11<i>H</i>-pyrido[2,1-<i>b</i>]quinazolin-5-ium) tetrachloridozincate Acta Crystallographica Section E, 2021, 77, 629-633 |
| 2243837 | CIF HKL Paper | C9 H22 Al2 Br4 O2 | C 1 2/c 1 | 8.3872; 12.1039; 18.1504 90; 95.646; 90 | 1833.7 | Butcher, Ray J.; Purdy, Andrew P. μ-Methylene-bis[dibromido(diethyl ether-κ<i>O</i>)aluminium(III)]: crystal structure and chemical exchange in solution Acta Crystallographica Section E, 2021, 77, 647-652 |
| 2243838 | CIF HKL Paper | C18 H16 N2 O3 | P -1 | 5.3518; 11.6989; 13.3527 64.019; 80.323; 76.952 | 729.83 | Abad, Nadeem; El Ghayati, Lhoussaine; Kalonji Mubengayi, Camille; Essassi, El Mokhtar; Kaya, Savaş; Mague, Joel T.; Ramli, Youssef Crystal structure and Hirshfeld surface analysis of 2-(2-oxo-3-phenyl-1,2,3,8a-tetrahydroquinoxalin-1-yl)ethyl acetate Acta Crystallographica Section E, 2021, 77, 643-646 |
| 2243839 | CIF HKL Paper | C22 H18 N2 O2 | P 1 21/c 1 | 7.4089; 11.4544; 21.9491 90; 97.814; 90 | 1845.4 | Kansiz, Sevgi; Tatlidil, Digdem; Dege, Necmi; Aktas, Feyzi Alkim; Al-Asbahy, Samir Osman Mohammed; Alaman Agar, Aysen Crystal structure and molecular docking study of (<i>E</i>)-2-{[(<i>E</i>)-2-hydroxy-5-methylbenzylidene]hydrazinylidene}-1,2-diphenylethan-1-one Acta Crystallographica Section E, 2021, 77, 658-662 |
| 2243840 | CIF HKL Paper | C29 H29 N3 O4 S | P 1 21/n 1 | 8.4506; 23.112; 13.601 90; 99.021; 90 | 2623.6 | Sayed, Eman M.; Hassanien, Reda; Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Farhan, Nasser; Bakhite, Etify A.; Al-Waleedy, Safiyyah A. H. Crystal structure and Hirshfeld surface analysis of 2-{[7-acetyl-4-cyano-6-hydroxy-8-(4-methoxyphenyl)-1,6-dimethyl-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-<i>N</i>-phenylacetamide Acta Crystallographica Section E, 2021, 77, 663-667 |
| 2243841 | CIF HKL Paper | C16 H11 Cl N2 O2 | C 1 c 1 | 32.83; 4.4049; 18.844 90; 90.13; 90 | 2725.1 | Bougueria, Hassiba; Chetioui, Souheyla; Bensegueni, Mohammed Abdellatif; Djukic, Jean-Pierre; Benarous, Nesrine Crystal structure and Hirshfeld surface analysis of 1-[(<i>E</i>)-2-(5-chloro-2-hydroxyphenyl)hydrazin-1-ylidene]naphthalen-2(1<i>H</i>)-one Acta Crystallographica Section E, 2021, 77, 672-676 |
| 2243842 | CIF HKL Paper | C20 H23 N O2 | P 21 21 21 | 6.1313; 7.371; 38.1143 90; 90; 90 | 1722.53 | Miyamoto, Hisakazu; Takahashi, Hiroki Crystal structure and photoreactive behaviour of <i>N</i>,<i>N</i>-diisopropyl(<i>p</i>-phenylphenyl)glyoxylamide Acta Crystallographica Section E, 2021, 77, 653-657 |
| 2243843 | CIF HKL Paper | C32 H36 Cu8 F36 O8 | P 1 21/n 1 | 10.3302; 19.5926; 13.1516 90; 101.004; 90 | 2612.88 | Purdy, Andrew P.; Butcher, Ray J. Tetrakis[μ~2~-1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-olato]tetrakis(μ~3~-2-methylpropan-2-olato)octacopper(I) Acta Crystallographica Section E, 2021, 77, 668-671 |
| 2243844 | CIF HKL Paper | C22 H48 Br2 Cu N4 O2 | P -1 | 8.08; 10.38; 17.511 97.02; 92.91; 111.31 | 1350.8 | Moon, Dohyun; Jeon, Sunghwan; Lim, Woo Taik; Ryoo, Keon Sang; Choi, Jong-Ha Crystal structure of diaqua(3,14-diethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane)copper(II) (3,14-diethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane)copper(II) tetrabromide dihydrate, [Cu(C~22~H~44~N~4~)(H~2~O)~2~][Cu(C~22~H~44~N~4~)]Br~4~·2H~2~O Acta Crystallographica Section E, 2021, 77, 677-680 |
| 2243845 | CIF HKL Paper | C34 H58 O2 | P 1 21 1 | 12.0622; 9.2715; 13.814 90; 92.306; 90 | 1543.63 | Akduran, Nurcan; Karakurt, Tuncay; Hökelek, Tuncer Crystal structure, Hirshfeld surface analysis, interaction energy, and DFT studies of cholesteryl heptanoate Acta Crystallographica Section E, 2021, 77, 686-691 |
| 2243846 | CIF HKL Paper | C20 H18 N2 O3 | C 1 2/c 1 | 17.947; 4.5907; 41.305 90; 91.016; 90 | 3402.6 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher The crystal structures of three disordered 2-substituted benzimidazole esters Acta Crystallographica Section E, 2021, 77, 473-479 |
| 2243847 | CIF HKL Paper | C29 H24 N2 O2 | P 1 21/c 1 | 18.467; 8.686; 14.242 90; 95.359; 90 | 2274.5 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher The crystal structures of three disordered 2-substituted benzimidazole esters Acta Crystallographica Section E, 2021, 77, 473-479 |
| 2243848 | CIF HKL Paper | C21 H19 Cl N4 O2 | P 1 21/n 1 | 11.1095; 9.5126; 18.6747 90; 95.079; 90 | 1965.8 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher The crystal structures of three disordered 2-substituted benzimidazole esters Acta Crystallographica Section E, 2021, 77, 473-479 |
| 2243849 | CIF HKL Paper | C14 H6 F4 O2 | P b c n | 7.0588; 7.4008; 21.5265 90; 90; 90 | 1124.56 | Brown, Loren C.; Balaich, Gary J. Crystal structure of 1,2-bis(3,5-difluorophenyl)ethane-1,2-dione Acta Crystallographica Section E, 2021, 77, 700-702 |
| 2243850 | CIF HKL Paper | C18 H26 Cl6 N2 O4 Sn | P 1 21/n 1 | 6.9762; 22.806; 8.0394 90; 90.948; 90 | 1278.9 | Ndiolene, Adrienne; Diop, Tidiane; Boye, Mouhamadou Sembène; Diasse-Sarr, Aminata; Englert, Ulli A new organic‒inorganic compound, ethylenediammonium hexachloridostannate(IV) <i>p</i>-anisaldehyde disolvate Acta Crystallographica Section E, 2021, 77, 696-699 |
| 2243851 | CIF HKL Paper | C H5 I3 N2 | P -1 | 6.0767; 6.1886; 11.727 97.512; 100.345; 99.437 | 422.1 | Ordinartsev, Artem A.; Petrov, Andrey A.; Lyssenko, Konstantin A.; Petrov, Andrey V.; Goodilin, Eugene A.; Tarasov, Alexey B. Crystal structure of new formamidinium triiodide jointly refined by single-crystal XRD, Raman scattering spectroscopy and DFT assessment of hydrogen-bond network features Acta Crystallographica Section E, 2021, 77, 692-695 |
| 2243852 | CIF HKL Paper | C63 H80 Cu6 N8 O21 | P -1 | 13.6406; 14.0568; 18.5907 83.626; 86.186; 72.288 | 3372.7 | Kébé, Momath; Thiam, Ibrahima Elhadji; Sow, Mouhamadou Moustapha; Diouf, Ousmane; Barry, Aliou Hamady; Sall, Abdou Salam; Retailleau, Pascal; Gaye, Mohamed Hexanuclear copper(II) complex of 2-hydroxy-<i>N</i>,<i>N</i>'-bis[1-(2-hydroxyphenyl)ethylidene]propane-1,3-diamine incorporating an open-cubane core Acta Crystallographica Section E, 2021, 77, 708-713 |
| 2243853 | CIF HKL Paper | C13 H27 N O6 Sr | P 1 21/c 1 | 8.1516; 19.1921; 11.4288 90; 99.295; 90 | 1764.52 | Seiss, Maximilian; Schmitz, Sebastian; Börner, Martin; Monakhov, Kirill Yu. Synthesis and crystal structure of a one-dimensional chain-like strontium(II) coordination polymer built of <i>N</i>-methyldiethanolamine and isobutyrate ligands Acta Crystallographica Section E, 2021, 77, 703-707 |
| 2243854 | CIF HKL Paper | C11 H8 Co N6 O4 | P 1 21/c 1 | 13.3368; 6.8727; 13.6015 90; 103.478; 90 | 1212.38 | Zhao, Chen; Li, Yi; Xiao, Jin-Sheng; Zhang, Peng-Dan; Wu, Xue-Qian; Chen, Qiang Synthesis and crystal structure of poly[(3-amino-1,2,4-triazole)(μ~3~-1<i>H</i>-benzimidazole-5,6-dicarboxylato)cobalt(II)] Acta Crystallographica Section E, 2021, 77, 714-717 |
| 2243855 | CIF HKL Paper | C17 H14 Cl N3 O4 | P -1 | 8.0218; 10.2278; 10.6714 98.8503; 108.005; 96.3852 | 810.92 | Naghiyev, Farid N.; Grishina, Maria M.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynova, Afet T.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of ethyl 6'-amino-2'-(chloromethyl)-5'-cyano-2-oxo-1,2-dihydrospiro[indoline-3,4'-pyran]-3'-carboxylate Acta Crystallographica Section E, 2021, 77, 739-743 |
| 2243856 | CIF HKL Paper | C8 H16 Br2 Cu2 S2 | P -1 | 6.8076; 9.7078; 10.1579 75.804; 89.845; 89.594 | 650.79 | Knorr, Michael; Viau, Lydie; Rousselin, Yoann; Kubicki, Marek M. Crystal structure of the two-dimensional coordination polymer poly[di-μ-bromido-bis(μ-tetrahydrothiophene)dicopper(I)] Acta Crystallographica Section E, 2021, 77, 744-748 |
| 2243857 | CIF HKL Paper | C21 H20 N2 O3 S | P 1 21/n 1 | 10.7365; 9.759; 18.56 90; 90.066; 90 | 1944.67 | Al-Waleedy, Safiyyah A. H.; Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Abbady, Mohamed S.; Bakhite, Etify A. Crystal structure and Hirshfeld surface analysis of ethyl 2-({5-acetyl-3-cyano-6-methyl-4-[(<i>E</i>)-2-phenylethenyl]pyridin-2-yl}sulfanyl)acetate Acta Crystallographica Section E, 2021, 77, 730-733 |
| 2243858 | CIF HKL Paper | C12 H16 Cl4 Cu N2 | I 1 2/c 1 | 15.2354; 8.3683; 12.8372 90; 99.205; 90 | 1615.59 | Mehmood, Tahir; Bhosale, Rajesh S.; Reddy, J. Prakasha Bis(2-methylpyridinium) tetrachloridocuprate(II): synthesis, structure and Hirshfeld surface analysis Acta Crystallographica Section E, 2021, 77, 726-729 |
| 2243859 | CIF HKL Paper | C15 H12 N2 O2 | P 21 21 21 | 6.569; 12.7956; 14.1278 90; 90; 90 | 1187.5 | Ali, Arif; Muslim, Mohd; Kamaal, Saima; Ahmed, Adeeba; Ahmad, Musheer; Shahid, M.; Khan, Jamal A.; Dege, Necmi; Javed, Saleem; Mashrai, Ashraf Crystal structure, Hirshfeld and electronic transition analysis of 2-[(1<i>H</i>-benzimidazol-1-yl)methyl]benzoic acid Acta Crystallographica Section E, 2021, 77, 755-758 |
| 2243860 | CIF HKL Paper | C14 H12.448 N4 O7.224 | C 1 2/c 1 | 24.2097; 12.6311; 10.4022 90; 113.133; 90 | 2925.2 | Atioğlu, Zeliha; Akkurt, Mehmet; Mammadova, Gunay Z.; Huseynov, Fatali E.; Hajiyeva, Sevinj R.; Shamilov, Nazim T.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of dimethyl 5-[2-(2,4,6-trioxo-1,3-diazinan-5-ylidene)hydrazin-1-yl]benzene-1,3-dicarboxylate 0.224-hydrate Acta Crystallographica Section E, 2021, 77, 759-764 |
| 2243861 | CIF HKL Paper | C73 H126 Br8 N28 O4 P8 Re2 Ru4 | P 1 21/c 1 | 12.6027; 17.7075; 23.0252 90; 101.914; 90 | 5027.7 | Pacheco, Mario; Alvarez, Natalia; Cuevas, Alicia; Romerosa, Antonio; Lloret, Francesc; Kremer, Carlos Crystal structure and magnetic study of the complex salt [RuCp(PTA)~2~‒μ-CN-1κ<i>C</i>:2κ<i>N</i>‒RuCp(PTA)~2~][Re(NO)Br~4~(EtOH)~0.5~(MeOH)~0.5~] Acta Crystallographica Section E, 2021, 77, 749-754 |
| 2243862 | CIF HKL Paper | C22 H28 N O6 S3 | P -1 | 10.6886; 11.4878; 11.8389 76.007; 65.584; 63.213 | 1178.87 | Sribala, R.; Srinivasan, N.; Rajalaksmi, P.; Indumathi, S.; Krishnakumar, R.V. Crystal structure and Hirshfeld surface analysis of a pyrrolo-thiazine complex Acta Crystallographica Section E, 2021, 77, 770-774 |
| 2243863 | CIF HKL Paper | C15 H13 Cl2 N3 O3 S | P -1 | 7.7426; 10.429; 10.934 85.51; 76.92; 81.04 | 848.64 | Purandara, H.; Foro, Sabine; Thimme Gowda, B. Crystal structures of three <i>N</i>-acylhydrazone isomers Acta Crystallographica Section E, 2021, 77, 780-784 |
| 2243864 | CIF HKL Paper | C15 H13 Cl2 N3 O3 S | P -1 | 9.491; 9.976; 10.446 67.22; 66.8; 86.32 | 833.59 | Purandara, H.; Foro, Sabine; Thimme Gowda, B. Crystal structures of three <i>N</i>-acylhydrazone isomers Acta Crystallographica Section E, 2021, 77, 780-784 |
| 2243865 | CIF HKL Paper | C15 H13 Cl2 N3 O3 S | P -1 | 6.7234; 10.281; 13.611 74.98; 87.11; 75.34 | 879 | Purandara, H.; Foro, Sabine; Thimme Gowda, B. Crystal structures of three <i>N</i>-acylhydrazone isomers Acta Crystallographica Section E, 2021, 77, 780-784 |
| 2243866 | CIF HKL Paper | C24 H16 Cl12 N2 O4 | P 1 21/c 1 | 8.9549; 10.5908; 16.6043 90; 103.499; 90 | 1531.24 | Alikhanova, Aygun I.; Atioğlu, Zeliha; Akkurt, Mehmet; Mlowe, Sixberth Crystal structure and Hirshfeld surface analysis of (3a<i>R</i>,4<i>S</i>,7<i>S</i>,7a<i>S</i>)-4,5,6,7,8,8-hexachloro-2-{6-[(3a<i>R</i>,4<i>R</i>,7<i>R</i>,7a<i>S</i>)-4,5,6,7,8,8-hexachloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2<i>H</i>-4,7-methanoisoindol-2-yl]hexyl}-3a,4,7,7a-tetrahydro-1<i>H</i>-4,7-methanoisoindole-1,3(2<i>H</i>)-dione Acta Crystallographica Section E, 2021, 77, 775-779 |
| 2243867 | CIF HKL Paper | C32 H84 Ca2 N12 O20 P4 | P 1 21/n 1 | 10.6249; 15.5774; 17.0925 90; 96.707; 90 | 2809.6 | Micallef, Duncan; Baisch, Ulrich Di-μ-nitrato-bis(μ-octaethyl pyrophosphoramide)bis[aquadinitratocalcium(II)] Acta Crystallographica Section E, 2021, 77, 795-798 |
| 2243868 | CIF HKL Paper | C15 H21 N O3 | P 1 21/c 1 | 18.4574; 5.702; 14.8058 90; 113.468; 90 | 1429.33 | Martens, Viktor; Görls, Helmar; Imhof, Wolfgang Crystal structure of 2-oxo-2-phenylethyl diisopropylcarbamate Acta Crystallographica Section E, 2021, 77, 785-787 |
| 2243869 | CIF HKL Paper | C17 H19 N3 O S | P -1 | 8.0605; 9.5635; 11.4397 70.578; 82.671; 68.723 | 774.95 | Tan, Ming Yueh; Kwong, Huey Chong; Crouse, Karen A.; Ravoof, Thahira B. S. A.; Tiekink, Edward R. T. 1-{(<i>E</i>)-[4-(4-Hydroxyphenyl)butan-2-ylidene]amino}-3-phenylthiourea: crystal structure, Hirshfeld surface analysis and computational study Acta Crystallographica Section E, 2021, 77, 788-794 |
| 2243870 | CIF HKL Paper | C14 H11 N O2 | P 1 21/c 1 | 28.29; 3.9052; 20.264 90; 105.817; 90 | 2154 | Thiruvalluvar, Aravazhi Amalan; Sridharan, M.; Rajendra Prasad, K. J.; Zeller, M. Synthesis and crystal structure of 1-hydroxy-8-methyl-9<i>H</i>-carbazole-2-carbaldehyde Acta Crystallographica Section E, 2021, 77 |
| 2243871 | CIF HKL | C29 H39 Cl3 O7 | P 1 21 1 | 7.3633; 15.952; 12.657 90; 94.14; 90 | 1482.8 | Okmanov, R. Ya.; Makhmudova, M. M.; Bobaev, I. D.; Tashkhodjaev, B. Withanolides from <i>Physalis angulata</i> L. Acta Crystallographica Section E, 2021, 77, 804-808 |
| 2243872 | CIF HKL | C28 H40 O7 | P 1 | 6.2374; 9.5938; 11.351 112.81; 96.49; 93.13 | 618.5 | Okmanov, R. Ya.; Makhmudova, M. M.; Bobaev, I. D.; Tashkhodjaev, B. Withanolides from <i>Physalis angulata</i> L. Acta Crystallographica Section E, 2021, 77, 804-808 |
| 2243873 | CIF HKL Paper | C22 H14 Cl4 N4 | P 1 21/c 1 | 16.0289; 13.1213; 11.1286 90; 108.073; 90 | 2225.1 | Shikhaliyev, Namiq Q.; Atioğlu, Zeliha; Akkurt, Mehmet; Ahmadova, Nigar E.; Askerov, Rizvan K.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of 1,3-bis{2,2-dichloro-1-[(<i>E</i>)-phenyldiazenyl]ethenyl}benzene Acta Crystallographica Section E, 2021, 77, 814-818 |
| 2243874 | CIF HKL | C26 H38 O5 S | P 21 21 21 | 6.4201; 17.6239; 20.8997 90; 90; 90 | 2364.74 | Rousselin, Yoann; Yolka, Sylvie; Clavel, Alexandre Crystal structures of two polymorphs of tixocortol pivalate Acta Crystallographica Section E, 2021, 77, 809-813 |
| 2243875 | CIF HKL | C26 H38 O5 S | P 21 21 21 | 6.0146; 19.2817; 20.9887 90; 90; 90 | 2434.1 | Rousselin, Yoann; Yolka, Sylvie; Clavel, Alexandre Crystal structures of two polymorphs of tixocortol pivalate Acta Crystallographica Section E, 2021, 77, 809-813 |
| 2243876 | CIF HKL Paper | C48 H50.27 Cu2 F6 N8 O1.13 Zr | P -1 | 8.6219; 10.8064; 12.9992 103.078; 104.013; 98.863 | 1116.33 | Wang, Yiran; Nisbet, Matthew L.; Poeppelmeier, Kenneth R. Crystal structures of two copper(I)‒6,6'-dimethyl-2,2'-bipyridyl (dmbpy) compounds, [Cu(dmbpy)~2~]~2~[<i>M</i>F~6~]·<i>x</i>H~2~O (<i>M</i> = Zr, Hf; <i>x</i> = 1.134, 0.671) Acta Crystallographica Section E, 2021, 77, 819-823 |
| 2243877 | CIF HKL | C48 H49.34 Cu2 F6 Hf N8 O0.67 | P -1 | 8.5737; 10.7967; 13.0183 103.273; 103.662; 98.785 | 1112.08 | Wang, Yiran; Nisbet, Matthew L.; Poeppelmeier, Kenneth R. Crystal structures of two copper(I)‒6,6'-dimethyl-2,2'-bipyridyl (dmbpy) compounds, [Cu(dmbpy)~2~]~2~[<i>M</i>F~6~]·<i>x</i>H~2~O (<i>M</i> = Zr, Hf; <i>x</i> = 1.134, 0.671) Acta Crystallographica Section E, 2021, 77, 819-823 |
| 2243878 | CIF HKL Paper | C16 H12 F5 N3 O | C 1 2/c 1 | 19.0048; 11.5216; 17.2227 90; 116.526; 90 | 3374.2 | Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Niyazova, Aytan A.; Mlowe, Sixberth Crystal structure and Hirshfeld surface analysis of (2<i>Z</i>)-<i>N</i>,<i>N</i>-dimethyl-2-(pentafluorophenyl)-2-(2-phenylhydrazin-1-ylidene)acetamide Acta Crystallographica Section E, 2021, 77, 829-833 |
| 2243879 | CIF HKL Paper | C20 H15 N O3 | P 1 21/n 1 | 8.2284; 13.7693; 13.923 90; 96.155; 90 | 1568.37 | Bouzian, Younos; Chkirate, Karim; Mague, Joel T.; Al-Ostoot, Fares Hezam; Hammou Ahabchane, Noureddine; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and density functional theory study of benzyl 2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydroquinoline-4-carboxylate Acta Crystallographica Section E, 2021, 77, 824-828 |
| 2243880 | CIF HKL Paper | C19 H16 N2 O4 | P 1 21/c 1 | 7.0111; 11.0123; 20.493 90; 96.202; 90 | 1573 | El Hafi, Mohamed; Lahmidi, Sanae; El Ghayati, Lhoussaine; Hökelek, Tuncer; Mague, Joel T.; Amer, Bushra; Sebbar, Nada Kheira; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and interaction energy calculation of 4-(furan-2-yl)-2-(6-methyl-2,4-dioxopyran-3-ylidene)-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepine Acta Crystallographica Section E, 2021, 77, 834-838 |
| 2243881 | CIF HKL Paper | C44 H34 N8 O4 S2 Zn | P 1 21/n 1 | 13.4029; 15.831; 19.6257 90; 107.841; 90 | 3964 | Tan, Ming Yueh; Kwong, Huey Chong; Crouse, Karen A.; Ravoof, Thahira B. S. A.; Tiekink, Edward R. T. Bis{<i>N</i>'-[3-(4-nitrophenyl)-1-phenylprop-2-en-1-ylidene]-<i>N</i>-phenylcarbamimidothioato}zinc(II): crystal structure, Hirshfeld surface analysis and computational study Acta Crystallographica Section E, 2021, 77, 839-846 |
| 2243882 | CIF HKL Paper | C26 H23 Fe O P S | P 1 21/c 1 | 7.3643; 17.909; 16.71 90; 95.23; 90 | 2194.7 | Bandyopadhyay, Uchchhal; Sundararaju, Basker; Poli, Rinaldo; Manoury, Eric; Daran, Jean-Claude Synthesis and crystallographic studies of 2-(diphenylphosphinothioyl)-2-(3-oxobut-1-en-yl)ferrocene Acta Crystallographica Section E, 2021, 77, 853-856 |
| 2243883 | CIF HKL Paper | C16 H13 N3 O2 S | P 1 | 4.71248; 6.96463; 11.5455 105.617; 95.7876; 95.9993 | 359.638 | Azzam, Rasha A.; Elgemeie, Galal H.; Seif, Mona M.; Jones, Peter G. Crystal structure of <i>N</i>'-[2-(benzo[<i>d</i>]thiazol-2-yl)acetyl]benzohydrazide, an achiral compound crystallizing in space group <i>P</i>1 with <i>Z</i> = 1 Acta Crystallographica Section E, 2021, 77 |
| 2243884 | CIF HKL Paper | C18 H12 N2 O2 | P -1 | 9.266; 12.959; 13.101 96.2487; 109.181; 106.106 | 1392.39 | Singh, Neetu; Noh, Ga Hee; Park, Hyoung-Ryun; Lee, Junseong Crystal structure, Hirshfeld surface and photophysical analysis of 2-nitro-3-phenyl-9<i>H</i>-carbazole Acta Crystallographica Section E, 2021, 77 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!