Crystallography Open Database
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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2107618 | CIF HKL | C6 H12 Cl2 O Pd S2 | P 1 21/n 1 | 7.0391; 11.4914; 13.4616 90; 96.676; 90 | 1081.51 | Tidey, Jeremiah P.; Wong, Henry L. S.; McMaster, Jonathan; Schröder, Martin; Blake, Alexander J. High-pressure studies of three polymorphs of a palladium(II) oxathioether macrocyclic complex Acta Crystallographica Section B, 2016, 72, 357-371 |
| 2107619 | CIF HKL | C6 H12 Cl2 O Pd S2 | P 1 21/n 1 | 7.0534; 11.5465; 13.4903 90; 96.648; 90 | 1091.29 | Tidey, Jeremiah P.; Wong, Henry L. S.; McMaster, Jonathan; Schröder, Martin; Blake, Alexander J. High-pressure studies of three polymorphs of a palladium(II) oxathioether macrocyclic complex Acta Crystallographica Section B, 2016, 72, 357-371 |
| 2107620 | CIF HKL | C6 H12 Cl2 O Pd S2 | P 1 21/n 1 | 7.0638; 11.6103; 13.5208 90; 96.459; 90 | 1101.8 | Tidey, Jeremiah P.; Wong, Henry L. S.; McMaster, Jonathan; Schröder, Martin; Blake, Alexander J. High-pressure studies of three polymorphs of a palladium(II) oxathioether macrocyclic complex Acta Crystallographica Section B, 2016, 72, 357-371 |
| 2107621 | CIF HKL | C6 H12 Cl2 O Pd S2 | P 1 21/n 1 | 7.0749; 11.6762; 13.5923 90; 96.32; 90 | 1116.01 | Tidey, Jeremiah P.; Wong, Henry L. S.; McMaster, Jonathan; Schröder, Martin; Blake, Alexander J. High-pressure studies of three polymorphs of a palladium(II) oxathioether macrocyclic complex Acta Crystallographica Section B, 2016, 72, 357-371 |
| 2107622 | CIF HKL Paper | C15 H14 Mn N2 O6 | P b c a | 14.648; 12.4006; 16.6062 90; 90; 90 | 3016.4 | Madsen, Solveig R.; Moggach, Stephen A.; Overgaard, Jacob; Brummerstedt Iversen, Bo Anisotropic compressibility of the coordination polymer emim[Mn(btc)] Acta Crystallographica Section B, 2016, 72, 389-394 |
| 2107623 | CIF HKL | C15 H14 Mn N2 O6 | P b c a | 14.3847; 12.2888; 16.6029 90; 90; 90 | 2934.9 | Madsen, Solveig R.; Moggach, Stephen A.; Overgaard, Jacob; Brummerstedt Iversen, Bo Anisotropic compressibility of the coordination polymer emim[Mn(btc)] Acta Crystallographica Section B, 2016, 72, 389-394 |
| 2107624 | CIF | C15 H14 Mn N2 O6 | P b c a | 14.1985; 12.0745; 16.5616 90; 90; 90 | 2839.3 | Madsen, Solveig R.; Moggach, Stephen A.; Overgaard, Jacob; Brummerstedt Iversen, Bo Anisotropic compressibility of the coordination polymer emim[Mn(btc)] Acta Crystallographica Section B, 2016, 72, 389-394 |
| 2107625 | CIF HKL | C15 H14 Mn N2 O6 | P b c a | 14.15; 11.86; 16.574 90; 90; 90 | 2781.4 | Madsen, Solveig R.; Moggach, Stephen A.; Overgaard, Jacob; Brummerstedt Iversen, Bo Anisotropic compressibility of the coordination polymer emim[Mn(btc)] Acta Crystallographica Section B, 2016, 72, 389-394 |
| 2107626 | CIF HKL | C15 H14 Mn N2 O6 | P b c a | 14.138; 11.686; 16.583 90; 90; 90 | 2739.8 | Madsen, Solveig R.; Moggach, Stephen A.; Overgaard, Jacob; Brummerstedt Iversen, Bo Anisotropic compressibility of the coordination polymer emim[Mn(btc)] Acta Crystallographica Section B, 2016, 72, 389-394 |
| 2107627 | CIF HKL | C15 H14 Mn N2 O6 | P b c a | 14.14; 11.319; 16.6 90; 90; 90 | 2656.8 | Madsen, Solveig R.; Moggach, Stephen A.; Overgaard, Jacob; Brummerstedt Iversen, Bo Anisotropic compressibility of the coordination polymer emim[Mn(btc)] Acta Crystallographica Section B, 2016, 72, 389-394 |
| 2107628 | CIF HKL Paper | Bi2.27 Cu O6.18 Sr1.73 | A 1 2/a 1 | 5.3869; 5.3874; 24.579 90; 90.01; 90 | 713.32 | Mironov, Andrei V.; Petříček, Vaclav; Khasanova, Nellie R.; Antipov, Evgeny V. New insight on bismuth cuprates with incommensurate modulated structures Acta Crystallographica Section B, 2016, 72, 395-403 |
| 2107629 | CIF HKL Paper | C12 H30 Co N11 O9 | P 1 21 1 (c,2*a+c,b) | 8.4283; 14.5984; 15.7057 90; 90; 89.9943 | 1932.42 | Dey, Somnath; Schönleber, Andreas; Mondal, Swastik; Prathapa, Siriyara Jagannatha; van Smaalen, Sander; Larsen, Finn Krebs The <i>Z</i>' = 12 superstructure of Λ-cobalt(III) sepulchrate trinitrate governed by C—H···O hydrogen bonds Acta Crystallographica Section B, 2016, 72, 372-380 |
| 2107630 | CIF HKL Paper | C11 H19 N | P 1 21/m 1 | 8.2451; 6.5202; 8.8214 90; 96.509; 90 | 471.18 | Mohamed, Sharmarke; Karothu, Durga Prasad; Naumov, Panče Using crystal structure prediction to rationalize the hydration propensities of substituted adamantane hydrochloride salts Acta Crystallographica Section B, 2016, 72, 551-561 |
| 2107631 | CIF HKL | C11 H20 Cl N | P 21 21 21 | 6.6114; 20.4778; 24.6057 90; 90; 90 | 3331.3 | Mohamed, Sharmarke; Karothu, Durga Prasad; Naumov, Panče Using crystal structure prediction to rationalize the hydration propensities of substituted adamantane hydrochloride salts Acta Crystallographica Section B, 2016, 72, 551-561 |
| 2107632 | CIF HKL | C21 H27 Cl N2 | I 4/m | 20.275; 20.275; 5.0989 90; 90; 90 | 2096.03 | Chodkiewicz, Michał Leszek; Makal, Anna; Gajda, Roman; Vidovic, Dragoslav; Woźniak, Krzysztof An insight into real and average structure from diffuse X-ray scattering ‒ a case study Acta Crystallographica Section B, 2016, 72, 571-583 |
| 2107633 | CIF HKL | C21 H27 Cl N2 | I 4/m | 20.275; 20.275; 5.0989 90; 90; 90 | 2096.03 | Chodkiewicz, Michał Leszek; Makal, Anna; Gajda, Roman; Vidovic, Dragoslav; Woźniak, Krzysztof An insight into real and average structure from diffuse X-ray scattering ‒ a case study Acta Crystallographica Section B, 2016, 72, 571-583 |
| 2107634 | CIF HKL | C21 H27 Cl N2 | I 4/m | 19.924; 19.924; 5.088 90; 90; 90 | 2019.8 | Chodkiewicz, Michał Leszek; Makal, Anna; Gajda, Roman; Vidovic, Dragoslav; Woźniak, Krzysztof An insight into real and average structure from diffuse X-ray scattering ‒ a case study Acta Crystallographica Section B, 2016, 72, 571-583 |
| 2107635 | CIF HKL | C21 H27 Cl N2 | I 4/m | 19.924; 19.924; 5.088 90; 90; 90 | 2019.8 | Chodkiewicz, Michał Leszek; Makal, Anna; Gajda, Roman; Vidovic, Dragoslav; Woźniak, Krzysztof An insight into real and average structure from diffuse X-ray scattering ‒ a case study Acta Crystallographica Section B, 2016, 72, 571-583 |
| 2107636 | CIF HKL Paper | C6 H15 As2 N3 O10 | P 1 21 1 | 9.2196; 8.9077; 8.83 90; 108.69; 90 | 686.93 | Tyagi, Nidhi; Sinha, Nidhi; Yadav, Harsh; Kumar, Binay Growth, morphology, structure and characterization of <small>L</small>-histidinium dihydrogen arsenate orthoarsenic acid single crystal Acta Crystallographica Section B, 2016, 72, 593-601 |
| 2107637 | CIF Paper | In Mo4 O6 | P 4/m b m | 9.6664; 9.6664; 2.8645 90; 90; 90 | 267.66 | Schultz, Peter; Simon, Arndt; Oeckler, Oliver Modulated crystal structure of InMo~4~O~6~ Acta Crystallographica Section B, 2016, 72, 642-649 |
| 2107638 | CIF HKL | C32 H50 O4 | P 21 21 21 | 12.9577; 13.0369; 16.3908 90; 90; 90 | 2768.87 | Langer, Dominik; Wicher, Barbara; Szczołko, Wojciech; Gdaniec, Maria; Tykarska, Ewa Self-assembly modes of glycyrrhetinic acid esters in view of the crystal packing of related triterpene molecules Acta Crystallographica Section B, 2016, 72, 584-592 |
| 2107639 | CIF HKL | C33 H52 O4 | P 21 21 21 | 11.7789; 13.0812; 18.7845 90; 90; 90 | 2894.36 | Langer, Dominik; Wicher, Barbara; Szczołko, Wojciech; Gdaniec, Maria; Tykarska, Ewa Self-assembly modes of glycyrrhetinic acid esters in view of the crystal packing of related triterpene molecules Acta Crystallographica Section B, 2016, 72, 584-592 |
| 2107640 | CIF HKL | C36 H57 N O5 | P 21 21 21 | 12.87; 13.6972; 18.5682 90; 90; 90 | 3273.26 | Langer, Dominik; Wicher, Barbara; Szczołko, Wojciech; Gdaniec, Maria; Tykarska, Ewa Self-assembly modes of glycyrrhetinic acid esters in view of the crystal packing of related triterpene molecules Acta Crystallographica Section B, 2016, 72, 584-592 |
| 2107952 | CIF Paper | Al0.16 Ba2 Ca0.05 Cu2.84 O6.75 Y0.95 | P 4/m m m | 3.8551; 3.8551; 11.6782 90; 90; 90 | 173.56 | Pascale, Lise; Truccato, Marco; Operti, Lorenza; Agostino, Angelo Effect of Al and Ca co-doping, in the presence of Te, in superconducting YBCO whiskers growth Acta Crystallographica Section B, 2016, 72, 702-708 |
| 2107953 | CIF | Al0.1 Ba2 Ca0.08 Cu2.9 O6.89 Y0.92 | P 4/m m m | 3.8526; 3.8526; 11.666 90; 90; 90 | 173.15 | Pascale, Lise; Truccato, Marco; Operti, Lorenza; Agostino, Angelo Effect of Al and Ca co-doping, in the presence of Te, in superconducting YBCO whiskers growth Acta Crystallographica Section B, 2016, 72, 702-708 |
| 2107954 | CIF Paper | C H6 I3 N Pb | I 4 2 2 | 8.88375; 8.88375; 12.701 90; 90; 90 | 1002.38 | Arakcheeva, Alla; Chernyshov, Dmitry; Spina, Massimo; Forró, László; Horváth, Endre CH~3~NH~3~PbI~3~: precise structural consequences of water absorption at ambient conditions Acta Crystallographica Section B, 2016, 72, 716-722 |
| 2107955 | CIF HKL Paper | C0.925 H5.55 I2.982 N0.925 O0.088 Pb | P 42 21 2 | 8.8829; 8.8829; 12.7008 90; 90; 90 | 1002.17 | Arakcheeva, Alla; Chernyshov, Dmitry; Spina, Massimo; Forró, László; Horváth, Endre CH~3~NH~3~PbI~3~: precise structural consequences of water absorption at ambient conditions Acta Crystallographica Section B, 2016, 72, 716-722 |
| 2107956 | CIF HKL Paper | C28 H26 N4 O2 | P -1 | 8.9389; 9.7292; 16.065 89.067; 78.856; 62.927 | 1216.48 | Di Paolo, Matias; Bossi, Mariano L.; Baggio, Ricardo; Suarez, Sebastián A. Two rhodamine 6G derivative compounds: a structural and fluorescence single-crystal study Acta Crystallographica Section B, 2016, 72, 684-692 |
| 2107957 | CIF HKL Paper | C30 H33 N3 O4 | P -1 | 9.425; 11.6209; 12.608 88.708; 68.696; 86.313 | 1283.89 | Di Paolo, Matias; Bossi, Mariano L.; Baggio, Ricardo; Suarez, Sebastián A. Two rhodamine 6G derivative compounds: a structural and fluorescence single-crystal study Acta Crystallographica Section B, 2016, 72, 684-692 |
| 2107958 | CIF HKL Paper | C10 H12 Br2 O2 | P 1 21/c 1 | 16.663; 7.943; 8.924 90; 94.725; 90 | 1177.1 | Suarez, Sebastián A.; Muller, Federico; Gutiérrez Suburu, Matías E.; Fonrouge, Ana; Baggio, Ricardo F.; Cukiernik, Fabio D. Br···Br and van der Waals interactions along a homologous series: crystal packing of 1,2-dibromo-4,5-dialkoxybenzenes Acta Crystallographica Section B, 2016, 72, 693-701 |
| 2107959 | CIF HKL | C30 H52 Br2 O2 | P 1 21/c 1 | 39.897; 8.421; 9.321 90; 91.622; 90 | 3130 | Suarez, Sebastián A.; Muller, Federico; Gutiérrez Suburu, Matías E.; Fonrouge, Ana; Baggio, Ricardo F.; Cukiernik, Fabio D. Br···Br and van der Waals interactions along a homologous series: crystal packing of 1,2-dibromo-4,5-dialkoxybenzenes Acta Crystallographica Section B, 2016, 72, 693-701 |
| 2107960 | CIF HKL | C34 H60 Br2 O2 | P 1 21/c 1 | 45.22; 8.374; 9.279 90; 91.809; 90 | 3512 | Suarez, Sebastián A.; Muller, Federico; Gutiérrez Suburu, Matías E.; Fonrouge, Ana; Baggio, Ricardo F.; Cukiernik, Fabio D. Br···Br and van der Waals interactions along a homologous series: crystal packing of 1,2-dibromo-4,5-dialkoxybenzenes Acta Crystallographica Section B, 2016, 72, 693-701 |
| 2107961 | CIF HKL | C42 H76 Br2 O2 | C 1 2/c 1 | 110.75; 8.2292; 9.1539 90; 92.268; 90 | 8336.2 | Suarez, Sebastián A.; Muller, Federico; Gutiérrez Suburu, Matías E.; Fonrouge, Ana; Baggio, Ricardo F.; Cukiernik, Fabio D. Br···Br and van der Waals interactions along a homologous series: crystal packing of 1,2-dibromo-4,5-dialkoxybenzenes Acta Crystallographica Section B, 2016, 72, 693-701 |
| 2107962 | CIF HKL | C24 H34 N6 | P -1 | 8.7977; 10.3488; 13.4887 84.101; 87.035; 73.903 | 1173.34 | Raghavaiah, P.; Kuladeep, R.; Narayana Rao, D.; Jyothi Lakshmi, A.; Srujana, P.; Subbalakshmi, J. <i>Bis</i>-(1-(2-aminoethyl)piperidino), (2-(2-aminoethyl)pyridino) and (1-(2-aminoethyl)pyrrolidino)-substituted dicyanoquinodimethanes: consequences of flexible ethylene spacers with heterocyclic moieties and amine functionalities Acta Crystallographica Section B, 2016, 72, 709-715 |
| 2107963 | CIF HKL | C24 H22 N6 | P 21 21 21 | 8.2134; 12.2105; 21.052 90; 90; 90 | 2111.3 | Raghavaiah, P.; Kuladeep, R.; Narayana Rao, D.; Jyothi Lakshmi, A.; Srujana, P.; Subbalakshmi, J. <i>Bis</i>-(1-(2-aminoethyl)piperidino), (2-(2-aminoethyl)pyridino) and (1-(2-aminoethyl)pyrrolidino)-substituted dicyanoquinodimethanes: consequences of flexible ethylene spacers with heterocyclic moieties and amine functionalities Acta Crystallographica Section B, 2016, 72, 709-715 |
| 2107964 | CIF HKL | C22 H30 N6 | P 1 21/c 1 | 13.143; 10.3517; 16.1607 90; 101.651; 90 | 2153.4 | Raghavaiah, P.; Kuladeep, R.; Narayana Rao, D.; Jyothi Lakshmi, A.; Srujana, P.; Subbalakshmi, J. <i>Bis</i>-(1-(2-aminoethyl)piperidino), (2-(2-aminoethyl)pyridino) and (1-(2-aminoethyl)pyrrolidino)-substituted dicyanoquinodimethanes: consequences of flexible ethylene spacers with heterocyclic moieties and amine functionalities Acta Crystallographica Section B, 2016, 72, 709-715 |
| 2107965 | CIF Paper | C3 H3 N3 O2 | P 1 21/c 1 | 7.3215; 9.8106; 6.7539 90; 115.71; 90 | 437.095 | Kalaiarasi, Chinnasamy; Pavan, Mysore S.; Kumaradhas, Poomani Topological characterization of electron density, electrostatic potential and intermolecular interactions of 2-nitroimidazole: an experimental and theoretical study Acta Crystallographica Section B, 2016, 72, 775-786 |
| 2107966 | CIF HKL Paper | C9 H16 S Si | P 21 21 21 | 5.6366; 11.0112; 17.8309 90; 90; 90 | 1106.69 | Lumpi, Daniel; Kautny, Paul; Stöger, Berthold; Fröhlich, Johannes Crystal chemistry of trialkylsilyl-capped (3<i>Z</i>)-4-(methylthio)-3-penten-1-yne: polymorphism, twinning and ambiguity of order‒disorder descriptions Acta Crystallographica Section B, 2016, 72, 753-762 |
| 2107967 | CIF HKL | C15 H28 S Si | P -1 | 7.962; 13.842; 15.326 92.33; 99.313; 90.721 | 1665.1 | Lumpi, Daniel; Kautny, Paul; Stöger, Berthold; Fröhlich, Johannes Crystal chemistry of trialkylsilyl-capped (3<i>Z</i>)-4-(methylthio)-3-penten-1-yne: polymorphism, twinning and ambiguity of order‒disorder descriptions Acta Crystallographica Section B, 2016, 72, 753-762 |
| 2107968 | CIF HKL | C15 H28 S Si | P -1 | 9.4082; 11.2004; 16.3446 79.108; 83.424; 89.3 | 1680.1 | Lumpi, Daniel; Kautny, Paul; Stöger, Berthold; Fröhlich, Johannes Crystal chemistry of trialkylsilyl-capped (3<i>Z</i>)-4-(methylthio)-3-penten-1-yne: polymorphism, twinning and ambiguity of order‒disorder descriptions Acta Crystallographica Section B, 2016, 72, 753-762 |
| 2107969 | CIF HKL | C12 H22 S Si | P -1 | 6.2535; 7.2501; 32.335 92.496; 91.452; 107.191 | 1398.1 | Lumpi, Daniel; Kautny, Paul; Stöger, Berthold; Fröhlich, Johannes Crystal chemistry of trialkylsilyl-capped (3<i>Z</i>)-4-(methylthio)-3-penten-1-yne: polymorphism, twinning and ambiguity of order‒disorder descriptions Acta Crystallographica Section B, 2016, 72, 753-762 |
| 2107970 | CIF Paper | C22 H33 N3 O6 S | P 1 21 1 | 8.3052; 6.1117; 23.7414 90; 93.652; 90 | 1202.64 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107971 | CIF Paper | C25 H30 N2 O4 S | P 1 21/c 1 | 16.9513; 6.9458; 21.5346 90; 95.409; 90 | 2524.2 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107972 | CIF Paper | C25 H28 N2 O3 S | P 1 21/c 1 | 8.6363; 20.6504; 12.9243 90; 93.435; 90 | 2300.82 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107973 | CIF Paper | C25 H27 N3 O3 S2 | P 1 21/n 1 | 6.8375; 15.8835; 23.2329 90; 92.451; 90 | 2520.86 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107974 | CIF Paper | C18 H23 Cl N2 S | P 1 21/c 1 | 16.9383; 6.5283; 17.8173 90; 111.406; 90 | 1834.3 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107975 | CIF Paper | C36 H45 Cl N4 S2 | P 1 21/c 1 | 20.9755; 7.716; 10.6432 90; 93.067; 90 | 1720.1 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107976 | CIF Paper | C18 H23 Br N2 S | P 1 21/c 1 | 13.0982; 18.2551; 7.8088 90; 100.698; 90 | 1834.7 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107977 | CIF Paper | C36 H45 Br N4 S2 | P 1 21/c 1 | 21.1781; 7.8799; 10.5126 90; 87.993; 90 | 1753.28 | Zhou, Xinbo; Hu, Xiurong; Wu, Suxiang; Ye, Jiali; Sun, Mengying; Gu, Jianming; Zhu, Jianrong; Zhang, Zhongliang Structures and physicochemical properties of vortioxetine salts Acta Crystallographica Section B, 2016, 72, 723-732 |
| 2107978 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.6341; 17.8996; 20.096 90; 101.098; 90 | 4106.6 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107979 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.6463; 17.9257; 20.11 90; 101.06; 90 | 4120.3 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107980 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.6801; 17.9212; 20.1555 90; 100.954; 90 | 4142.1 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107981 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.6874; 17.9345; 20.1975 90; 100.976; 90 | 4156.1 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107982 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.703; 17.9455; 20.2104 90; 101.001; 90 | 4166.5 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107983 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.7471; 17.9659; 20.25 90; 100.904; 90 | 4196.5 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107984 | CIF HKL Paper | C42 H67 N O3 S Si | C 1 c 1 | 11.801; 18.019; 20.201 90; 100.958; 90 | 4217.3 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107985 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.4301; 16.2937; 18.8001 90; 106.835; 90 | 3937.6 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107986 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.4487; 16.3096; 18.8302 90; 106.902; 90 | 3951.9 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107987 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.4625; 16.3181; 18.8624 90; 106.983; 90 | 3963 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107988 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.4813; 16.3521; 18.8926 90; 107.073; 90 | 3981.3 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107989 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.5052; 16.382; 18.9409 90; 107.106; 90 | 4005.1 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107990 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.5221; 16.3924; 18.982 90; 107.079; 90 | 4022 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107991 | CIF HKL Paper | C41 H57 N O3 S Si | P 1 21/c 1 | 13.5393; 16.4475; 19.021 90; 107.159; 90 | 4047.2 | Mielcarek, Agnieszka; Daszkiewicz, Marek; Kazimierczuk, Katarzyna; Ciborska, Anna; Dołega, Anna Variable-temperature X-ray diffraction study of structural parameters of NH—S hydrogen bonds in triethylammonium and pyridinium silanethiolates Acta Crystallographica Section B, 2016, 72, 763-770 |
| 2107992 | CIF Paper | C13 H19 Cl N2 O2 | P b c n | 17.8252; 7.2708; 20.6396 90; 90; 90 | 2674.96 | Jacobs, Jeroen; Moris, Michele; De Samber, Tim; Vrijdag, Johannes; De Borggraeve, Wim; Van Meervelt, Luc The orthorhombic pseudopolymorph of tacrine hydrochloride Acta Crystallographica Section B, 2016, 72, 771-774 |
| 2107993 | CIF HKL Paper | Al7.62 Ca18.1 Fe2.55 Mg0.63 Na0.9 O78 Si18 Ti2.2 | P 4/n n c :2 | 15.5326; 15.5326; 11.804 90; 90; 90 | 2847.85 | Aksenov, Sergey M.; Chukanov, Nikita V.; Rusakov, Vyacheslav S.; Panikorovskii, Taras L.; Rastsvetaeva, Ramiza K.; Gainov, Ramil R.; Vagizov, Farit G.; Lyssenko, Konstantin A.; Belakovskiy, Dmitry I. Towards a revisitation of vesuvianite-group nomenclature: the crystal structure of Ti-rich vesuvianite from Alchuri, Shigar Valley, Pakistan Acta Crystallographica Section B, 2016, 72, 744-752 |
| 2107996 | CIF Paper | C21 H22 N2 O2 | P -1 | 7.6021; 8.4538; 15.375 88.99; 84.05; 64.75 | 888.5 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2107997 | CIF | C21 H22 N2 O2 | P 1 21/n 1 | 7.7857; 8.1859; 27.953 90; 96.87; 90 | 1768.7 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2107998 | CIF HKL | C21 H22 N2 O2 | P -1 | 7.6738; 7.7598; 16.2725 78.957; 83.673; 65.094 | 862.12 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2107999 | CIF HKL | C20 H19 Cl N2 O2 | P -1 | 7.6718; 7.7441; 16.056 80.06; 84.88; 65.5 | 854.8 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2108000 | CIF HKL | C21 H22 N2 O2 | P -1 | 7.5271; 7.5702; 15.664 88.11; 78.41; 89.2 | 873.9 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2108001 | CIF HKL | C20 H19 Cl N2 O2 | P 1 21/n 1 | 7.7585; 8.0699; 28.056 90; 97.29; 90 | 1742.4 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2108002 | CIF HKL | C20 H19 Cl N2 O2 | P b c a | 7.8069; 13.987; 32.185 90; 90; 90 | 3514.4 | Bouanga Boudiombo, Jacky S.; Jacobs, Ayesha Solvates of selected fenamic acids with substituted pyridines: structure, thermal stability and desolvation Acta Crystallographica Section B, 2016, 72, 836-845 |
| 2108003 | CIF HKL Paper | C24 H17 Cu F6 N3 O4 | P -1 | 9.3862; 10.7268; 13.3463 70.106; 75.783; 84.529 | 1224.77 | Perdih, Franc Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane Acta Crystallographica Section B, 2016, 72, 828-835 |
| 2108004 | CIF HKL Paper | C24 H17 F6 N3 O4 Zn | P 1 2/n 1 | 11.5334; 9.2949; 13.0287 90; 115.198; 90 | 1263.79 | Perdih, Franc Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane Acta Crystallographica Section B, 2016, 72, 828-835 |
| 2108005 | CIF HKL Paper | C24 H16 Cu F6 N2 O4 | C 1 2/m 1 | 16.698; 7.5724; 11.9436 90; 121.097; 90 | 1293.17 | Perdih, Franc Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane Acta Crystallographica Section B, 2016, 72, 828-835 |
| 2108006 | CIF HKL Paper | C24 H16 F6 N2 O4 Zn | C 1 2/m 1 | 16.8348; 7.2272; 12.2602 90; 121.311; 90 | 1274.43 | Perdih, Franc Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane Acta Crystallographica Section B, 2016, 72, 828-835 |
| 2108007 | CIF HKL Paper | C24 H16 F6 N2 O4 Zn | P -1 | 7.211; 8.9713; 10.9554 92.223; 106.931; 113.347 | 612.83 | Perdih, Franc Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane Acta Crystallographica Section B, 2016, 72, 828-835 |
| 2108008 | CIF HKL Paper | C32 H22 Cu F6 N2 O4 | P -1 | 8.646; 9.6246; 9.6615 65.711; 78.619; 88.191 | 717.29 | Perdih, Franc Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane Acta Crystallographica Section B, 2016, 72, 828-835 |
| 2108010 | CIF Paper | Al1.44 Ca0.49 Na0.51 O8 Si2.56 | ? | 8.1661; 12.8545; 14.235 93.5777; 116.309; 89.593 | 1336.52 | Xu, Huifang; Jin, Shiyun; Noll, Bruce C. Incommensurate density modulation in a Na-rich plagioclase feldspar: <i>Z</i>-contrast imaging and single-crystal X-ray diffraction study Acta Crystallographica Section B, 2016, 72, 904-915 |
| 2108011 | CIF HKL Paper | C6 H13 N O2 | P 1 21 1 | 9.606; 5.324; 14.666 90; 94.06; 90 | 748.2 | Binns, Jack; Parsons, Simon; McIntyre, Garry J. Accurate hydrogen parameters for the amino acid <small>L</small>-leucine Acta Crystallographica Section B, 2016, 72, 885-892 |
| 2108012 | CIF HKL | C6 H13 N O2 | P 1 21 1 | 9.562; 5.301; 14.519 90; 94.2; 90 | 734 | Binns, Jack; Parsons, Simon; McIntyre, Garry J. Accurate hydrogen parameters for the amino acid <small>L</small>-leucine Acta Crystallographica Section B, 2016, 72, 885-892 |
| 2108013 | CIF HKL Paper | H O4 Rb S | P 1 n 1 | 14.2651; 4.5853; 14.2789 90; 117.999; 90 | 824.66 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108014 | CIF HKL | H O4 Rb S | P 1 21/n 1 | 14.3602; 4.6156; 14.413 90; 118.069; 90 | 842.9 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108015 | CIF | H O4 Rb S | P 1 21/n 1 | 14.3602; 4.6156; 14.413 90; 118.069; 90 | 842.9 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108016 | CIF HKL | H O4 Rb S | P 1 21/n 1 | 14.3602; 4.6156; 14.413 90; 118.069; 90 | 842.9 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108017 | CIF HKL | H O4 Rb S | P 1 21/n 1 | 14.324; 4.6263; 14.401 90; 117.74; 90 | 844.6 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108018 | CIF HKL | H O4 Rb S | P 1 n 1 | 14.166; 4.5982; 14.326 90; 117.68; 90 | 826.4 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108019 | CIF HKL | H O4 Rb S | P 1 21/c 1 | 7.3202; 7.765; 7.3247 90; 110.938; 90 | 388.85 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108020 | CIF HKL | H O4 Rb S | P 1 21/n 1 | 14.3405; 4.615; 14.3723 90; 118.054; 90 | 839.42 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108021 | CIF HKL | H O4 Rb S | P 1 21/n 1 | 14.334; 4.6197; 14.361 90; 118.94; 90 | 832.2 | Binns, Jack; McIntyre, Garry J.; Parsons, Simon Neutron and high-pressure X-ray diffraction study of hydrogen-bonded ferroelectric rubidium hydrogen sulfate Acta Crystallographica Section B, 2016, 72, 855-863 |
| 2108022 | CIF HKL Paper | C7 H9 N3 O5 | P 1 21/c 1 | 15.9356; 7.48389; 17.139 90; 112.052; 90 | 1894.47 | Daszkiewicz, Marek; Mielcarek, Agnieszka Comparison of hydrogen bonds and diverse weak interactions of the nitro group in 2-methyl-4-nitroanilinium nitrate, bisulfate and two hexafluoridosilicates: elementary graph-set approach Acta Crystallographica Section B, 2016, 72, 916-926 |
| 2108023 | CIF HKL | C7 H10 N2 O6 S | P 1 21/c 1 | 15.9394; 5.01801; 12.931 90; 101.367; 90 | 1013.99 | Daszkiewicz, Marek; Mielcarek, Agnieszka Comparison of hydrogen bonds and diverse weak interactions of the nitro group in 2-methyl-4-nitroanilinium nitrate, bisulfate and two hexafluoridosilicates: elementary graph-set approach Acta Crystallographica Section B, 2016, 72, 916-926 |
| 2108024 | CIF HKL | C14 H18 F6 N4 O4 Si | P 1 21/c 1 | 6.1643; 10.2128; 29.824 90; 92.439; 90 | 1875.86 | Daszkiewicz, Marek; Mielcarek, Agnieszka Comparison of hydrogen bonds and diverse weak interactions of the nitro group in 2-methyl-4-nitroanilinium nitrate, bisulfate and two hexafluoridosilicates: elementary graph-set approach Acta Crystallographica Section B, 2016, 72, 916-926 |
| 2108025 | CIF HKL | C14 H22 F6 N4 O6 Si | P 1 21/c 1 | 15.0445; 8.8682; 8.1133 90; 104.638; 90 | 1047.32 | Daszkiewicz, Marek; Mielcarek, Agnieszka Comparison of hydrogen bonds and diverse weak interactions of the nitro group in 2-methyl-4-nitroanilinium nitrate, bisulfate and two hexafluoridosilicates: elementary graph-set approach Acta Crystallographica Section B, 2016, 72, 916-926 |
| 2108026 | CIF | C8 N4 S3 | P 1 21/n 1 | 11.947; 6.696; 12.598 90; 108.6; 90 | 955.2 | Curtis, Farren; Wang, Xiaopeng; Marom, Noa Effect of packing motifs on the energy ranking and electronic properties of putative crystal structures of tricyano-1,4-dithiino[<i>c</i>]-isothiazole Acta Crystallographica Section B, 2016, 72, 562-570 |
| 2108027 | CIF HKL Paper | Fe2 O3 | C 1 2/c 1 | 9.61865; 5.03554; 13.75158 90; 162.404; 90 | 201.349 | Fabrykiewicz, P.; Stekiel, M.; Sosnowska, I.; Przeniosło, R. Deformations of the α-Fe~2~O~3~ rhombohedral lattice across the Néel temperature Acta Crystallographica Section B, 2017, 73, 27-32 |
| 2108028 | CIF HKL Paper | Fe2 O3 | C 1 2/c 1 | 9.6892; 5.08737; 13.84868 90; 162.351; 90 | 206.967 | Fabrykiewicz, P.; Stekiel, M.; Sosnowska, I.; Przeniosło, R. Deformations of the α-Fe~2~O~3~ rhombohedral lattice across the Néel temperature Acta Crystallographica Section B, 2017, 73, 27-32 |
| 2108029 | CIF HKL Paper | C4 H12 Cl N5 | P 1 21/c 1 | 7.9104; 13.8794; 7.931 90; 114.606; 90 | 791.69 | Niranjana Devi, Rajendran; Jelsch, Christian; Israel, Samuel; Aubert, Emmanuel; Anzline, Chellam; Hosamani, Amar A. Charge density analysis of metformin chloride, a biguanide anti-hyperglycemic agent Acta Crystallographica Section B, 2017, 73, 10-22 |
| 2108030 | CIF HKL Paper | C22 H24 Br F3 I3 N | P b c a | 15.7522; 22.3326; 15.5213 90; 90; 90 | 5460.2 | Szell, Patrick M. J.; Gabidullin, Bulat; Bryce, David L. 1,3,5-Tri(iodoethynyl)-2,4,6-trifluorobenzene: halogen-bonded frameworks and NMR spectroscopic analysis Acta Crystallographica Section B, 2017, 73 |
| 2108031 | CIF HKL Paper | C22 H24 Br F3 I3 N | C 1 2/c 1 | 31.434; 14.8275; 26.724 90; 116.034; 90 | 11192 | Szell, Patrick M. J.; Gabidullin, Bulat; Bryce, David L. 1,3,5-Tri(iodoethynyl)-2,4,6-trifluorobenzene: halogen-bonded frameworks and NMR spectroscopic analysis Acta Crystallographica Section B, 2017, 73 |
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