Crystallography Open Database

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2022949 CIF
HKL
Paper
C29 H44 N8 OP 1 21 15.5229; 11.9579; 22.5767
90; 94.962; 90
1485.43Zouhair, Mustapha; El Ghayati, Lhoussaine; El Monfalouti, Hanae; Abchihi, Hicham; Hökelek, Tuncer; Ahmed, Mazzah; Mague, Joel T.; Sebbar, Nada Kheira
Synthesis, structure and Hirshfeld surface analysis of 1,3-bis[(1-octyl-1H-1,2,3-triazol-4-yl)methyl]-1H-benzo[d]imidazol-2(3H)-one
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1179-1182
2022950 CIF
HKL
Paper
C7 H7 N3 OP 1 21/c 15.3864; 18.013; 7.0112
90; 96.288; 90
676.17Lahyaoui, Mouad; Haoudi, Amal; Kartah, Badr Eddine; Mazzah, Ahmed; Hökelek, Tuncer; Mague, Joel T.; Kandri Rodi, Youssef; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, intermolecular interaction energies, energy frameworks and DFT calculations of 4-amino-1-(prop-2-yn-1-yl)pyrimidin-2(1H)-one
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1183-1189
2022951 CIF
HKL
Paper
C15 H15 F3 N2 O3 SI 1 2/a 121.9709; 5.1271; 27.022
90; 93.633; 90
3037.8Richter, Adrian; Goddard, Richard; Imming, Peter; Seidel, Rüdiger W.
Crystal structure and antimycobacterial evaluation of 2-(cyclohexylmethyl)-7-nitro-5-(trifluoromethyl)benzo[d]isothiazol-3(2H)-one
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1194-1198
2022952 CIF
HKL
Paper
C49 H88 Cl12 N12 Na Nd O11 P4P -112.7712; 13.6102; 24.7288
98.301; 97.814; 117.051
3687.5Kariaka, Nataliia S.; Dyakonenko, Viktoriya V.; Znovjyak, Kateryna O.; Shishkina, Svitlana V.; Amirkhanov, Volodymyr M.
Synthesis, crystal structure and Hirshfeld surface analysis of the tetrakis complex NaNdPyr4(i-PrOH)2·i-PrOH with a carbacylamidophosphate of the amide type
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1218-1222
2022953 CIF
HKL
Paper
C56 H90 N26 Ni8 O6I 4/m m m16.6921; 16.6921; 12.4112
90; 90; 90
3458.09Al Isawi, Wisam A.; Zeller, Matthias; Mezei, Gellert
An octanuclear nickel(II) pyrazolate cluster with a cubic Ni8 core and its methyl- and n-octyl-functionalized derivatives
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1199-1206
2022954 CIF
HKL
Paper
C94.39 H164.78 Cl14.39 N26 Ni8 O6P m n a30.39; 14.5762; 14.5141
90; 90; 90
6429.3Al Isawi, Wisam A.; Zeller, Matthias; Mezei, Gellert
An octanuclear nickel(II) pyrazolate cluster with a cubic Ni8 core and its methyl- and n-octyl-functionalized derivatives
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1199-1206
2022955 CIF
HKL
Paper
C164 H306 N26 Ni8 O6P -113.973; 20.765; 31.873
99.896; 94.798; 99.1
8937Al Isawi, Wisam A.; Zeller, Matthias; Mezei, Gellert
An octanuclear nickel(II) pyrazolate cluster with a cubic Ni8 core and its methyl- and n-octyl-functionalized derivatives
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1199-1206
2022956 CIF
HKL
Paper
C19 H20 Cl2 N2 OP 1 21/n 112.364; 11.148; 13.898
90; 96.5; 90
1903.3Akila, Shanmugasundaram; Vidhyasagar, Thankakan; Winfred Jebaraj, John Peter; Thiruvalluvar, Aravazhi Amalan; Rajeswari, Krishnan
Synthesis, crystal structure and computational analysis of 2,7-bis(4-chlorophenyl)-3,3-dimethyl-1,4-diazepan-5-one
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1212-1217
2022957 CIF
HKL
Paper
C34 H38 Cd N8 O6 S2C 1 2/c 123.5743; 7.7286; 19.726
90; 103.858; 90
3489.39Suyunov, Jabbor; Torambetov, Batirbay; Turaev, Khayit; Kadirova, Shakhnoza; Alimnazarov, Bekmurod; Ashurov, Jamshid
Synthesis, crystal structure and Hirshfeld surface analysis of a cadmium complex of naphthalene-1,5-disulfonate and o-phenylenediamine
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1190-1193
2022958 CIF
HKL
Paper
Bi2 H N O6P n a 215.3854; 5.3676; 17.051
90; 90; 90
492.9Weil, Matthias; Missen, Owen P.; Mills, Stuart J.
Dimorphism of [Bi2O2(OH)](NO3) – the ordered Pna21 structure at 100 K
Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1223-1227
2022959 CIF
HKL
Paper
B47.6 Li1.89 Mg1.11P 43 21 210.1905; 10.1905; 14.4709
90; 90; 90
1502.75Pavlyuk, Nazar; Milashius, Viktoria; Kordan, Vasyl; Pavlyuk, Volodymyr
Synthesis, crystal structure and hydrogenation properties of Mg<sub><i>x</i></sub>Li<sub>3 - <i>x</i></sub>B<sub>48 - <i>y</i></sub> (<i>x</i> = 1.11, <i>y</i> = 0.40).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 10-13
2022960 CIF
HKL
Paper
C26 H33 Cl4 N7 O4 Zn2P b c a28.4313; 7.6516; 29.5461
90; 90; 90
6427.6Tiwari, Laxmi; Waynant, Kristopher V.
The synthesis and structural properties of a chlorido-bis-{<i>N</i>-[(4-meth-oxy-phen-yl)imino]-pyrrolidine-1-carboxamide}-zinc(II) (aceto-nitrile)-trichlorido-zincate coordination complex.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 14-17
2022961 CIF
Paper
C20 H16 N2 O2P 1 21/n 110.6474; 13.2429; 11.4176
90; 99.067; 90
1589.79Bouhidel, Zakaria; Sahli, Kaouther; Cherouana, Aouatef
Crystal structure and Hirshfeld surface analysis of a new benzimidazole compound, 3-{1-[(2-hy-droxyphen-yl)meth-yl]-1<i>H</i>-1,3-benzo-diazol-2-yl}phenol.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 18-21
2022962 CIF
HKL
Paper
C12 H12 Li2 O8 S2P 1 21/c 115.8584; 5.3693; 8.8636
90; 99.994; 90
743.27Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro
Crystal structure of dilithium biphenyl-4,4'-di-sulfonate dihydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 22-24
2022963 CIF
HKL
Paper
C23 H27 N3 O7 SP -18.26968; 12.50096; 12.76743
116.955; 104.842; 91.0281
1123.39Metwally, Nadia H.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of 2-[(5-amino-1-tosyl-1<i>H</i>-pyrazol-3-yl)-oxy]-1-(4-meth-oxy-phen-yl)ethan-1-one 1,4-dioxane monosolvate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 29-33
2022964 CIF
HKL
Paper
C18 H32 Fe N14 O12C 1 2/c 115.5352; 11.5178; 16.0472
90; 107.616; 90
2736.7Plutenko, Maksym O.; Shylin, Sergii I.; Shova, Sergiu; Blinder, Aleksander V.; Fritsky, Igor O.
Crystal structure of a water oxidation catalyst solvate with composition (NH<sub>4</sub>)<sub>2</sub>[Fe<sup>IV</sup>(<i>L</i>-6H)]·3CH<sub>3</sub>COOH (<i>L</i> = clathrochelate ligand).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 25-28
2022965 CIF
HKL
Paper
C9 H21 Au Cl P SP 1 21/n 18.05892; 11.1342; 15.0596
90; 97.004; 90
1341.21Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022966 CIF
HKL
Paper
C11 H25 Au Cl P SC 1 2/c 126.953; 8.1226; 18.69
90; 132.03; 90
3039.3Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022967 CIF
HKL
Paper
C12 H27 Au Cl P SP 1 21 18.45319; 10.904; 8.7166
90; 93.583; 90
801.87Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022968 CIF
HKL
Paper
C9 H21 Au Cl P SeP 1 21/n 18.0938; 11.3088; 14.9798
90; 96.403; 90
1362.57Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022969 CIF
HKL
Paper
C10 H23 Au Cl P SeP 1 21/n 18.2215; 11.3519; 15.24
90; 92.389; 90
1421.11Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022970 CIF
HKL
Paper
C11 H25 Au Cl P SeP 1 21/c 17.64505; 14.6437; 13.7211
90; 90.4954; 90
1536.04Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022971 CIF
HKL
Paper
C9 H21 Au Br P SP 1 21/n 18.1898; 11.1421; 15.3064
90; 97.394; 90
1385.12Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022972 CIF
HKL
Paper
C11 H25 Au Br P SC 1 2/c 127.3157; 8.16931; 18.8362
90; 132.187; 90
3114.5Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022973 CIF
HKL
Paper
C12 H27 Au Br P SP 1 21/c 18.3107; 13.482; 14.7591
90; 90.424; 90
1653.64Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022974 CIF
HKL
Paper
C9 H21 Au Br P SeP 1 21/n 18.225; 11.31793; 15.2065
90; 96.6895; 90
1405.94Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022975 CIF
HKL
Paper
C10 H23 Au Br P SeP 1 21/c 111.5037; 15.244; 16.8366
90; 90.053; 90
2952.51Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022976 CIF
HKL
Paper
C11 H25 Au Br P SeP 1 21/c 17.66804; 14.77026; 13.94963
90; 90.4697; 90
1579.87Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022977 CIF
HKL
Paper
C12 H27 Au Br P SeP 1 21/c 18.29705; 13.6959; 14.6444
90; 90.0892; 90
1664.12Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022978 CIF
HKL
Paper
C10 H23 Au I P SP 1 21/n 18.601; 15.0435; 11.7218
90; 91.202; 90
1516.34Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022979 CIF
HKL
Paper
C10 H23 Au I P SeP 1 21/c 111.70073; 15.4167; 17.048
90; 89.6296; 90
3075.17Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022980 CIF
HKL
Paper
C11 H25 Au I P SeP 43 21 210.7755; 10.7755; 28.3769
90; 90; 90
3294.88Upmann, Daniel; Jones, Peter G.; Bockfeld, Dirk; Târcoveanu, Eliza
Crystal structures of sixteen phosphane chalcogenide complexes of gold(I) chloride, bromide and iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 34-49
2022981 CIF
HKL
C33 H43 Cl2 N3 O RuP 1 21/n 113.6801; 10.7078; 22.035
90; 102.553; 90
3150.6Mammadova, Gunay Z.; Atioğlu, Zeliha; Akkurt, Mehmet; Grigoriev, Mikhail S.; Volchkov, Nikita S.; Azizova, Asmet N.; Bhattarai, Ajaya; Antonova, Alexandra S.
Crystal structure of [1,3-bis-(2,4,6-tri-methyl-phen-yl)imidazolidin-2-yl-idene]di-chlorido-(2-{[(2-methoxyeth-yl)(meth-yl)amino]-meth-yl}benzyl-idene)ruth-en-ium.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 50-53
2022982 CIF
HKL
Paper
C25 H25 N O7 SP 1 21/c 112.52978; 18.87277; 10.63916
90; 109.409; 90
2372.88Guliyeva, Narmina A.; Burkin, Gleb M.; Annadurdyyeva, Selbi; Khrustalev, Victor N.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of dimethyl 4-hy-droxy-5,4'-dimethyl-2'-(toluene-4-sulfonyl-amino)-biphenyl-2,3-di-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 62-66
2022983 CIF
HKL
Paper
C20 H18 N2 SP 437.74413; 7.74413; 53.4131
90; 90; 90
3203.27Sadikhova, Nurlana D.; Atioğlu, Zeliha; Guliyeva, Narmina A.; Shelukho, Evgeniya R.; Polyanskaya, Darya K.; Khrustalev, Victor N.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 3-benzyl-2-[bis(1<i>H</i>-pyrrol-2-yl)methyl]thiophene.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 72-77
2022984 CIF
HKL
Paper
C8 H7 Co N3 O S2P 1 21/c 17.67386; 7.66462; 18.8755
90; 97.4258; 90
1100.89Näther, Christian; Jess, Inke
Synthesis, crystal structure and properties of poly[(μ-2-methyl-pyridine <i>N</i>-oxide-κ<sup>2</sup><i>O</i>:<i>O</i>)bis-(μ-thio-cyanato-κ<sup>2</sup><i>N</i>:<i>S</i>)cobalt(II)].
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 67-71
2022985 CIF
HKL
Paper
C18 H22 O7P 1 21/c 17.1566; 14.1907; 16.2737
90; 91.329; 90
1652.27Sadikhova, Nurlana D.; Atioğlu, Zeliha; Guliyeva, Narmina A.; Podrezova, Alexandra G.; Nikitina, Eugeniya V.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of dieth-yl (3a<i>S</i>,3<i>a</i>1<i>R</i>,4<i>S</i>,5<i>S</i>,6<i>R</i>,6a<i>S</i>,7<i>R</i>,9a<i>S</i>)-3a1,5,6,6a-tetra-hydro-1<i>H</i>,3<i>H</i>,4<i>H</i>,7<i>H</i>-3a,6:7,9a-di-epoxy-benzo[<i>de</i>]isochromene-4,5-di-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 83-87
2022986 CIF
HKL
Paper
C7 H10 Cl N OP b c a8.8689; 8.4361; 21.7319
90; 90; 90
1625.96Uppu, Rao M.; Babu, Sainath; Fronczek, Frank R.
Temperature-dependent solid-state phase transition with twinning in the crystal structure of 4-meth-oxy-anilinium chloride.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 58-61
2022987 CIF
HKL
Paper
C7 H10 Cl N OP 1 21/c 18.3039; 21.6993; 8.8495
90; 90.077; 90
1594.58Uppu, Rao M.; Babu, Sainath; Fronczek, Frank R.
Temperature-dependent solid-state phase transition with twinning in the crystal structure of 4-meth-oxy-anilinium chloride.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 58-61
2022988 CIF
HKL
Paper
C5 H11 F6 N2 O PP b c a10.4638; 13.4495; 13.734
90; 90; 90
1932.83Neary, Michelle C.; Corfield, Peter W. R.; Parkin, Sean R.; Saba, Shahrokh
Crystal structures of two formamidinium hexa-fluorido-phosphate salts, one with batch-dependent disorder.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 88-93
2022989 CIF
HKL
C5 H11 F6 N2 O PP c a 2110.4504; 13.717; 13.4157
90; 90; 90
1923.1Neary, Michelle C.; Corfield, Peter W. R.; Parkin, Sean R.; Saba, Shahrokh
Crystal structures of two formamidinium hexa-fluorido-phosphate salts, one with batch-dependent disorder.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 88-93
2022990 CIF
HKL
C5 H11 F6 N2 PC 1 c 112.3588; 12.7942; 12.2759
90; 105.4; 90
1871.38Neary, Michelle C.; Corfield, Peter W. R.; Parkin, Sean R.; Saba, Shahrokh
Crystal structures of two formamidinium hexa-fluorido-phosphate salts, one with batch-dependent disorder.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 88-93
2022991 CIF
HKL
Paper
C18 H30 Li N O3P 1 21/n 19.267; 13.178; 15.053
90; 94.437; 90
1832.8Mairath, Tristan; Schmidt, Annika; Strohmann, Carsten
Crystal structure and Hirshfeld surface analysis of 2-picolyllithium·3thf.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 78-82
2022992 CIF
HKL
Paper
C8 H12 Cu N6 O6P -16.8465; 7.1097; 7.209
79.267; 83.193; 64.076
309.8Petrenko, Yuliia P.; Vynohradov, Oleksandr S.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Shova, Sergiu; Lampeka, Rostyslav D.
Crystal structure and Hirshfeld-surface analysis of di-aqua-bis-(5-methyl-1<i>H</i>-1,2,4-triazole-3-carboxyl-ato)copper(II).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 54-57
2022993 CIFCl O12 P3 Sr5P 63/m9.859; 9.859; 7.206
90; 90; 120
606.58Sudarsanan, K.; Young, R. A.
Structure refinement and random error analysis for strontium `chlorapatite', Sr5(PO4)3Cl
Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, 1974, 30, 1381-1386
2022994 CIF
HKL
Paper
C72 H48 Cu2 O10 S2P -110.5283; 11.8583; 11.9401
101.044; 98.136; 104.142
1390.69Nogué-Guzmán, Vianca C; Burgos-Suazo, Alejandro; Rivera-Reyes, Javier O; Montes Quiñones, Vasti P; Ramis-Aybar, Paola C; Burgos-Jiménez, Adriana C; González-Nieves, Karilys; Piñero-Cruz, Dalice M
New copper carboxyl-ate pyrene dimers: synthesis, crystal structure, Hirshfeld surface analysis and electrochemical characterization.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 1-9
2022995 CIF
HKL
C74 H50 Cu2 N2 O10P 1 21/n 110.54266; 21.8888; 12.66517
90; 100.116; 90
2877.26Nogué-Guzmán, Vianca C; Burgos-Suazo, Alejandro; Rivera-Reyes, Javier O; Montes Quiñones, Vasti P; Ramis-Aybar, Paola C; Burgos-Jiménez, Adriana C; González-Nieves, Karilys; Piñero-Cruz, Dalice M
New copper carboxyl-ate pyrene dimers: synthesis, crystal structure, Hirshfeld surface analysis and electrochemical characterization.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 1-9
2022996 CIF
HKL
Paper
Ba2 Mn1.71 Te5 Y0.87C 1 2/m 115.1466; 4.5782; 10.606
90; 116.956; 90
655.56Yadav, Sweta; Prakash, Jai
Synthesis and crystal structure of Ba2Y0.87(1)Mn1.71(1)Te5
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2022997 CIF
HKL
Paper
C15 H17 Br N2 SP 21 21 217.9846; 9.1982; 19.3636
90; 90; 90
1422.14Savin, J. Alejandro; Ávila-Ortíz, C. Gabriela; Leyva-Ramírez, Marco Antonio; Juaristi, Eusebio
X-ray crystallographic structure of a novel enantiopure chiral isothiourea with potential applications in enantioselective synthesis
Acta Crystallographica Section C Structural Chemistry, 2024, 80, 15-20
2022998 CIF
HKL
Paper
C10 H11 N5 O2 S2P 1 21/n 15.44832; 9.03714; 26.1141
90; 92.9914; 90
1284.03Mohamed-Ezzat, Reham A; Elgemeie, Galal H.; Jones, Peter G.
An unexpected tautomer: synthesis and crystal structure of <i>N</i>-[6-amino-4-(methyl-sulfan-yl)-1,2-di-hydro-1,3,5-triazin-2-yl-idene]benzenesulfonamide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 120-124
2022999 CIF
HKL
Paper
C26 H30 Cd N5 O9.5P -18.1674; 12.3033; 15.4877
75.226; 86.412; 75.346
1455.89Popovych, Anastasiia M.; Tsymbal, Liudmyla V.; Khomenko, Dmytro M.; Bargan, Alexandra; Lampeka, Yaroslaw D.; Lampeka, Rostislav D.
Synthesis and crystal structure of a cadmium(II) coordination polymer based on 4,4'-(1<i>H</i>-1,2,4-triazole-3,5-di-yl)dibenzoate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 128-132
2023000 CIF
HKL
Paper
C9 H9 N3 O2 SP 1 21/c 17.1189; 10.9687; 13.0678
90; 100.426; 90
1003.55Mesto, Ernesto; Okio, Coco K. Y. A.; Lemus, Maria Alejandra; Schingaro, Emanuela
{[(<i>E</i>)-(1,3-Benzodioxol-5-yl)methyl-idene]amino}thio-urea.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 125-127
2023001 CIF
HKL
Paper
C13 H15 N5 O4P -17.9481; 12.8523; 14.8737
96.651; 96.96; 90.548
1497.6Hajiyeva, Sevinc R.; Huseynov, Fatali E.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-[2-(2-amino-1-cyano-2-oxo-ethyl-idene)hydrazin-1-yl]benzoic acid <i>N</i>,<i>N</i>-di-methylformamide monosolvate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 110-116
2023002 CIF
HKL
Paper
Gd K2 Mo O8 PI b c a6.9527; 19.7112; 12.2466
90; 90; 90
1678.35Zozulia, Valeriia; Terebilenko, Kateryna; Voinalovych, Artem; Potaskalov, Vadim; Slobodyanik, Mykola
Crystal structure of a layered phosphate molybdate K<sub>2</sub>Gd(PO<sub>4</sub>)(MoO<sub>4</sub>).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 117-119
2023003 CIF
HKL
Paper
C20 H18 O4C 1 2/c 135.908; 6.8473; 13.2661
90; 98.915; 90
3222.4Kenfack Tsobnang, Patrice; Ziki, Eric; Siaka, Soso; Yoda, Jules; Kamal, Seham; Bouraima, Adam; Djifa Hounsi, Ayi; Wenger, Emmanuel; Bendeif, El-Eulmi; Lecomte, Claude
Synthesis, structure and Hirshfeld surface analysis of 2-oxo-2<i>H</i>-chromen-6-yl 4-<i>tert</i>-butyl-benzoate: work carried out as part of the AFRAMED project.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 106-109
2023004 CIF
Paper
C18 H22 Br6 Cu4 N4 O2P 1 21/c 123.1656; 7.7041; 16.5664
90; 110.896; 90
2762.1Traoré, Bocar; Diouf, Ngoné; Kébé, Momath; Guéye-Sylla, Rokhaya; Thiam, Ibrahima Elhadji; Diouf, Ousmane; Retailleau, Pascal; Gaye, Mohamed
Crystal structure of poly[hexa-μ-bro-mido-bis{2-[1-(py-ri-din-2-yl)ethyl-idene-amino]ethanol-ato}tetracopper(II)].
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 133-136
2023005 CIF
HKL
Paper
C12 H14 Br2 Co N2 O2P 21 21 217.6106; 7.8024; 25.4699
90; 90; 90
1512.43Näther, Christian; Jess, Inke
Synthesis, crystal structure and thermal properties of di-bromido-bis-(2-methyl-pyridine <i>N</i>-oxide-κ<i>O</i>)cobalt(II).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 152-156
2023006 CIF
HKL
Paper
C16 H11 F N2 OP c a 2123.612; 7.2392; 7.2122
90; 90; 90
1232.8Akkache, Hibet Errahmane Meroua; Hamdouni, Noudjoud; Boudjada, Ali; Medjroubi, Mohamed Larbi; Mili, Assia; Jeannin, Olivier
Crystal structure, Hirshfeld surface analysis and energy frameworks of 1-[(<i>E</i>)-2-(2-fluoro-phen-yl)diazan-1-yl-idene]naphthalen-2(1<i>H</i>)-one.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 137-142
2023007 CIF
HKL
Paper
C16 H24 B F3 O5 S SiP n a 2110.4316; 25.1732; 7.7756
90; 90; 90
2041.8Barnå, Fredrik; Hribersek, Matic; Orthaber, Andreas; Pilarski, Lukasz T.
Synthesis and crystal structures of boryl <i>ortho</i>-silylaryl tri-fluoro-methane-sulfonates.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 143-147
2023008 CIF
HKL
Paper
C16 H24 B F3 O5 S SiC 1 2/c 128.334; 11.8449; 12.9139
90; 92.723; 90
4329.2Barnå, Fredrik; Hribersek, Matic; Orthaber, Andreas; Pilarski, Lukasz T.
Synthesis and crystal structures of boryl <i>ortho</i>-silylaryl tri-fluoro-methane-sulfonates.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 143-147
2023009 CIF
HKL
Paper
C17 H26 B F3 O5 S SiP 1 21/n 110.2407; 12.6295; 34.127
90; 95.689; 90
4392.1Barnå, Fredrik; Hribersek, Matic; Orthaber, Andreas; Pilarski, Lukasz T.
Synthesis and crystal structures of boryl <i>ortho</i>-silylaryl tri-fluoro-methane-sulfonates.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 143-147
2023010 CIF
HKL
Paper
C4 H10 N4 O2P 21 21 216.0356; 7.6501; 15.7851
90; 90; 90
728.84Bibik, Yurii S.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Bargan, Alexandra; Lampeka, Rostyslav D.
Synthesis and crystal structure of <i>N</i><sup>1</sup>,<i>N</i><sup>2</sup>-di-methyl-ethane-dihydrazide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 148-151
2023011 CIF
HKL
Paper
C28 H36 Au N3 OP 21 21 2110.3941; 11.154; 23.3489
90; 90; 90
2707Bakhoda, Abolghasem
Synthesis and crystal structure of [1,3-bis-(2,6-diiso-propyl-phen-yl)imidazol-2-yl-idene](iso-cyanato-κ<i>N</i>)gold(I).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 166-168
2023012 CIF
HKL
Paper
C12 H26 Au Cl N2P 1 21/n 16.4068; 25.2542; 9.3395
90; 103.946; 90
1466.58Döring, Cindy; Jones, Peter G.
Crystal structures of five gold(I) complexes with methyl-piperidine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 157-165
2023013 CIF
HKL
Paper
C12 H26 Au2 Cl2 N2P -19.6998; 9.7001; 10.7194
102.218; 101.893; 114.695
844.89Döring, Cindy; Jones, Peter G.
Crystal structures of five gold(I) complexes with methyl-piperidine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 157-165
2023014 CIF
HKL
Paper
C12 H26 Au2 Br2 N2P -19.8461; 9.7728; 10.9461
100.136; 103.685; 116.287
868.58Döring, Cindy; Jones, Peter G.
Crystal structures of five gold(I) complexes with methyl-piperidine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 157-165
2023015 CIF
HKL
Paper
C19 H41 Au2 Cl4 N3P 1 21/c 120.5785; 16.0876; 18.2247
90; 116.196; 90
5413.7Döring, Cindy; Jones, Peter G.
Crystal structures of five gold(I) complexes with methyl-piperidine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 157-165
2023016 CIF
HKL
Paper
C12 H26 Au Cl N2C 1 2/c 117.6978; 11.2748; 16.562
90; 114.013; 90
3018.8Döring, Cindy; Jones, Peter G.
Crystal structures of five gold(I) complexes with methyl-piperidine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 157-165
2023017 CIF
Paper
C66 H44 Cu3 Eu2 N18 O31R -3 c :H14.0021; 14.0021; 63.523
90; 90; 120
10785.7Yang, Ke; Yang, Yuting; Yao, Ziqin; Cheng, Sisi; Cui, Xue; Wang, Xingyi; Han, Yi; Yi, Feiyan; Mo, Guang
High-pressure study of a 3d–4f heterometallic CuEu–organic skeleton
Acta Crystallographica Section C Structural Chemistry, 2024, 80, 49-55
2023018 CIF
HKL
Paper
C23 H19 N O16 Pr2I 1 2/a 127.4898; 5.9436; 32.0473
90; 93.854; 90
5224.32Yotnoi, Bunlawee; Rujiwatra, Apinpus
Crystal structure and characterization of a new lanthanide coordination polymer, [Pr<sub>2</sub>(pydc)(phth)<sub>2</sub>(H<sub>2</sub>O)<sub>3</sub>]·H<sub>2</sub>O.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 228-231
2023019 CIF
HKL
Paper
C16 H17 N3 O3P -19.1397; 9.4879; 10.0063
79.554; 63.787; 83.054
764.75Ait Elmachkouri, Younesse; Irrou, Ezaddine; El Monfalouti, Hanae; Mazzah, Ahmed; Hökelek, Tuncer; Mague, Joel T.; Taha, Mohamed Labd; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, crystal voids, inter-action energy calculations and energy frameworks and DFT calculations of ethyl 2-cyano-3-(3-hy-droxy-5-methyl-1<i>H</i>-pyrazol-4-yl)-3-phen-yl-propano-ate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 240-246
2023020 CIF
HKL
Paper
C6 H9 Cl N2 OP 1 21/c 19.842; 6.9145; 11.1807
90; 93.618; 90
759.36Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Dukhnovsky, Evgeny A.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G
Crystal structure and Hirshfeld surface analysis of 4-(2-chloro-eth-yl)-5-methyl-1,2-di-hydro-pyrazol-3-one.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 223-227
2023021 CIF
HKL
Paper
C16 H13 N O2P 1 21/c 16.6126; 4.868; 38.924
90; 94.118; 90
1249.73Rharmili, Nohaila; Abdellaoui, Omar; Ouazzani Chahdi, Fouad; Mague, Joel T.; Hökelek, Tuncer; Mazzah, Ahmed; Kandri Rodi, Youssef; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, crystal voids, inter-action energy calculations and energy frameworks, and DFT calculations of 1-(4-methyl-benz-yl)in-do-line-2,3-dione.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 232-239
2023022 CIF
HKL
Paper
C36 H34 Cl Fe2 N3 OP -18.0175; 11.3134; 17.408
95.099; 99.963; 96.414
1536Sghyar, Riham; Bentama, Abdeslem; Haoudi, Amal; Mazzah, Ahmed; Mague, Joel T.; Hökelek, Tuncer; El Hadrami, El Mestafa; Sebbar, Nada Kheira
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-<i>N</i>-{chloro-[(4-ferrocenylphen-yl)imino]-meth-yl}-4-ferrocenylaniline <i>N</i>,<i>N</i>-di-methyl-formamide monosolvate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 262-266
2023023 CIF
HKL
Paper
C10 H6 N2 O4P 1 21/n 114.331; 7.769; 17.558
90; 91.969; 90
1953.7Montoya-Garcia, Maribel; Cortes-Hernandez, Héctor; D'Vries, Richard; Valencia-Sanchez, Hoover
Crystal structure, Hirshfeld surface analysis and DFT study of <i>N</i>-(2-nitro-phen-yl)male-imide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 256-261
2023024 CIF
HKL
Paper
C6 H14 Br2 Cd N2 OP -17.1291; 7.1662; 11.0151
77.704; 80.079; 72.371
520.49Chidambaranathan, B.; Sivaraj, S.; Vijayamathubalan, P.; Abraham Rajasekar, S.; Selvakumar, S.
[4-(2-Aminoethyl)morpholine-κ<sup>2</sup><i>N</i>,<i>N</i>']di-bromidocadmium(II): synthesis, crystal structure and Hirshfeld surface analysis.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 271-276
2023025 CIF
HKL
Paper
C21 H23 F2 N O4C 1 2/c 119.705; 15.389; 14.1279
90; 113.801; 90
3919.8Yıldırım, Sema Öztürk; Akkurt, Mehmet; Pehlivanlar, Ezgi; Çetin, Gökalp; Şimşek, Rahime; Butcher, Ray J.; Bhattarai, Ajaya
Syntheses, characterizations, crystal structures and Hirshfeld surface analyses of methyl 4-[4-(di-fluorometh-oxy)phen-yl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate, isopropyl 4-[4-(di-fluoro-meth-oxy)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate and <i>tert</i>-butyl 4-[4-(di-fluoro-meth-oxy)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 281-288
2023026 CIF
HKL
Paper
C23 H27 F2 N O4P b c a12.255; 15.694; 21.903
90; 90; 90
4212.6Yıldırım, Sema Öztürk; Akkurt, Mehmet; Pehlivanlar, Ezgi; Çetin, Gökalp; Şimşek, Rahime; Butcher, Ray J.; Bhattarai, Ajaya
Syntheses, characterizations, crystal structures and Hirshfeld surface analyses of methyl 4-[4-(di-fluorometh-oxy)phen-yl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate, isopropyl 4-[4-(di-fluoro-meth-oxy)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate and <i>tert</i>-butyl 4-[4-(di-fluoro-meth-oxy)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 281-288
2023027 CIF
HKL
Paper
C24 H29 F2 N O4P b c a12.4094; 15.9871; 21.9629
90; 90; 90
4357.2Yıldırım, Sema Öztürk; Akkurt, Mehmet; Pehlivanlar, Ezgi; Çetin, Gökalp; Şimşek, Rahime; Butcher, Ray J.; Bhattarai, Ajaya
Syntheses, characterizations, crystal structures and Hirshfeld surface analyses of methyl 4-[4-(di-fluorometh-oxy)phen-yl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate, isopropyl 4-[4-(di-fluoro-meth-oxy)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate and <i>tert</i>-butyl 4-[4-(di-fluoro-meth-oxy)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 281-288
2023028 CIF
HKL
Paper
C16 H22 N5 O5 VP -17.685; 9.4135; 13.9147
105.609; 101.103; 96.253
937.5Mondal, Bipul
Crystal structure of di-ethyl-ammonium dioxido{<i>Z</i>)-<i>N</i>-[(pyri-din-2-yl)car-bon-yl-azan-idyl]pyri-dine-2-car-box-imid-ato}vana-date(1-) monohydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 277-280
2023029 CIF
HKL
Paper
C32 H28 Na O12 SmP 1 21/c 111.5512; 24.4768; 12.8355
90; 115.742; 90
3268.9Hastings, Ashley M.; Williams, Ashley; Surbella Iii, Robert G.; Hixon, Amy E.; Arteaga, Ana
Structural characterization of a new samarium-sodium heterometallic coordination polymer.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 267-270
2023030 CIF
HKL
Paper
C9 H11 Cl N2 SeP 1 21/c 19.054; 15.015; 30.93
90; 94.1; 90
4194Temesgen, Ayalew W.; Sapronov, Alexander A.; Kubasov, Alexey S.; Novikov, Alexander S.; Le, Tuan Anh; Tskhovrebov, Alexander G.
Synthesis and crystal structure of the adduct between 2-pyridyl-selenyl chloride and isobutyro-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 247-251
2023031 CIF
HKL
Paper
C18 H24 N Na O9 SP -19.9014; 10.7214; 11.9401
69.789; 71.074; 66.439
1064.45Bereziuk, Olha; Gubina, Kateryna; Trush, Viktor; Ovchynnikov, Vladimir
Crystal structure of the sodium salt of mesotrione: a triketone herbicide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 296-299
2023032 CIF
HKL
Paper
C12 H11 N3 O SP 1 21/c 18.78308; 11.66215; 11.00169
90; 97.946; 90
1116.08Elboshi, Heba A.; Azzam, Rasha A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of 4-(benzo[<i>d</i>]thia-zol-2-yl)-1,2-dimethyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 289-291
2023033 CIF
Paper
C29 H40 N4 O8.961R 3 :H24.3443; 24.3443; 14.55212
90; 90; 120
7468.81Kaduk, James A.; Boaz, Nicholas C.; Gates-Rector, Stacy; Gindhart, Amy M.; Blanton, Thomas N.
Omadacycline dihydrate, C<sub>29</sub>H<sub>40</sub>N<sub>4</sub>O<sub>7</sub>·2H<sub>2</sub>O, from X-ray powder diffraction data.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 292-295
2023034 CIF
HKL
Paper
C31 H24 N4 O2P -18.8038; 10.2277; 14.0937
90.262; 96.63; 108.395
1195Abad, Nadeem; Mague, Joel T.; Alsubari, Abdulsalam; Essassi, El Mokhtar; Alzahrani, Abdullah Yahya Abdullah; Ramli, Youssef
Crystal structure and Hirshfeld surface analysis of 3-phenyl-1-{3-[(3-phenyl-quinoxalin-2-yl)-oxy]prop-yl}-1,2-di-hydro-quinoxalin-2-one.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 300-304
2023035 CIF
HKL
Paper
C21 H31 N3 O5 SP 1 21/c 111.0276; 10.7661; 19.635
90; 91.792; 90
2330Rybczyńska, Małgorzata; Sikorski, Artur
Crystal structure of the tetra-ethyl-ammonium salt of the non-steroidal anti-inflammatory drug nimesulide (polymorph II).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 314-317
2023036 CIF
HKL
Paper
C14 H8 N4 O2P -17.166; 7.686; 12.172
95.473; 105.226; 113.116
579.9Dhote, Pawan; Tothadi, Srinu; Ramana, Chepuri V.
Synthesis, characterization, and crystal structure of 2-(2-azido-phen-yl)-3-oxo-3<i>H</i>-indole 1-oxide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 310-313
2023037 CIF
HKL
Paper
C21 H15 N5 O S2P 1 21/n 15.63465; 18.02763; 18.40115
90; 97.1649; 90
1854.58Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Mamedov, Huseyn M.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G
Crystal structure and Hirshfeld surface analysis of 4-oxo-3-phenyl-2-sulfanyl-idene-5-(thio-phen-2-yl)-3,4,7,8,9,10-hexa-hydro-2<i>H</i>-pyrido[1,6-<i>a</i>:2,3-<i>d</i>']di-pyrimidine-6-carbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 325-329
2023038 CIF
HKL
Paper
C26.5 H18 F10 N2 O4.5 SiP 1 21/n 112.6809; 12.1217; 17.7335
90; 105.767; 90
2623.3Kraft, Bradley M.; Brennessel, William W.; Andrews, Jordan W.; Viggiani, Michael T.; Kittrell, Nathan F.; Heckman, Matthew T.
Synthesis and crystal structures of bis-[1-oxopyridin-2-olato(1-)]bis-(penta-fluoro-phen-yl)silicon(IV)-tetra-hydro-furan-pentane (2/1/1), bis-[1-oxopyridin-2-olato(1-)]bis-(<i>p</i>-tol-yl)silicon(IV), and dimesitylbis[1-oxopyridin-2-olato(1-)]silicon(IV).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 318-324
2023039 CIF
HKL
Paper
C24 H22 N2 O4 SiP -18.5662; 8.8343; 14.7801
93.057; 105.372; 106.757
1022.45Kraft, Bradley M.; Brennessel, William W.; Andrews, Jordan W.; Viggiani, Michael T.; Kittrell, Nathan F.; Heckman, Matthew T.
Synthesis and crystal structures of bis-[1-oxopyridin-2-olato(1-)]bis-(penta-fluoro-phen-yl)silicon(IV)-tetra-hydro-furan-pentane (2/1/1), bis-[1-oxopyridin-2-olato(1-)]bis-(<i>p</i>-tol-yl)silicon(IV), and dimesitylbis[1-oxopyridin-2-olato(1-)]silicon(IV).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 318-324
2023040 CIF
HKL
Paper
C28 H30 N2 O4 SiP 21 21 2112.571; 12.68898; 15.358
90; 90; 90
2449.8Kraft, Bradley M.; Brennessel, William W.; Andrews, Jordan W.; Viggiani, Michael T.; Kittrell, Nathan F.; Heckman, Matthew T.
Synthesis and crystal structures of bis-[1-oxopyridin-2-olato(1-)]bis-(penta-fluoro-phen-yl)silicon(IV)-tetra-hydro-furan-pentane (2/1/1), bis-[1-oxopyridin-2-olato(1-)]bis-(<i>p</i>-tol-yl)silicon(IV), and dimesitylbis[1-oxopyridin-2-olato(1-)]silicon(IV).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 318-324
2023041 CIF
HKL
Paper
C28 H46 F3 N3 O7 S2 SiP 1 21 18.5784; 14.4797; 13.6961
90; 96.052; 90
1691.75Alaboosh, Jamal M. H.; Hill, Steven P.; Kariuki, Benson M.; Redman, James E.
Crystal structures of sulfonamide protected bicyclic guanidines: (<i>S</i>)-8-{[(<i>tert</i>-butyl-dimethyl-sil-yl)-oxy]meth-yl}-1-[(2,2,4,6,7-penta-methyl-2,3-di-hydro-benzo-furan-5-yl)sulfon-yl]-1,3,4,6,7,8-hexa-hydro-2<i>H</i>-pyrimido[1,2-<i>a</i>]pyrimidin-1-ium tri-fluoro-methane-sulfonate and (<i>S</i>)-8-(iodo-meth-yl)-1-tosyl-1,3,4,6,7,8-hexa-hydro-2<i>H</i>-pyrimido[1,2-<i>a</i>]pyrimidin-1-ium iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 305-309
2023042 CIF
HKL
Paper
C15 H21 I2 N3 O2 SP 21 21 216.6117; 10.1482; 28.1444
90; 90; 90
1888.4Alaboosh, Jamal M. H.; Hill, Steven P.; Kariuki, Benson M.; Redman, James E.
Crystal structures of sulfonamide protected bicyclic guanidines: (<i>S</i>)-8-{[(<i>tert</i>-butyl-dimethyl-sil-yl)-oxy]meth-yl}-1-[(2,2,4,6,7-penta-methyl-2,3-di-hydro-benzo-furan-5-yl)sulfon-yl]-1,3,4,6,7,8-hexa-hydro-2<i>H</i>-pyrimido[1,2-<i>a</i>]pyrimidin-1-ium tri-fluoro-methane-sulfonate and (<i>S</i>)-8-(iodo-meth-yl)-1-tosyl-1,3,4,6,7,8-hexa-hydro-2<i>H</i>-pyrimido[1,2-<i>a</i>]pyrimidin-1-ium iodide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 305-309
2023043 CIF
HKL
Paper
C14 H16 Cu N2 O6P 1 2/c 16.9143; 6.2111; 17.169
90; 90.05; 90
737.3Gogia, Alisha; Novikov, Egor M.; Guzei, Ilia A.; Fonari, Marina S.; Timofeeva, Tatiana V.
Crystal structure and characterization of a new one-dimensional copper(II) coordination polymer containing a 4-amino-benzoic acid ligand.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 330-334
2023044 CIF
Paper
C56 H80 Cu2 O14 S2P -110.299; 11.734; 12.846
87.275; 88.918; 72.096
1475.6Shlian, Daniel G.; Summers, Rachael H.; Martinez, Katelyn; Upmacis, Rita K.
Crystal structure of tetra-kis-(μ-2-hy-droxy-3,5-di-isoprop-yl-benzoato)bis-[(dimethyl sulfoxide)copper(II)].
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 335-338
2023045 CIF
Paper
C25 H18 N4P b c a16.8662; 12.8555; 18.7561
90; 90; 90
4066.8Bader, Mamoun M.; Pham, Phuong-Truc
Crystal structure of 1-{4-[bis-(4-methyl-phen-yl)amino]-phen-yl}ethene-1,2,2-tricarbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 339-342
2023046 CIF
Paper
C12 H25 Cl3 N4 O2 ZnP 1 21/n 18.7253; 14.3482; 14.0718
90; 104.76; 90
1703.5Hubin, Daniel J.; Cunningham, Blue M.; Hubin, Timothy J.; Ebel, Jonathan P.; Krause, Jeanette A.; Oliver, Allen G.
The unanti-cipated oxidation of a tertiary amine in a tetra-cyclic glyoxal-cyclam condensate yielding zinc(II) coordinated to a sterically hindered amine oxide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 343-346
2023047 CIF
Paper
C14 H12 N2 O4P 1 21/m 18.7649; 6.8899; 10.6868
90; 104.676; 90
624.31Shi, Xin-Wei; Zheng, Shao-Jun; Lu, Qiang-Qiang; Li, Gen; Zhou, Ya-Fu
Synthesis, crystal structure and Hirshfeld surface analysis of <i>N</i>-(6-acetyl-1-nitro-naphthalen-2-yl)acetamide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 347-350
2023048 CIF
Paper
C28 H29 Cl N8 O6C 1 2/c 120.5406; 13.7457; 10.565
90; 107.006; 90
2852.54Gautam, Ram N.; Sonkar, Sankatha P.; Yadav, Shailendra; Nath, Paras; Bharty, Manoj K.
Co<sup>II</sup>-catalysed synthesis of <i>N</i>-(4-meth-oxy-phen-yl)-5-(pyridin-4-yl)-1,3,4-oxa-diazol-2-amine hemi-hydro-chloride monohydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 351-354
2023049 CIF
Paper
C40 H44 Cl12 Lu N4 O16 P5P 1 21/c 119.6882; 18.9452; 17.2139
90; 110.811; 90
6001.8Struhatska, Mariia B.; Ovchynnikov, Vladimir A.; Kariaka, Nataliia S.; Gawryszewska, Paula; Amirkhanov, Volodymyr M.
Crystal structure of tetra-phenyl phosphate tetra-kis-[dimethyl (2,2,2-tri-chloro-acet-yl)phos-pho-ramidato]lutetium(III), PPh<sub>4</sub>[Lu<i>L</i><sub>4</sub>].
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 370-374
2023050 CIF
Paper
C9 H21 Au Cl3 P SP -18.0262; 9.0839; 10.7162
86.185; 85.73; 84.468
774.12Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023051 CIF
Paper
C10 H23 Au Cl3 P SP 1 21/n 18.4533; 17.0563; 11.4826
90; 94.525; 90
1650.42Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023052 CIF
Paper
C10 H23 Au Cl3 P SP 1 21/n 17.9363; 14.4096; 14.2851
90; 91.774; 90
1632.85Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023053 CIF
Paper
C11 H25 Au Cl3 P SP -18.6034; 9.7779; 11.4231
78.876; 71.456; 72.702
864.7Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023054 CIF
Paper
C12 H25 Au Cl6 D P SP -19.6382; 10.2787; 11.8483
75.115; 68.875; 89.728
1053.13Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023055 CIF
Paper
C13 H29 Au Cl5 P SP -18.4202; 11.2194; 11.8355
98.398; 101.174; 95.991
1074.95Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023056 CIF
Paper
C10 H23 Au Cl3 P SeP 1 21/n 17.92516; 14.5559; 14.3635
90; 91.264; 90
1656.54Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023057 CIF
Paper
C11 H25 Au Cl3 P SeP -18.5878; 9.8435; 11.5022
78.391; 71.168; 73.463
875.78Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023058 CIF
Paper
C12 H25 Au Cl6 D P SeP -18.5343; 9.7185; 14.0759
74.398; 78.121; 73.257
1066.3Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023059 CIF
Paper
C9 H21 Au Br3 P SP 1 21/c 19.1341; 7.9039; 22.642
90; 94.519; 90
1629.56Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023060 CIF
Paper
C11 H25 Au Br3 P SP -18.6067; 10.1161; 11.5123
77.873; 70.257; 71.867
890.37Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023061 CIF
Paper
C9 H21 Au Br3 P SeP -18.3928; 10.1417; 10.7567
94.419; 105.612; 110.113
813.34Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023062 CIF
Paper
C11 H25 Au Br3 P SeP -18.6; 10.2045; 11.5987
77.475; 69.764; 72.601
904.02Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 355-369
2023063 CIF
Paper
C13 H13 Cl F N O4P 1 21 17.8729; 5.5655; 15.492
90; 101.446; 90
665.31Li, Victor; Yap, Glenn P. A.; Ni, Chaoying
Crystal structure of (<i>S</i>)-5-(3-acetyl-5-chloro-2-ethoxy-6-fluorophenyl)-2-oxazolidinone.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 375-377
2023064 CIF
Paper
C17 H15 N5P 1 21/c 16.2459; 14.148; 16.2111
90; 92.435; 90
1431.23Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Dobrokhotova, Ekaterina V.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G
Crystal structure and Hirshfeld surface analysis of 6-imino-8-(4-methyl-phen-yl)-1,3,4,6-tetra-hydro-2<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidine-7,9-dicarbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 378-382
2023065 CIF
Paper
C17 H12 N2 OP -18.4614; 9.0947; 9.536
87.739; 72.963; 69.028
653.39Abad, Nadeem; Mague, Joel T.; Alsubari, Abdulsalam; Essassi, El Mokhtar; Pourayoubi, Mehrdad; Yahya Abdullah Alzahrani, Abdullah; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 2-phenyl-3-(prop-2-yn-1-yl-oxy)quin-oxaline.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 383-387
2023066 CIF
Paper
C21 H23 N3 O3P 21 21 218.444; 14.3013; 15.4233
90; 90; 90
1862.52Lamssane, Houda; Haoudi, Amal; Kartah, Badr Eddine; Mazzah, Ahmed; Mague, Joel T.; Hökelek, Tuncer; Kandri Rodi, Youssef; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, calculations of crystal voids, inter-action energy and energy frameworks as well as density functional theory (DFT) calculations of 3-[2-(morpholin-4-yl)eth-yl]-5,5-di-phenyl-imidazolidine-2,4-dione.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 423-429
2023067 CIFC9 H9 Li O5P 1 21/n 18.3083; 4.8511; 22.587
90; 98.572; 90
900.2Bieler, Irén; Wagner, Christoph; Merzweiler, Kurt
Lithium and sodium 3-(3,4-di-hydroxy-phen-yl)propenoate hydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 401-407
2023068 CIFC9 H9 Na O5P -16.3289; 6.8126; 11.253
75.05; 86.39; 78.09
458.65Bieler, Irén; Wagner, Christoph; Merzweiler, Kurt
Lithium and sodium 3-(3,4-di-hydroxy-phen-yl)propenoate hydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 401-407
2023069 CIF
Paper
C20 H28 Br2 Cu N12 S8P 4/n :212.69368; 12.69368; 11.35879
90; 90; 90
1830.24Atashov, Aziz; Azamova, Mukhlisakhon; Ziyatov, Daminbek; Uzakbergenova, Zamira; Torambetov, Batirbay; Holczbauer, Tamas; Ashurov, Jamshid; Kadirova, Shakhnoza
Synthesis, crystal structure and Hirshfeld surface analysis of bromido-tetra-kis-[5-(prop-2-en-1-yl-sulf-an-yl)-1,3,4-thia-diazol-2-amine-κ<i>N</i><sup>3</sup>]copper(II) bromide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 408-412
2023070 CIF
Paper
C25 H31 N5 O6P 1 21/n 19.9055; 15.96; 16.4794
90; 106.344; 90
2499.98Metwally, Nadia H.; Elgemeie, Galal H.; Abd Al-Latif, El-Shimaa S M; Jones, Peter G.
Crystal structure of 2,4-di-amino-5-(4-hy-droxy-3-meth-oxy-phen-yl)-8,8-dimethyl-6-oxo-6,7,8,9-tetra-hydro-5<i>H</i>-chromeno[2,3-<i>b</i>]pyridine-3-carbo-nitrile-di-methyl-formamide-water (1/1/1).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 396-400
2023071 CIF
Paper
C18 H18 O12I 41 c d24.069; 24.069; 6.4468
90; 90; 90
3734.7Hanauer, Thomas; Seichter, Wilhelm; Mazik, Monika
Crystal structure and Hirshfeld surface analysis of 4,4'-di-meth-oxy-biphenyl-3,3',5,5'-tetra-carb-oxy-lic acid dihydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 413-417
2023072 CIF
Paper
C8 H7 N O2P -16.6279; 7.3272; 8.2308
67.271; 83.403; 73.006
352.58Florez-Muñoz, Valentina; Guerrero, Andres Felipe; Macias, Mario; Illicachi, Luis Alberto; D'Vries, Richard
Synthesis, characterization and supra-molecular analysis for (<i>E</i>)-3-(pyridin-4-yl)acrylic acid.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 388-391
2023073 CIF
Paper
C13 H13 Cl N2 O3P c a 2122.8042; 4.7826; 11.7421
90; 90; 90
1280.63Mustaphi, Nour El Hoda; Aboutofil, Fatima Ezzahra; El Houssni, Lamyae; Saif, Eiad; Mague, Joel T.; Chkirate, Karim; Essassi, El Mokhtar
Crystal structure and Hirshfeld surface analysis of ethyl 2-(7-chloro-3-methyl-2-oxo-1,2-di-hydro-quinoxalin-1-yl)acetate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 430-434
2023074 CIF
Paper
C64 H62 N4 O9 S2P -110.7108; 11.7817; 12.9233
73.831; 67.667; 67.38
1375.62Burkin, Gleb M.; Kvyatkovskaya, Elizaveta A.; Khrustalev, Victor N.; Hasanov, Khudayar I.; Sadikhova, Nurlana D.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 8-benzyl-1-[(4-methyl-phen-yl)sulfon-yl]-2,7,8,9-tetra-hydro-1<i>H</i>-3,6:10,13-diep-oxy-1,8-benzodi-aza-cyclo-penta-decine ethanol hemisolvate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 418-422
2023075 CIF
Paper
C14 H13 N O SP -15.6768; 12.0747; 18.1912
87.071; 82.11; 81.11
1219.72Mohamed-Ezzat, Reham A; Kariuki, Benson M.; Elgemeie, Galal H.
Synthesis and crystal structure of <i>N</i>-phenyl-2-(phenyl-sulfan-yl)acetamide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 392-395
2023076 CIF
Paper
C18 H19 Br N2 O3 SP b c a12.407; 17.425; 17.5276
90; 90; 90
3789.3Kolade, Sherif O.; Aina, Oluwafemi S.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
Synthesis, crystal structure and in-silico evaluation of arylsulfonamide Schiff bases for potential activity against colon cancer.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 129-142
2023077 CIF
Paper
C22 H18 N2 O12P -15.9454; 7.9543; 12.0673
72.124; 79.661; 86.052
534.25Businski, Artjom; Ta, Thuy C.; Gindullis, Niklas; Näther, Christian; Herges, Rainer
Synthesis and crystal structure of tetra-methyl (<i>E</i>)-4,4'-(ethene-1,2-di-yl)bis-(5-nitro-benzene-1,2-di-carboxyl-ate).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 435-438
2023078 CIF
Paper
C20 H17 Br O5 SP 1 21/c 111.467; 8.4852; 20.4823
90; 105.135; 90
1923.8Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Asadov, Khammed A.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of dimethyl 4′-bromo-3-oxo-5-(thiophen-2-yl)-3,4,5,6-tetrahydro-[1,1′-biphenyl]-2,4-dicarboxylate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023079 CIF
Paper
C8 H11 N5 O2P 1 21/c 110.7082; 7.027; 13.882
90; 91.679; 90
1044.12Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Ponomarova, Vira V.; Lysenko, Andrey B.; Krautscheid, Harald
2-Cyano-2-isonitrosoacetamide–3,4-dimethylpyrazole (1/1): a co-crystal of two molecules with agrochemical activities
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023080 CIF
Paper
C14 H23 N3 SP -17.4584; 7.7429; 13.2461
103.025; 98.735; 90.769
735.73Oliveira, Adriano Bof de; Beck, Johannes; Daniels, Jörg
Synthesis, crystal structure and Hirshfeld analysis of N-ethyl-2-{3-methyl-2-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-ylidene}hydrazinecarbothioamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023081 CIF
Paper
C5 H12 N2 O2P c a 217.1686; 4.8491; 19.1276
90; 90; 90
664.9Justen, Guilherme Augusto; Carneiro Neto, José Severiano; Sousa Santana, Francielli; Leiriane Batistel Ribas, Maria; Gomes da Silva de Paula, Felipe; Dario, Priscila Paola; Gonçalves Montes D'Oca, Marcelo
Crystal structure and Hirshfeld surface analysis of 5-hydroxypentanehydrazide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023082 CIF
Paper
C22 H23 Cu N5 O3P 1 21 18.2816; 17.4856; 14.9186
90; 104.478; 90
2091.74Kaneda, Ai; Suzuki, Soma; Nakane, Daisuke; Kashiwagi, Yukiyasu; Akitsu, Takashiro
Crystal structure and Hirshfeld surface analysis of (1H-imidazole-κN 3)[4-methyl-2-({[2-oxido-5-(2-phenyldiazen-1-yl)phenyl]methylidene}amino)pentanoate-κ3 O,N,O′]copper(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023083 CIF
Paper
C20 H21 Co N5 O3 S2C 1 c 111.902; 26.4007; 7.1933
90; 104.299; 90
2190.26Näther, Christian; Jess, Inke
Synthesis, crystal structure and properties of the trigonal–bipyramidal complex tris(2-methylpyridine N-oxide-κO)bis(thiocyanato-κN)cobalt(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023084 CIF
Paper
C33 H34 B2 Co F8 N12P -110.6861; 13.0639; 15.7006
96.304; 107.142; 110.766
1901.24Batra, Vipul; Reed, Garrett C.; Tierney, David L.
Structure of the five-coordinate CoII complex (1H-imidazole){tris[(1-benzyltriazol-4-yl-κN 3)methyl]amine-κN}cobalt(II) bis(tetrafluoroborate)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023085 CIF
Paper
C6 H13 Au Cl3 NP b c a12.5716; 8.394; 20.3319
90; 90; 90
2145.54Döring, Cindy; Jones, Peter G.
Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023086 CIF
Paper
C6 H13 Au Br3 NP n m a9.9871; 7.1505; 15.716
90; 90; 90
1122.32Döring, Cindy; Jones, Peter G.
Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023087 CIF
Paper
C6 H13 Au Br3 NP b c a12.6471; 8.7247; 21.0262
90; 90; 90
2320.08Döring, Cindy; Jones, Peter G.
Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023088 CIF
Paper
C25 H20 N6 OP -110.2188; 10.7365; 20.4119
84.376; 89.298; 70.167
2095.97Mamedov, İbrahim G.; Khrustalev, Victor N.; Akkurt, Mehmet; Kerimli, Fuad Sh.; Bhattarai, Ajaya; Khalilov, Ali N.; Naghiyev, Farid N.
Crystal structure and Hirshfeld surface analysis of 2,4-diamino-6-[(1Z,3E)-1-cyano-2,4-diphenylpenta-1,3-dien-1-yl]pyridine-3,5-dicarbonitrile monohydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023089 CIF
Paper
C30 H36 Co2 N8 O6 S4P 1 21/n 111.46665; 12.37103; 13.58185
90; 97.0894; 90
1911.91Näther, Christian; Jess, Inke
Synthesis, crystal structure and thermal properties of the dinuclear complex bis(μ-4-methylpyridine N-oxide-κ2 O:O)bis[(methanol-κO)(4-methylpyridine N-oxide-κO)bis(thiocyanato-κN)cobalt(II)]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023090 CIF
Paper
C54 H108 Mo6 N6 S27P 1 21/n 116.1699; 21.1139; 30.0046
90; 91.576; 90
10240Fraker, Addison; Donahue, James P.; McSkimming, Alex
Bis[tris(diisobutyldithiocarbamato)-μ3-sulfido-tri-μ2-disulfido-trimolybdenum(IV)] sulfide tetrahydrofuran monosolvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023091 CIF
Paper
C12 H15 N3 O2 SP -15.77; 8.3069; 14.6243
82.891; 87.004; 74.172
669.07Madhan, Sundarasamy; NizamMohideen, Mohamed; Viswanathan, Vijayan; Karthik Ananth, Mani; Narasimhan, Srinivasan
Synthesis, crystal structure and Hirshfeld surface analysis of 4-{(1E)-1-[(carbamothioylamino)imino]ethyl}phenyl propanoate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023092 CIF
Paper
As2 H7 N Ni3 O10C 1 2/m 110.178; 5.9156; 7.7158
90; 112.658; 90
428.71Eder, Felix; Weil, Matthias
Synthesis and crystal structure of (NH4)[Ni3(HAsO4)(AsO4)(OH)2]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023093 CIF
Paper
C24 H21 N O3 SP -19.427; 9.4386; 12.3849
95.392; 96.849; 106.512
1039.49Yakovleva, Elizaveta D.; Shelukho, Evgeniya R.; Grigoriev, Mikhail S.; Hasanov, Khudayar I.; Sadikhova, Nurlana D.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (Z)-4-({[2-(benzo[b]thiophen-3-yl)cyclopent-1-en-1-yl]methyl}(phenyl)amino)-4-oxobut-2-enoic acid
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023094 CIF
Paper
C23 H21 Br N4 OP -19.226; 12.7703; 18.6607
109.79; 96.72; 90.657
2051.4Abu-Zaied, Mamdouh A.; Mohamed-Ezzat, Reham A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of (E)-N-(4-bromophenyl)-2-cyano-3-[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023095 CIF
Paper
C9 H21 Au Cl5 P SP 1 21/n 113.3577; 10.0877; 13.9182
90; 106.29; 90
1800.16Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023096 CIF
Paper
C10 H23 Au Cl5 P SP -17.5619; 8.7408; 15.4558
84.346; 78.306; 66.915
920.07Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023097 CIF
Paper
C11 H25 Au Cl5 P SC 1 2/c 133.653; 7.7933; 16.212
90; 113.861; 90
3888.5Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023098 CIF
Paper
C12 H27 Au Cl5 P SP 1 21/n 19.7661; 12.5787; 16.9776
90; 103.887; 90
2024.65Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023099 CIF
Paper
C9 H21 Au Cl5 P SeP -17.4202; 8.5966; 15.398
97.497; 100.128; 109.324
893.42Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023100 CIF
Paper
C10 H23 Au Cl5 P SeP -17.5836; 8.7603; 15.4719
84.445; 78.641; 67.128
928.27Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023101 CIF
Paper
C11 H25 Au Cl5 P SeC 1 2/c 133.7472; 7.79306; 16.2575
90; 113.582; 90
3918.56Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023102 CIF
Paper
C9 H21 Au Br5 P SP -17.8543; 8.0592; 15.3505
76.717; 83.169; 87.722
938.89Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023103 CIF
Paper
C10 H23 Au Br5 P SP -17.8455; 9.138; 15.544
86.6; 81.097; 64.862
996.66Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023104 CIF
Paper
C11 H25 Au Br5 P SP 1 21/n 112.4712; 10.3712; 16.2524
90; 92.724; 90
2099.73Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023105 CIF
Paper
C12 H27 Au Br5 P SP -110.2218; 10.8085; 11.1163
70.909; 71.516; 75.645
1086.39Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023106 CIF
Paper
C9 H21 Au Br5 P SeP -17.9212; 8.0606; 15.2911
76.817; 82.668; 87.728
942.77Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023107 CIF
Paper
C10 H23 Au Br5 P SeP -17.8155; 9.1505; 15.5221
85.965; 80.294; 66.049
999.97Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023108 CIF
Paper
C11 H25 Au Br5 P SeP 1 21/n 112.3529; 10.4233; 16.4635
90; 93.453; 90
2115.96Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023109 CIF
Paper
C10 H26 Br4 N2 O4 Sn2P 1 21/c 17.0415; 17.9349; 9.0148
90; 100.812; 90
1118.26Klecker, Christopher Jan; Reuter, Hans
Dimeric ethyltin(IV)–dibromide–hydroxide–N,N-dimethylformamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023110 CIF
Paper
C21 H17 N3 O2P 1 21/c 117.764; 8.4429; 11.6601
90; 100.948; 90
1717El Moutaouakil Ala Allah, Abderrazzak; Guerrab, Walid; Mague, Joel T.; Alsubari, Abdulsalam; Alzahrani, Abdullah Yahya Abdullah; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 2-[(4-hydroxyphenyl)amino]-5,5-diphenyl-1H-imidazol-4(5H)-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023111 CIF
Paper
C11 H16 F3 N O3 SP 1 21/n 18.5194; 18.1257; 9.0875
90; 105.106; 90
1354.8Stewart, John W.; Irons, Elena M.; Osorio Abanto, Giovanna; Zeller, Matthias; Zaleski, Curtis M.; Predecki, Daniel P.
Synthesis and crystal structures of N,2,4,6-tetramethylanilinium trifluoromethanesulfonate and N-isopropylidene-N,2,4,6-tetramethylanilinium trifluoromethanesulfonate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023112 CIF
Paper
C14 H20 F3 N O3 SP 1 21/n 16.858; 19.4619; 12.6131
90; 102.024; 90
1646.53Stewart, John W.; Irons, Elena M.; Osorio Abanto, Giovanna; Zeller, Matthias; Zaleski, Curtis M.; Predecki, Daniel P.
Synthesis and crystal structures of N,2,4,6-tetramethylanilinium trifluoromethanesulfonate and N-isopropylidene-N,2,4,6-tetramethylanilinium trifluoromethanesulfonate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023113 CIF
Paper
C11 H10 Cl N O PtP 1 21/c 17.9462; 26.5977; 5.186
90; 100.613; 90
1077.31Chi, Nguyen Thi Thanh; Tuan Cuong, Ngo; Thu Trang, Tran; Van Thong, Pham; Linh, Nguyen Thi Bang; Ly, Nguyen Thi Khanh; Van Meervelt, Luc
Synthesis, crystal structure and anticancer activity of the complex chlorido(η2-ethylene)(quinolin-8-olato-κ2 N,O)platinum(II) by experimental and theoretical methods
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 550-554
2023114 CIF
Paper
C34 H26 Br2 O4P -110.1542; 11.9156; 11.9964
75.221; 88.341; 81.751
1388.9Gorbunov, Alexander; Bezzubov, Stanislav; Malakhova, Maria; Kovalev, Vladimir; Vatsouro, Ivan
Synthesis and crystal structures of 5,17-dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene, 5,17-dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene and 25,27-bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023115 CIF
Paper
C40 H38 Br2 O4P b c n18.1223; 9.984; 18.2863
90; 90; 90
3308.6Gorbunov, Alexander; Bezzubov, Stanislav; Malakhova, Maria; Kovalev, Vladimir; Vatsouro, Ivan
Synthesis and crystal structures of 5,17-dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene, 5,17-dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene and 25,27-bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023116 CIF
Paper
C32 H28 Br2 N6 O4R -3 :H36.3261; 36.3261; 12.1054
90; 90; 120
13834Gorbunov, Alexander; Bezzubov, Stanislav; Malakhova, Maria; Kovalev, Vladimir; Vatsouro, Ivan
Synthesis and crystal structures of 5,17-dibromo-26,28-dihydroxy-25,27-dipropynyloxycalix[4]arene, 5,17-dibromo-26,28-dipropoxy-25,27-dipropynyloxycalix[4]arene and 25,27-bis(2-azidoethoxy)-5,17-dibromo-26,28-dihydroxycalix[4]arene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023117 CIF
Paper
C12 H10 N2 O3P -18.1208; 8.2262; 9.5944
73.338; 72.167; 62.966
535.19Shi, Xin-Wei; Bai, Ming-sheng; Zheng, Shao-Jun; Lu, Qiang-Qiang; Li, Gen; Zhou, Ya-Fu
Crystal structure characterization, Hirshfeld surface analysis, and DFT calculation studies of 1-(6-amino-5-nitronaphthalen-2-yl)ethanone
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023118 CIF
Paper
C40 H34 F12 N8 O14 PdP -18.6173; 10.6265; 13.1312
93.384; 98.121; 94.09
1184.45Zakharchenko, Borys V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Bargan, Alexandra; Vassilyeva, Olga Yu.; Lampeka, Rostyslav D.
Crystal structure of bis{2-[5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine}palladium(II) bis(trifluoroacetate) trifluoroacetic acid disolvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023119 CIF
Paper
C8 H22 Cl6 Co N2C 1 2/c 112.7521; 8.9648; 16.6801
90; 111.057; 90
1779.54McGinness, Katelyn; Minton, Kim; White, Katelyn; Bond, Marcus R.
Bis(2-chloro-N,N-dimethylethan-1-aminium) tetrachloridocobaltate(II) and tetrachloridozincate(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023120 CIF
Paper
C8 H22 Cl6 N2 ZnC 1 2/c 112.7297; 8.9784; 16.6837
90; 111.062; 90
1779.43McGinness, Katelyn; Minton, Kim; White, Katelyn; Bond, Marcus R.
Bis(2-chloro-N,N-dimethylethan-1-aminium) tetrachloridocobaltate(II) and tetrachloridozincate(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023121 CIF
Paper
C15 H13 N O3 SP 1 21/c 19.8042; 9.4258; 15.4065
90; 108.455; 90
1350.5Podrezova, Alexandra G.; Nikitina, Eugeniya V.; Grigoriev, Mikhail S.; Akkurt, Mehmet; Hasanov, Khudayar I.; Sadikhov, Nurlana D.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (Z)-4-oxo-4-{phenyl[(thiophen-2-yl)methyl]amino}but-2-enoic acid
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023122 CIF
Paper
H48 La2 N12 Ni3 O60R -3 :H11.023; 11.023; 34.4826
90; 90; 120
3628.53Bi, David Wenhua; Liu, Yong; Magrez, Arnaud
High-resolution crystal structure of the double nitrate hydrate [La(NO3)6]2[Ni(H2O)6]3·6H2O
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023123 CIF
Paper
C6 H4 Br F3 N4 O2P 1 21/n 14.95281; 14.0515; 13.5208
90; 95.1372; 90
937.192Guseinov, Firudin I.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Ovsyannikov, Viacheslav O.; Ugrak, Bogdan I.; Lavrova, Oksana M.; Samigullina, Aida I.; Bhattarai, Ajaya
Synthesis, crystal structure and Hirshfeld surface analysis of (3Z)-4-[(4-amino-1,2,5-oxadiazol-3-yl)amino]-3-bromo-1,1,1-trifluorobut-3-en-2-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023124 CIF
Paper
C12 H16 N2 OP 1 21/n 19.5331; 8.9358; 14.0279
90; 107.49; 90
1139.73Zeller, Matthias; Parent, Stephan; Schultheiss, Nate
Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023125 CIF
Paper
C12 H16 N2 OP 1 21/c 110.4041; 8.5286; 12.4087
90; 92.5663; 90
1099.95Zeller, Matthias; Parent, Stephan; Schultheiss, Nate
Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023126 CIF
Paper
C12 H16 N2 OP 1 21/c 110.6228; 8.4984; 12.5073
90; 90.807; 90
1129.01Zeller, Matthias; Parent, Stephan; Schultheiss, Nate
Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023127 CIF
Paper
C17 H21 N5 OP 1 21/c 15.7032; 24.2184; 11.8683
90; 91.312; 90
1638.85El Atrassi, Zakaria; Zouhair, Mustapha; Blacque, Olivier; Hökelek, Tuncer; Haoudi, Amal; Mazzah, Ahmed; Cherkaoui, Hassan; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, calculations of intermolecular interaction energies and energy frameworks and the DFT-optimized molecular structure of 1-[(1-butyl-1H-1,2,3-triazol-4-yl)methyl]-3-(prop-1-en-2-yl)-1H-benzimidazol-2-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023128 CIF
Paper
C H19 Cl2 Cu N7 OP 1 21/n 112.2214; 7.023; 13.0537
90; 94.511; 90
1116.94Breen, Olivia D.; Keene, Tony D.
Crystal structure and Hirshfeld surface of a pentaaminecopper(II) complex with urea and chloride
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023129 CIF
Paper
Li Lu Mo2 O8I 41/a :25.1052; 5.1052; 11.08
90; 90; 90
288.78Hartenbach, Ingo; Hertweck, Robin F.
Mixed occupancy: the crystal structure of scheelite-type LiLu[MoO4]2
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023130 CIF
Paper
C31 H24 N4 O2P -19.0384; 9.4484; 14.9524
77.267; 83.991; 72.708
1188.16Abad, Nadeem; Mague, Joel T.; Alsubari, Abdulsalam; Essassi, El Mokhtar; Alzahrani, Abdullah Yahya Abdullah; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 1-[3-(2-oxo-3-phenyl-1,2-dihydroquinoxalin-1-yl)propyl]-3-phenyl-1,2-dihydroquinoxalin-2-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023131 CIF
Paper
C18 H26 O4C 1 2/c 116.9184; 6.523; 17.2645
90; 111.822; 90
1768.8Sadikhova, Nurlana D.; Akkurt, Mehmet; Ismayilov, Valeh M.; Yusubov, Niftali N.; Hasanov, Khudayar I.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 3,3′-[ethane-1,2-diylbis(oxy)]bis(5,5-dimethylcyclohex-2-en-1-one) including an unknown solvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023132 CIF
Paper
C28 H44 Li N3 O2 Si2C 1 2/c 115.612; 12.7649; 17.18
90; 116.243; 90
3070.8Carneiro Neto, José Severiano; Iwaya, Eduardo Mariano; Santana, Francielli Sousa; Soares, Jaísa Fernandes
Crystal structure of a three-coordinate lithium complex with monodentate phenyloxazoline and hexamethyldisilylamide ligands
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023133 CIF
Paper
C10 H10 Cl I3 N2 S2P 1 21/c 112.9631; 11.3802; 13.1675
90; 117.624; 90
1721.1Podda, Enrico; Aragoni, M. Carla; Caltagirone, Claudia; De Filippo, Greta; Garau, Alessandra; Lippolis, Vito; Mancini, Annalisa; Pintus, Anna; Orton, James B.; Coles, Simon J.; Arca, Massimiliano
Crystal structure of 4,4′-(disulfanediyl)dipyridinium chloride triiodide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023134 CIF
Paper
C22 H21 N O5.47 PtP 1 21/c 113.151; 8.5584; 18.2071
90; 105.714; 90
1972.65Chi, Nguyen Thi Thanh; Van Thong, Pham; Thang, Nguyen Manh; Thao, Pham Ngoc; Van Meervelt, Luc
Synthesis and crystal structures of three organoplatinum(II) complexes bearing natural arylolefin and quinoline derivatives
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023135 CIF
Paper
C25 H25 N O6 PtP 1 21/n 18.2857; 18.5001; 14.6282
90; 102.014; 90
2193.19Chi, Nguyen Thi Thanh; Van Thong, Pham; Thang, Nguyen Manh; Thao, Pham Ngoc; Van Meervelt, Luc
Synthesis and crystal structures of three organoplatinum(II) complexes bearing natural arylolefin and quinoline derivatives
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023136 CIF
Paper
C24 H26 Cl N O4 PtP 1 21/c 114.576; 11.0945; 15.7
90; 117.197; 90
2258.2Chi, Nguyen Thi Thanh; Van Thong, Pham; Thang, Nguyen Manh; Thao, Pham Ngoc; Van Meervelt, Luc
Synthesis and crystal structures of three organoplatinum(II) complexes bearing natural arylolefin and quinoline derivatives
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023137 CIF
Paper
C16 H18 N2P n a 218.8641; 22.0075; 6.2771
90; 90; 90
1224.52Valdez, Nichole; Nagel, Eric; Redline, Erica; Rodriguez, Mark; Staiger, Chad; Dugger, Jason; Foster, Jeffrey
Synthesis and crystal structure of 2,9-diamino-5,6,11,12-tetrahydrodibenzo[a,e]cyclooctene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023138 CIF
Paper
C13 H12 Cd2 Cl4 N2P -16.8597; 10.8855; 12.8106
107.566; 100.523; 106.799
834.02Theppitak, Chatphorn; Laksee, Sakchai; Chainok, Kittipong
Synthesis, crystal structure and properties of poly[di-μ3-chlorido-di-μ2-chlorido-bis[4-methyl-N-(pyridin-2-ylmethylidene)aniline]dicadmium(II)]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023139 CIF
Paper
C72 H61.81 Ca0.1 F12 N8 O16 S4P 1 21/c 110.4506; 15.6166; 22.3537
90; 90.417; 90
3648.1Salomón-Flores, María K.; Valdes-García, Josue; Martínez-Otero, Diego; Dorazco-González, Alejandro
Trifluoromethanesulfonate salt of 5,10,15,20-tetrakis(1-benzylpyridin-1-ium-4-yl)-21H,23H-porphyrin and its CaII complex
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023140 CIF
Paper
C19 H17 N O5 SP 15.526; 8.5012; 10.1076
110.91; 98.128; 96.006
432.885Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynov, Elnur Z.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of dimethyl 2-oxo-4-(pyridin-2-yl)-6-(thiophen-2-yl)cyclohex-3-ene-1,3-dicarboxylate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023141 CIF
Paper
C46 H32 N4 Ni O2P -114.1382; 15.3202; 18.3835
72.09; 69.6031; 74.6737
3495.8Sharma, Meenakshi; Brückner, Christian; Zeller, Matthias
Crystal structure of (6,9-diacetyl-5,10,15,20-tetraphenylsecochlorinato)nickel(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023142 CIF
Paper
C15 H10 Br N3 O S2P 1 21/n 113.5009; 6.413; 17.9147
90; 103.606; 90
1507.55Sow, Salif; Thiam, Mariama; Odame, Felix; Thiam, Elhadj Ibrahima; Diouf, Ousmane; Ellena, Javier; Gaye, Mohamed; Tshentu, Zenixole
Crystal structure of 1-(1,3-benzothiazol-2-yl)-3-(4-bromobenzoyl)thiourea
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 663-666
2023143 CIF
Paper
Cs19 H42 Na5 O105 W24R -3 :H18.0071; 18.0071; 62.9142
90; 90; 120
17667.2Deblonde, Gauthier; Colliard, Ian
Synthesis and structural characterization of a hydrated sodium–caesium tetracosatungstate(VI), Na5Cs19[W24O84]·21H2O
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 667-670
2023144 CIF
Paper
C13 H12 O5C 1 2/c 18.2188; 13.8709; 20.837
90; 96.062; 90
2362.2Goyal, Navneet; Donahue, James P.; Thompson, Anthony; Zhang, Xiaodong; Mague, Joel T.; Foroozesh, Maryam
Ethyl 2-[(2-oxo-2H-chromen-6-yl)oxy]acetate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 659-662
2023145 CIF
Paper
C26 H28 Co N6 S2P 1 21/c 119.0089; 9.7403; 16.7516
90; 113.37; 90
2847.15Näther, Christian; Jochim, Aleksej
Synthesis, crystal structure and thermal properties of a new polymorphic modification of diisothiocyanatotetrakis(4-methylpyridine)cobalt(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 677-681
2023146 CIF
Paper
C16 H14 Br N O2 SP 1 21/c 17.979; 11.1; 17.54
90; 99.04; 90
1534Madhan, S.; NizamMohideen, M.; Harikrishnan, K.; MohanaKrishnan, Arasambattu K.
The crystal structures and Hirshfeld surface analysis of three new bromo-substituted 3-methyl-1-(phenylsulfonyl)-1H-indole derivatives
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 682-690
2023147 CIF
Paper
C24 H20 Br N O3 SP 1 21/c 18.4252; 28.669; 8.9462
90; 95.445; 90
2151.1Madhan, S.; NizamMohideen, M.; Harikrishnan, K.; MohanaKrishnan, Arasambattu K.
The crystal structures and Hirshfeld surface analysis of three new bromo-substituted 3-methyl-1-(phenylsulfonyl)-1H-indole derivatives
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 682-690
2023148 CIF
Paper
C23 H18 Br N O2 SP 1 21/n 112.553; 8.3533; 19.7698
90; 107.078; 90
1981.6Madhan, S.; NizamMohideen, M.; Harikrishnan, K.; MohanaKrishnan, Arasambattu K.
The crystal structures and Hirshfeld surface analysis of three new bromo-substituted 3-methyl-1-(phenylsulfonyl)-1H-indole derivatives
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 682-690
2023149 CIF
Paper
C26 H51 B Fe3 Mo N17 S3 SiP -110.689; 11.321; 19.03
75.306; 84.362; 86.829
2216Li, Yue; Wei, Jia; Han, Jie; Chen, Xu-Dong
Synthesis and crystal structure of the cluster (Et4N)[(Tp*)MoFe3S3(μ3-NSiMe3)(N3)3]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 691-694
2023150 CIF
Paper
C98 H90 N10 O8P -118.6922; 18.7278; 24.4009
89.992; 70.083; 85.978
8008.6Pinalli, Roberta; Massera, Chiara
Structural characterization of the supramolecular complex between a tetraquinoxaline-based cavitand and benzonitrile
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 671-676
2023151 CIFC11 H8 N3 O5 ZnC 1 2/c 135.421; 9.928; 7.1277
90; 95.396; 90
2495.4Farahmand Kateshali, Arash; Soleimannejad, Janet; Janczak, Jan
Ultrasound-assisted synthesis of a Eu3±functionalized ZnII coordination polymer as a fluorescent dual detection probe for highly sensitive recognition of HgII and L-Cys
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2024, 80, 208-218
2023152 CIF
Paper
C14 H14 B F4 N2 O4.5P 1 21/n 17.6794; 20.987; 10.0514
90; 95.123; 90
1613.5Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro
Crystal structures of 1,1'-bis-(carb-oxy-meth-yl)-4,4'-bipyridinium derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 695-698
2023153 CIF
Paper
C14 H20 N2 O8P 1 21/n 16.2521; 11.4122; 11.1413
90; 99.4832; 90
784.07Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro
Crystal structures of 1,1'-bis-(carb-oxy-meth-yl)-4,4'-bipyridinium derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 695-698
2023154 CIF
Paper
C17 H12 N2 O S2P 1 21/n 19.22549; 20.8037; 15.87594
90; 92.7309; 90
3043.52Yennawar, Hemant P.; Mal, Tapas K.; Olsen, Mark A.; Lagalante, Anthony F.; Louca, Evelyn M.; Gavalis, Aloura D.; Silverberg, Lee J.
Synthesis and crystal structures of two racemic 2-heteroaryl-3-phenyl-2,3-di-hydro-4<i>H</i>-pyrido[3,2-<i>e</i>][1,3]thia-zin-4-ones.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 699-703
2023155 CIFC21 H15.438 N3 O1.44 SC 1 2/c 128.2424; 11.0307; 28.6936
90; 111.952; 90
8290.9Yennawar, Hemant P.; Mal, Tapas K.; Olsen, Mark A.; Lagalante, Anthony F.; Louca, Evelyn M.; Gavalis, Aloura D.; Silverberg, Lee J.
Synthesis and crystal structures of two racemic 2-heteroaryl-3-phenyl-2,3-di-hydro-4<i>H</i>-pyrido[3,2-<i>e</i>][1,3]thia-zin-4-ones.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 699-703
2023156 CIF
Paper
C26 H28 Co N6 O4 Se2P 1 21/n 19.3825; 39.9164; 15.992
90; 104.217; 90
5805.82Näther, Christian; Jess, Inke
Syntheses and crystal structures of the five- and sixfold coordinated complexes diiso-seleno-cyanato-tris-(2-methyl-pyridine <i>N</i>-oxide)cobalt(II) and diiso-seleno-cyanato-tetra-kis-(2-methyl-pyridine <i>N</i>-oxide)cobalt(II).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 704-708
2023157 CIF
Paper
C20 H21 Co N5 O3 Se2C 1 c 112.07686; 26.47661; 7.25623
90; 104.276; 90
2248.56Näther, Christian; Jess, Inke
Syntheses and crystal structures of the five- and sixfold coordinated complexes diiso-seleno-cyanato-tris-(2-methyl-pyridine <i>N</i>-oxide)cobalt(II) and diiso-seleno-cyanato-tetra-kis-(2-methyl-pyridine <i>N</i>-oxide)cobalt(II).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 704-708
2023158 CIF
Paper
C12 H14 Cl4 Co N2P -16.6419; 7.6512; 15.837
99.458; 98.02; 97.046
777.3Jagadeesan, Sivaraman; Robert, Swinton Darious; Venkatesan, Perumal; Sundararaj, Rajamanikandan; Soundararajan, Krishnan; Nithianantham, Jeeva Jasmine
Crystal structure and Hirshfeld surface analysis of 6,6'-dimethyl-2,2'-bi-pyridine-1,1'-diium tetra-chlorido-cobaltate(II).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 709-712
2023159 CIF
Paper
C36 H42 Co N9 O9 S3P -316.6906; 16.6906; 9.1346
90; 90; 120
2203.76Roecker, Lee; Parkin, Sean
Crystal structure of tris-{<i>N</i>,<i>N</i>-diethyl-<i>N</i>'-[(4-nitro-phen-yl)(oxo)meth-yl]carbamimido-thio-ato}cobalt(III).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 713-716
2023160 CIF
Paper
C33 H10 F12 Hg3 O2P 1 21/n 112.4181; 13.8092; 17.6498
90; 93.36; 90
3021.5Novikov, Egor M.; Castañeda, Raúl; Fonari, Marina S.; Timofeeva, Tatiana V.
A 1:1 flavone cocrystal with cyclic trimeric perfluoro-<i>o</i>-phenyl-enemercury.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 717-720
2023161 CIF
Paper
C7 H14 N2 O3 SP 1 21 16.2517; 5.4935; 14.5686
90; 91.147; 90
500.24Babu, Sainath; Fronczek, Frank R.; Uppu, Rao M.; Claville, Michelle O.
Crystal structures of the isomeric dipeptides l-glycyl-l-me-thio-nine and l-me-thionyl-l-glycine.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 725-728
2023162 CIF
Paper
C7 H14 N2 O3 SP 21 21 215.2521; 11.4126; 16.5403
90; 90; 90
991.43Babu, Sainath; Fronczek, Frank R.; Uppu, Rao M.; Claville, Michelle O.
Crystal structures of the isomeric dipeptides l-glycyl-l-me-thio-nine and l-me-thionyl-l-glycine.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 725-728
2023163 CIF
Paper
Cl30 Cs36 O160 P4 Tl2 W48F m -3 m22.9963; 22.9963; 22.9963
90; 90; 90
12161.1Deblonde, Gauthier; Colliard, Ian
Crystal structure of hexa-chloro-thallate within a caesium chloride-phospho-tungstate lattice Cs<sub>9</sub>(TlCl<sub>6</sub>)(PW<sub>12</sub>O<sub>40</sub>)<sub>2</sub>·9CsCl.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 721-724
2023164 CIF
Paper
C20 H22 N3 O5 Re SP 1 21/c 118.5651; 7.6604; 15.4897
90; 95.472; 90
2192.8Kaluthanthiri, Dinithi; Perera, Theshini; Fronczek, Frank R.
Synthesis, spectroscopic analysis and crystal structure of (<i>N</i>-{2-[(2-amino-eth-yl)amino]-eth-yl}-4'-methyl-[1,1'-biphenyl]-4-sulfonamidato)tri-carb-on-ylrhenium(I).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 742-745
2023165 CIF
Paper
C14 H16 N6 O6 V2P 1 21/c 14.8817; 16.8263; 22.4354
90; 90.675; 90
1842.74Jabborova, Kholida; Ashurov, Jamshid; Tojiboev, Akmaljon; Daminova, Shahlo
Synthesis and crystal structure of bis-(2-aminobenzimidazolium) <i>catena</i>-[metavanadate(V)].
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 751-754
2023166 CIF
Paper
C28.5 H23 B Cl F4 Fe O4 PP -19.9343; 10.9767; 26.4168
86.993; 82.468; 77.3
2785.09Wong, Kelsey C.; Reinheimer, Eric W.; Nataro, Chip; Griffith, Daniel R.
Crystal structure of tricarbon-yl[η<sup>4</sup>-6-<i>exo</i>-(tri-phenyl-phosphino)cyclo-hepta-2,4-dien-1-one]iron(0) tetra-fluoro-borate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 746-750
2023167 CIF
Paper
C12 H14 Au2 Br2 N2C 1 2/c 116.3717; 6.3844; 16.185
90; 116.649; 90
1512Döring, Cindy; Jones, Peter G.
Crystal structures of four gold(I) complexes [Au<i>L</i> <sub>2</sub>]<sup>+</sup>[Au<i>X</i> <sub>2</sub>]<sup>-</sup> and a by-product (<i>L</i>·<i>L</i>H<sup>+</sup>)[AuBr<sub>2</sub>]<sup>-</sup> (<i>L</i> = substituted pyridine, <i>X</i> = Cl or Br).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 729-737
2023168 CIF
Paper
C12 H14 Au2 Br2 N2C 1 2/m 116.738; 6.44097; 8.1923
90; 120.415; 90
761.66Döring, Cindy; Jones, Peter G.
Crystal structures of four gold(I) complexes [Au<i>L</i> <sub>2</sub>]<sup>+</sup>[Au<i>X</i> <sub>2</sub>]<sup>-</sup> and a by-product (<i>L</i>·<i>L</i>H<sup>+</sup>)[AuBr<sub>2</sub>]<sup>-</sup> (<i>L</i> = substituted pyridine, <i>X</i> = Cl or Br).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 729-737
2023169 CIF
Paper
C14 H18 Au2 Cl2 N2P -16.7718; 8.5627; 15.1064
105.356; 90.788; 96.311
838.71Döring, Cindy; Jones, Peter G.
Crystal structures of four gold(I) complexes [Au<i>L</i> <sub>2</sub>]<sup>+</sup>[Au<i>X</i> <sub>2</sub>]<sup>-</sup> and a by-product (<i>L</i>·<i>L</i>H<sup>+</sup>)[AuBr<sub>2</sub>]<sup>-</sup> (<i>L</i> = substituted pyridine, <i>X</i> = Cl or Br).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 729-737
2023170 CIF
Paper
C14 H18 Au2 Br2 N2P -16.8343; 8.6676; 15.4049
105.72; 90.741; 98.242
868.05Döring, Cindy; Jones, Peter G.
Crystal structures of four gold(I) complexes [Au<i>L</i> <sub>2</sub>]<sup>+</sup>[Au<i>X</i> <sub>2</sub>]<sup>-</sup> and a by-product (<i>L</i>·<i>L</i>H<sup>+</sup>)[AuBr<sub>2</sub>]<sup>-</sup> (<i>L</i> = substituted pyridine, <i>X</i> = Cl or Br).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 729-737
2023171 CIF
Paper
C10 H9 Au Br4 N2P -17.9931; 8.4672; 11.3923
87.202; 74.635; 81.406
735.08Döring, Cindy; Jones, Peter G.
Crystal structures of four gold(I) complexes [Au<i>L</i> <sub>2</sub>]<sup>+</sup>[Au<i>X</i> <sub>2</sub>]<sup>-</sup> and a by-product (<i>L</i>·<i>L</i>H<sup>+</sup>)[AuBr<sub>2</sub>]<sup>-</sup> (<i>L</i> = substituted pyridine, <i>X</i> = Cl or Br).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 729-737
2023172 CIF
Paper
C8 H11 P SP 1 21/n 16.2805; 7.6549; 19.3578
90; 99.372; 90
918.23Risken, Robin; Kuzu, Yasin Mehmet; Schmidt, Annika; Strohmann, Carsten
Crystal structure and Hirshfeld surface analysis of dimeth-yl(phen-yl)phosphine sulfide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 755-758
2023173 CIF
Paper
C2 H7 Br2 NP 1 21/c 17.8966; 8.3394; 9.0089
90; 100.546; 90
583.24Semenikhin, Oleksandr A.; Shova, Sergiu; Golenya, Irina A.; Naumova, Dina D.; Gural'skiy, Il'ya A.
Crystal structure and Hirshfeld surface analysis of 2-bromo-ethyl-ammonium bromide - a possible side product upon synthesis of hybrid perovskites.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 738-741
2023174 CIF
Paper
C13 H19 N O7P 21 21 217.0695; 7.4842; 26.9573
90; 90; 90
1426.3Seidel, Rüdiger W; Kolev, Tsonko M.
Crystal structure of 1,2,3,4-tetra-hydro-isoquinolin-2-ium (2<i>S</i>,3<i>S</i>)-3-carb-oxy-2,3-di-hydroxy-propano-ate monohydrate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 763-766
2023175 CIF
Paper
C14 H14 O4P 1 21/c 19.57455; 9.2966; 14.5761
90; 100.952; 90
1273.8Bationo, Valentin; Kambo, Konan René; Sombié, Charles Bavouma; Semdé, Rasmané; Francotte, Pierre; Djandé, Abdoulaye
Synthesis, structure and Hirshfeld surface analysis of 2-oxo-2<i>H</i>-chromen-4-yl penta-noate.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 767-770
2023176 CIF
Paper
C11 H9 F2 I N SP 1 21/c 111.184; 5.2951; 20.544
90; 96.137; 90
1209.7Risken, Robin; Schrimpf, Tobias; Klotz, Franziska Dorothea; Strohmann, Carsten
Crystal structure and Hirshfeld surface analysis of a halogen bond between 2-(allyl-thio)-pyridine and 1,2,4,5-tetra-fluoro-3,6-di-iodo-benzene.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 759-762
2023177 CIF
Paper
C14 H14 N4 Ni S2C 1 2/c 120.0352; 9.1536; 19.2268
90; 116.783; 90
3147.8Näther, Christian; Mangelsen, Sebastian
Synthesis, crystal structure and thermal properties of <i>catena</i>-poly[[bis-(4-methyl-pyridine)-nickel(II)]-di-μ-thio-cyanato], which shows an alternating all-<i>trans</i> and <i>cis-cis</i>-<i>trans</i>-coordination of the NiS<sub>2</sub>N<sup>p</sup> <sub>2</sub>N<sup>t</sup> <sub>2</sub> octa-hedra (p = 4-methyl-pyridine, t = thio-cyanate).
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 771-776
2023178 CIF
Paper
C13 H12 N4 SP 1 21/c 112.4617; 7.0766; 13.65
90; 96.085; 90
1196.96Mustaphi, Nour El Hoda; Chlouchi, Amina; El Hafi, Mohamed; Mague, Joel T.; Hökelek, Tuncer; El Monfalouti, Hanae; Haoudi, Amal; Mazzah, Ahmed
Crystal structure determination and analyses of Hirshfeld surface, crystal voids, inter-molecular inter-action energies and energy frameworks of 1-benzyl-4-(methyl-sulfan-yl)-3a,7a-di-hydro-1<i>H</i>-pyrazolo-[3,4-<i>d</i>]pyrimidine.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 783-788
2023179 CIF
Paper
C19 H18 Br F N2 OP 1 21/n 19.2092; 9.0576; 20.4085
90; 101.518; 90
1668.06Pronina, Anastasia A.; Podrezova, Alexandra G.; Grigoriev, Mikhail S.; Hasanov, Khudayar I.; Sadikhova, Nurlana D.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 1-[6-bromo-2-(4-fluoro-phen-yl)-1,2,3,4-tetra-hydroquinolin-4-yl]pyrrolidin-2-one.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 777-782
2023180 CIF
Paper
C36 H65.11 N27 O35.56 PrP 1 21/n 124.1937; 17.01202; 28.6422
90; 90.5965; 90
11788Fedorenko, George V.; Zbruyev, Oleksandr I.; Pavlishchuk, Anna V.; Oleksenko, Lyudmila P.; Shova, Sergiu G.; Chebanov, Valentyn A.; Pavlishchuk, Vitaly V.
The crystal structure of a mononuclear Pr<sup>III</sup> complex with cucurbit[6]uril.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 789-794
2023181 CIF
Paper
C48 H48 Cl4 Mn2 N6 OP -18.7491; 13.2133; 21.3793
88.914; 82.29; 88.989
2448.48Le Thi Hong, Hai; Hoang Tuan, Duong; Nguyen Duc, Anh; Nguyen, Hien; Van Meervelt, Luc
Synthesis, crystal structure and photophysical properties of a dinuclear Mn<sup>II</sup> complex with 6-(di-ethyl-amino)-4-phenyl-2-(pyridin-2-yl)quinoline.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 795-799
2023182 CIF
Paper
C10 H10 N2P 1 21 15.6651; 5.7566; 13.2321
90; 101.732; 90
422.51Hayward, Emily R.; Zeller, Matthias; Mezei, Gellert
Chiral <i>versus</i> achiral crystal structures of 4-benzyl-1<i>H</i>-pyrazole and its 3,5-di-amino derivative.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 800-805
2023183 CIFC10 H12 N4P 1 21/c 117.41; 4.7271; 11.4664
90; 98.247; 90
933.9Hayward, Emily R.; Zeller, Matthias; Mezei, Gellert
Chiral <i>versus</i> achiral crystal structures of 4-benzyl-1<i>H</i>-pyrazole and its 3,5-di-amino derivative.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 800-805
2023184 CIF
Paper
C7 H6 Cl N3 O4 S2P 1 21 14.8296; 6.2703; 16.9551
90; 92.214; 90
513.069Brydson, Rowan K. H.; Kennedy, Alan R.
A monoclinic polymorph of chloro-thia-zide.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 806-810
2023185 CIF
Paper
C70 H100 Cr2 N4 O10P -110.6402; 11.773; 15.1884
82.353; 86.526; 69.248
1763.2Heiser, Christian; Merzweiler, Kurt
Two chromium(II) acetate complexes with N-heterocyclic carbene (NHC) coligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 811-815
2023186 CIFC50 H60 Cr2 N4 O8P -18.3679; 11.6127; 13.8355
68.949; 83.891; 71.508
1189.9Heiser, Christian; Merzweiler, Kurt
Two chromium(II) acetate complexes with N-heterocyclic carbene (NHC) coligands.
Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 811-815
2023187 CIF
Paper
C28 H26 N14 O18 ThP 1 21/n 114.5386; 9.3464; 15.4213
90; 117.846; 90
1852.86Rangarajan, Shalini; Sheokand, Sonu; Blair, Victoria L.; Deacon, Glen B.; Balakrishna, Maravanji S.
Synthesis, structural studies and Hirshfeld surface analysis of 2-[(4-phenyl-1H-1,2,3-triazol-1-yl)methyl]pyridin-1-ium hexakis(nitrato-κ2 O,O′)thorate(IV)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023188 CIF
Paper
C6 H10 Cd I2 N6P -15.1007; 6.9544; 9.047
83.198; 79.962; 81.742
311.289Kuzevanova, Iryna S.; Vynohradov, Oleksandr S.; Pavlenko, Vadim A.; Malinkin, Sergey O.; Shova, Sergiu; Fritsky, Igor O.; Seredyuk, Maksym
Crystal structure of polymeric bis(3-amino-1H-pyrazole)cadmium diiodide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023189 CIF
Paper
Bi F5I 4/m6.4439; 6.4439; 4.226
90; 90; 90
175.48Wassermann, Tobias Burghardt; Kraus, Florian
Rerefinement of the crystal structure of BiF5
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023190 CIF
Paper
C23 H27 N5 O4 SP 1 c 18.00032; 15.14469; 18.9141
90; 100.605; 90
2252.53Isobe, Mami; Kashiwagi, Yukiyasu; Kubono, Koji
Crystal structure of the 1:1 co-crystal 4-(dimethylamino)pyridin-1-ium 8-hydroxyquinoline-5-sulfonate–N,N-dimethylpyridin-4-amine
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023191 CIF
Paper
C22 H25 N3 O9 SP 21 21 217.11266; 13.765; 24.385
90; 90; 90
2387.43Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of four thioglycosides involving carbamimidothioate groups
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023192 CIF
Paper
C22 H25 N3 O9 SP 21 21 2110.10503; 14.5978; 16.4256
90; 90; 90
2422.96Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of four thioglycosides involving carbamimidothioate groups
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023193 CIF
Paper
C17 H23 N3 O9 SP 21 21 217.34295; 13.92258; 21.07464
90; 90; 90
2154.52Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of four thioglycosides involving carbamimidothioate groups
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023194 CIF
Paper
C23 H27 N3 O9 SP 21 21 217.42044; 14.9634; 22.758
90; 90; 90
2526.93Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of four thioglycosides involving carbamimidothioate groups
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023195 CIF
Paper
C23 H27 N3 O9 SP 21 21 217.41967; 14.96519; 22.75622
90; 90; 90
2526.78Abu-Zaied, Mamdouh A.; Nawwar, Galal A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of four thioglycosides involving carbamimidothioate groups
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023196 CIF
Paper
C24 H22 N2 O4 SP 1 21/c 113.6698; 19.781; 8.1056
90; 99.388; 90
2162.4Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.
The crystal structure determination and Hirshfeld surface analysis of N-acetyl-N-3-methoxyphenyl and N-phenylsulfonyl-N-(2,5-dimethoxyphenyl) derivatives of [1-(phenylsulfonyl)-1H-indol-2-yl]methanamine
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023197 CIF
Paper
C29 H26 N2 O6 S2C 1 c 113.463; 17.193; 11.532
90; 94.844; 90
2660Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.
The crystal structure determination and Hirshfeld surface analysis of N-acetyl-N-3-methoxyphenyl and N-phenylsulfonyl-N-(2,5-dimethoxyphenyl) derivatives of [1-(phenylsulfonyl)-1H-indol-2-yl]methanamine
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023198 CIF
Paper
C11 H11 N3 O6 UP b c a10.9966; 13.7147; 17.9345
90; 90; 90
2704.8Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Stoica, Alexandru-Constantin; Vassilyeva, Olga Yu.; Lampeka, Rostyslav D.
Crystal structure of catena-poly[[methanoldioxidouranium(VI)]-μ-2-[5-(2-oxidophenyl)-1H-1,2,4-triazol-3-yl]acetato-κ2 O:O′]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023199 CIF
Paper
C21 H12 Br4 O4P -13.8875; 9.3118; 14.7772
104.228; 93.211; 98.219
510.87Weeks, Nathan J.; Lauer, Moira K.; Balaich, Gary J.; Iacono, Scott T.
Crystal and molecular structure of 2-methyl-1,4-phenylene bis(3,5-dibromobenzoate)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023200 CIF
Paper
C61 H98 F2 O7P 1 21 112.4983; 7.17223; 60.3774
90; 94.1762; 90
5397.9Eadsforth, Megan A.; Kong, Linghan; Whitehead, George; Vitórica-Yrezábal, Iñigo J.; O'Keefe, Raymond T.; Bryce, Richard A.; Whitehead, Roger C.
Structural determination of oleanane-28,13β-olide and taraxerane-28,14β-olide fluorolactonization products from the reaction of oleanolic acid with SelectfluorTM
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023201 CIF
Paper
C61 H98 F2 O7C 2 2 216.6077; 13.873; 59.326
90; 90; 90
5438.3Eadsforth, Megan A.; Kong, Linghan; Whitehead, George; Vitórica-Yrezábal, Iñigo J.; O'Keefe, Raymond T.; Bryce, Richard A.; Whitehead, Roger C.
Structural determination of oleanane-28,13β-olide and taraxerane-28,14β-olide fluorolactonization products from the reaction of oleanolic acid with SelectfluorTM
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023202 CIF
Paper
C20 H26 O2P 21 21 218.396; 20.248; 8.9338
90; 90; 90
3327.7Tonga Lembe, Jordan; Mphahlele, Precious Mokgadi; Kamdem Kengne, Michael Hermann; Jiyane, Pangaman; Djuidje Fotsing, Marthe Carine; Ardene, Charmaine; Mmutlane, Edwin Mpho; Ndinteh, Derek Tantoh
Crystal structure of Staudtienic acid, a diterpenoid from Staudtia kamerunensis Warb. (Myristicaceae)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023203 CIF
Paper
C7 H4 F2 N2P 1 21/n 13.7283; 10.5275; 16.9073
90; 94.604; 90
661.46Novikov, Egor M.; Guillen Campos, Jesus; Read de Alaniz, Javier; Fonari, Marina S.; Timofeeva, Tatiana V.
Synthesis, molecular and crystal structures of 4-amino-3,5-difluorobenzonitrile, ethyl 4-amino-3,5-difluorobenzoate, and diethyl 4,4′-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023204 CIF
Paper
C9 H9 F2 N O2P b c n14.877; 8.9995; 13.635
90; 90; 90
1825.5Novikov, Egor M.; Guillen Campos, Jesus; Read de Alaniz, Javier; Fonari, Marina S.; Timofeeva, Tatiana V.
Synthesis, molecular and crystal structures of 4-amino-3,5-difluorobenzonitrile, ethyl 4-amino-3,5-difluorobenzoate, and diethyl 4,4′-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023205 CIF
Paper
C18 H14 F4 N2 O4P -14.6106; 8.839; 10.969
99.33; 99.431; 96.442
430.7Novikov, Egor M.; Guillen Campos, Jesus; Read de Alaniz, Javier; Fonari, Marina S.; Timofeeva, Tatiana V.
Synthesis, molecular and crystal structures of 4-amino-3,5-difluorobenzonitrile, ethyl 4-amino-3,5-difluorobenzoate, and diethyl 4,4′-(diazene-1,2-diyl)bis(3,5-difluorobenzoate)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023206 CIF
Paper
C11 H11 Br O3P n a 217.0928; 14.3933; 10.0419
90; 90; 90
1025.17Galla, Sri Hari; Sridhar, Jayalakshmi; Mague, Joel T.; Zhang, Xiaodong; White, Kira D.; Zhang, Qiang; Donahue, James P.
Crystal structure of 4-bromo-5,7-dimethoxy-2,3-dihydro-1H-inden-1-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023207 CIF
Paper
C4 H22 Br8 N8 O3 Ru S4C m c m11.6462; 13.9943; 16.9225
90; 90; 90
2758.04Rudnitskaya, Olga V.; Komarovskikh, Milena R.; Pekarskaya, Maria G.; Pshenichnyy, Daniil S.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, Ibrahim G.
Synthesis, molecular and crystal structure of [(NH2)2CSSC(NH2)2]2[RuBr6]Br2·3H2O
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023208 CIF
Paper
C24 H26 Mo2 O6P 1 21/c 112.1857; 8.0515; 12.6153
90; 105.49; 90
1192.77Ibrahimova, Nigar Z.; Tagiyev, Dilgam B.; Lyatifov, Iltifat U.; Akkurt, Mehmet; Hasanov, Khudayar I.; Bhattarai, Ajaya
Crystal structure of bis[(η5-tert-butylcyclopentadienyl)tricarbonylmolybdenum(I)](Mo—Mo)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023209 CIF
HKL
Paper
C17 H18 N6P 1 21 18.711; 19.5857; 18.9372
90; 90.857; 90
3230.53Peng, Ziyu; Ye, Long
Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2023210 CIF
HKL
Paper
C17 H22 N6 O2P 21 21 219.9563; 15.1596; 23.6491
90; 90; 90
3569.4Peng, Ziyu; Ye, Long
Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2023211 CIF
HKL
Paper
C17 H21 N6 O4 PP 21 21 217.1398; 12.0894; 43.818
90; 90; 90
3782.2Peng, Ziyu; Ye, Long
Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2023212 CIF
Paper
C141.78 H168.72 Cl8 Cu20 Ir6 N18 O3.18P -112.5708; 14.8757; 23.1383
84.392; 82.291; 85.686
4258.7Tickner, Ben. J.; Gammons, Richard; Whitwood, Adrian C.; Duckett, Simon B.
Pyrazine-bridged polymetallic copper–iridium clusters
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023213 CIF
Paper
C17 H13 Br N4 O5P 1 21/c 117.3468; 10.40583; 9.87841
90; 99.4243; 90
1759.06Hakimov, Muminjon; Khozhimatova, Shakhnoza; Ortikov, Ilkhomjon; Abdugafurov, Ibragimdjan; Tojiboev, Akmaljon
Synthesis, crystal structure and Hirshfeld surface analysis of [1-(4-bromophenyl)-1H-1,2,3-triazol-4-yl]methyl 2-(4-nitrophenoxy)acetate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 910-912
2023214 CIF
Paper
C6 H7 Au Cl3 NP 1 21/n 17.6852; 14.3992; 8.7963
90; 95.86; 90
968.32Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023215 CIF
Paper
C6 H7 Au Cl3 NP 1 21/c 17.8077; 16.4881; 7.6929
90; 103.92; 90
961.26Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023216 CIF
Paper
C6 H7 Au Br3 NP 1 21/n 18.0776; 14.723; 8.9682
90; 96.617; 90
1059.45Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023217 CIF
Paper
C6 H7 Au Br3 NC 1 2/c 118.6763; 6.78409; 18.4807
90; 118.887; 90
2050.19Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023218 CIF
Paper
C7 H9 Au Br3 NP 1 21/c 18.07477; 17.2853; 16.3527
90; 90.818; 90
2282.19Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023219 CIF
Paper
C7 H9 Au Cl3 NC 1 2/c 17.624; 15.936; 9.2538
90; 112.333; 90
1039.97Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023220 CIF
Paper
C7 H9 Au Br3 NP -18.2506; 8.4726; 9.421
113.828; 103.543; 98.368
563.93Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023221 CIF
Paper
C7 H9 Au Cl3 NC 1 2/c 111.0184; 10.66; 9.776
90; 113.053; 90
1056.56Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023222 CIF
Paper
C13 H16 Au2 Br6 N2P -19.1741; 11.1922; 11.4596
83.99; 80.777; 69.147
1083.91Döring, Cindy; Jones, Peter G.
Crystal structures of seven gold(III) complexes of the form LAuX 3 (L = substituted pyridine, X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 894-909
2023223 CIF
HKL
Paper
C36 H38.6 Cl2 Cu N8 O11.3P -18.8398; 9.9196; 12.8239
97.633; 93.948; 107.385
1056.59Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023224 CIF
HKL
C38 H40 Cl2 Cu N8 O10P -19.3557; 9.838; 13.0238
75.71; 89.649; 69.657
1084.99Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023225 CIF
HKL
C40 H44 Cl2 Cu N8 O10P -19.3377; 9.7888; 12.987
103.114; 90.344; 109.408
1086.13Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023226 CIF
HKL
C42 H48 Cl2 Cu N8 O10P -19.1329; 10.0787; 13.0825
103.496; 94.562; 105.229
1117.04Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023227 CIF
HKL
C44 H52 Cl2 Cu N8 O10P -19.4157; 9.9855; 13.6726
106.181; 96.455; 106.527
1157.64Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023228 CIF
HKL
C42 H46 Cl2 Cu N10 O10P -19.1544; 9.8343; 14.2557
91.493; 107.948; 109.075
1142.38Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023229 CIF
HKL
C42 H44 Cl2 Cu N8 O10P -19.4814; 9.7136; 13.3146
69.117; 80.66; 68.833
1067.61Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023230 CIF
HKL
C44 H48 Cl2 Cu N8 O10P 1 21/n 19.0943; 25.0287; 10.0253
90; 107.509; 90
2176.2Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023231 CIF
HKL
Paper
C44 H48 Cl2 Cu N8 O12P -19.3679; 10.2347; 12.5311
79.661; 84.578; 73.249
1130.6Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023232 CIF
HKL
Paper
C44 H48 Cl2 Cu N8 O12P -110.0363; 10.1867; 11.9902
83.078; 82.032; 70.015
1137.37Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023233 CIF
HKL
Paper
C40 H42 Cl2 Cu N8 O9P -18.6577; 9.8396; 12.82
97.084; 93.897; 108.096
1023.61Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios
Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 347-359
2023234 CIF
Paper
C12 H36 I12 N6 O12 Pb3P -18.5437; 11.2672; 14.8534
105.9; 92.647; 111.477
1262.4Tonoyan, Gayane S.; Giester, Gerald; Ghazaryan, Vahram V.; Chilingaryan, Ruben Yu.; Margaryan, Arthur A.; Mkrtchyan, Artak H.; Petrosyan, Aram M.
Crystal structure of hexaglycinium dodecaiodotriplumbate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023235 CIF
Paper
C20 H20 F8 N4 O2 Sn3P -17.4579; 8.4601; 9.8864
97.073; 98.474; 100.644
599.06Röwekamp-Krugley, Natalia; Reuter, Hans
[SnF(bipy)(H2O)]2[SnF6], a mixed-valent inorganic tin(II)–tin(IV) compound
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023236 CIF
Paper
C31 H28 O4P -19.0494; 10.0326; 14.6932
100.153; 107.292; 90.789
1250.6Jeyashri, K. R.; Logeshwari, G.; Rajapandiyan, U.; Sivakumar, K.; Selvanayagam, S.; Manikandan, H.; Kaviyarasu, K.
Synthesis and crystal structure of (2E)-1-[3,5-bis(benzyloxy)phenyl]-3-(4-ethoxyphenyl)prop-2-en-1-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023237 CIF
Paper
C15 H21 Cl2 N5 O PdP 1 21/c 19.3964; 20.2572; 9.9822
90; 96.358; 90
1888.4Dyakonenko, Viktoriya V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Ivanova, Ganna V.; Lampeka, Rostyslav D.
Crystal structure and Hirshfeld surface analysis of dichlorido[2-(3-cyclopentyl-1,2,4-triazol-5-yl-κN 4)pyridine-κN]palladium(II) dimethylformamide monosolvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023238 CIF
Paper
C32 H39 K O10 SnP 1 21 19.406; 19.3779; 9.4225
90; 97.925; 90
1701.02Song, Xueqing; Li, William; Torres, Yolanda; Greaves, Tazena
Crystal structure of (1,4,7,10,13,16-hexaoxacyclooctadecane-κ6 O)potassium-μ-oxalato-triphenylstannate(IV), the first reported 18-crown-6-stabilized potassium salt of triphenyloxalatostannate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023239 CIF
Paper
C26 H36 N2 O4P 1 21/n 112.5184; 9.1855; 22.1339
90; 105.133; 90
2456.87Stapf, Manuel; Miyyapuram, Venugopal Rao; Seichter, Wilhelm; Mazik, Monika
Synthesis and crystal structure of 1,3-bis(acetoxymethyl)-5-{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023240 CIF
Paper
C33 H29 Cl N2 O2P b c a9.229; 19.235; 30.058
90; 90; 90
5336Divyabharathi, Sivagnanam; Karthiga, Anjalai Ramachandran; Shalo, Rajans Reshwen; Rajeswari, Krishnan; Vidhyasagar, Thankakan; Selvanayagam, Sivashanmugam
Crystal structure, Hirshfeld surface analysis, DFT and the molecular docking studies of 3-(2-chloroacetyl)-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 981-985
2023241 CIF
Paper
C25 H52 N3 O12 P3P -110.02487; 11.92992; 16.6237
100.479; 100.124; 111.131
1759.25Wackerle, Brandon G.; Werner, Eric J.; Staples, Richard J.; Biros, Shannon M.
Crystal structure of a tris(2-aminoethyl)methane capped carbamoylmethylphosphine oxide compound
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 993-996
2023242 CIF
Paper
C6 H10 Ba N6 O7P m n 2113.6667; 4.4102; 11.2816
90; 90; 90
679.97Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Ponomarova, Vira V.; Lysenko, Andrey B.; Krautscheid, Harald
Three-dimensional alkaline earth metal–organic framework poly[[μ-aqua-aquabis(μ3-carbamoylcyanonitrosomethanido)barium] monohydrate] and its thermal decomposition
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 986-992
2023243 CIF
Paper
C19 H18 Br2 N2 OP 1 21/c 110.8691; 9.4578; 17.7217
90; 104.364; 90
1764.8Pronina, Anastasia A.; Kutasevich, Alexandra G.; Grigoriev, Mikhail S.; Hasanov, Khudayar I.; Sadikhova, Nurlana D.; Javadzade, Tahir A.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 1-[6-bromo-2-(3-bromophenyl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 967-972
2023244 CIF
Paper
C7 H16 N2 O6P 4 b m11.2716; 11.2716; 4.331
90; 90; 90
550.249Seidel, Rüdiger W.; Kolev, Tsonko M.
Crystal structure of propane-1,3-diaminium squarate dihydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 973-975
2023245 CIF
Paper
C12 H22 Cu2 N6 O14P 1 21/n 16.5176; 9.4854; 15.967
90; 93.035; 90
985.7Vynohradov, Oleksandr S.; Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Lampeka, Rostyslav D.; Stoica, Alexandru-Constantin
Synthesis, crystal structure and Hirshfeld surface analysis of a new copper(II) complex based on diethyl 2,2′-(4H-1,2,4-triazole-3,5-diyl)diacetate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 976-980
2023246 CIF
Paper
C14 H13 N3 O6 SP 1 21/c 121.03214; 8.61349; 16.69445
90; 102.555; 90
2952.05Mukhammadiev, Salmon; Rajabov, Sarvar; Tojiboev, Akmaljon; Ashurov, Jamshid; Murodov, Sardor; Daminova, Shahlo
Synthesis, crystal structure, and Hirshfeld surface analysis of 1,3-dihydro-2H-benzimidazol-2-iminium 3-carboxy-4-hydroxybenzenesulfonate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023247 CIF
Paper
C7 H8 N2 O3P 1 21/n 17.14981; 9.79512; 10.74206
90; 96.9437; 90
746.784Filley, Jonathan
Color center creation by dipole stacking in crystals of 2-methoxy-5-nitroaniline
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023248 CIF
Paper
C18 H15 Br3 N4P -16.2445; 13.2335; 13.4984
79.168; 88.671; 78.962
1075.2Yan, Ran; Dai, Zhaohua; Shlian, Daniel G.; Mitchell, Trinit'y D.; Loo, Aaron; Mulosmani, Kaltrina; Upmacis, Rita K.
Molecular structure of tris[(6-bromopyridin-2-yl)methyl]amine
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023249 CIF
Paper
C23 H24 N2 O2 SP -19.3404; 13.1888; 17.4549
79.515; 87.981; 88.516
2112.6Karthiga, A. R.; Divyabharathi, S.; Shalo, R. Reshwen; Rajeswari, K.; Vidhyasagar, T.; Selvanayagam, S.
Crystal structure, Hirshfeld surface analysis, DFT optimized molecular structure and the molecular docking studies of 1-[2-(cyanosulfanyl)acetyl]-3-methyl-2,6-bis(4-methylphenyl)piperidin-4-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023250 CIF
Paper
C27 H19 N O3P 1 21 19.4289; 9.6739; 11.4872
90; 97.668; 90
1038.43Harish Kumar, M.; Vinduvahini, M.; Devarajegowda, H. C.; Srinivasa, H. T.; Palakshamurthy, B. S.
Synthesis, crystal structure and Hirshfeld surface analysis of 4′-cyano-[1,1′-biphenyl]-4-yl 3-(benzyloxy)benzoate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023251 CIF
Paper
C20 H17 N O2 SP 1 21/c 113.732; 8.2475; 15.5387
90; 107.505; 90
1678.33Albert A. M., Dharani; Nagaraj, Achyuta; Somarathinam, Kanagasabai; Vinayagam, Pavunkumar; Arasambattu K., Mohanakrishnan; Kothandan, Gugan
Crystal structure and Hirshfeld surface analysis of (E)-N-(2-styrylphenyl)benzenesulfonamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023252 CIF
Paper
C12.35 H9.7 Cl1.7 N2 Se2P 1 21/c 111.087; 11.758; 11.991
90; 115.337; 90
1412.8Temesgen, Ayalew W.; Tskhovrebov, Alexander G.; Artemjev, Alexey A.; Kubasov, Alexey S.; Novikov, Alexander S.; Borisov, Alexander V.; Kirichuk, Anatoly A.; Kritchenkov, Andreii S.; Le, Tuan Anh
Coupling between 2-pyridylselenyl chloride and phenylselenocyanate: synthesis, crystal structure and non-covalent interactions
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023253 CIF
Paper
C36 H48 Cl4 In2 N2 O6P -110.297; 10.94; 11.711
63.57; 72.47; 62.92
1043.8Fuhrmann, Betty; Meier, Eric; Mazik, Monika
Crystal structure of bis(μ2-5-nonanoylquinolin-8-olato)bis[aquadichloridoindium(III)]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023254 CIF
Paper
C10 H13 Co N3 O2 S2P 1 21/c 111.67627; 11.61861; 10.60662
90; 107.593; 90
1371.61Näther, Christian; Jess, Inke
Synthesis and crystal structure of poly[ethanol(μ-4-methylpyridine N-oxide)di-μ-thiocyanato-cobalt(II)]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023255 CIF
Paper
C53 H61.18 Br0.82 N2 O10P 1 21/n 111.9686; 21.18; 20.107
90; 92.659; 90
5091.5Vinodh, Mickey; Al-Azemi, Talal F.
Crystal structure and supramolecular features of a host–guest inclusion complex based on A1/A2-hetero-difunctionalized pillar[5]arene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023256 CIF
Paper
C28 H30 O2P 1 21/c 111.3889; 15.6537; 12.5193
90; 99.92; 90
2198.6Coulibaly, Pénayori Marie-Aimée; Ziki, Eric; Bisseyou, Yvon Bibila Mayaya; Camara, Tchambaga Etienne; Coulibaly, Souleymane; Sissouma, Drissa
Synthesis, non-spherical structure refinement and Hirshfeld surface analysis of racemic 2,2′-diisobutoxy-1,1′-binaphthalene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023257 CIF
Paper
C7 H11 Cl Cu N2 O0.5P 1 21/c 17.0557; 14.5923; 17.4171
90; 92.253; 90
1791.9Näther, Christian; Jess, Inke
Synthesis and crystal structure of poly[[μ-chlorido-μ-(2,3-dimethylpyrazine)-copper(I)] ethanol hemisolvate], which shows a new isomeric CuCl(2,3-dimethylpyrazine) network
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023258 CIF
Paper
C24 H36 N14 O6 ZnP -319.1227; 19.1227; 7.477
90; 90; 120
2367.9Magwa, Nomampondo Penelope; Rashamuse, Thompho Jason
Synthesis, characterization, and crystal structure of hexakis(1-methyl-1H-imidazole-κN 3)zinc(II) dinitrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023259 CIF
Paper
C11 H17 N3 O8 S2P -15.8838; 11.6532; 12.3276
84.722; 78.442; 81.94
818.14Moroni, Aldana B.; Bottoso, Tiago; Lionello, Diego F.; Vega, Daniel R.; Kaufman, Teodoro S.; Calvo, Natalia L.
Synthesis, crystal structure and Hirshfeld surface analysis of sulfamethoxazolium methylsulfate monohydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023260 CIF
Paper
C18 H13 Cl3 N2 SnP 1 21/n 19.1085; 13.1958; 14.9869
90; 102.261; 90
1760.2Benlatreche, Tarek; Bensegueni, Mohamed Abdellatif; Dénès, Georges; Golhen, Stéphane; Merazig, Hocine
Crystal structure and Hirshfeld surface analysis of trichlorido(1,10-phenanthroline-κ2 N,N′)phenyltin(IV)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023261 CIF
Paper
C16 H17 Cl3 Cu N2 O7P -18.4699; 9.7818; 12.9026
77.238; 89.207; 78.038
1019.37Nazarov, Yusufjon Eshkobilovich; Turaev, Khayit Khudainazarovich; Suyunov, Jabbor Ruziboevich; Alimnazarov, Bekmurod Khurramovich; Rasulov, Abdusamat Abdujabborovich; Ibragimov, Bakhtiyar Tulyaganovich; Ashurov, Jamshid Mengnorovich
8-Hydroxyquinolinium trichlorido(pyridine-2,6-dicarboxylic acid-κ3 O,N,O′)copper(II) dihydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023262 CIF
Paper
C14 H16 Cd Cl N3 SP 1 21/c 112.8451; 7.4508; 15.9284
90; 96.965; 90
1513.2Reynolds, Todd M.; Berry, Steven M.; Bebout, Deborah C.
Crystal structure and Hirshfeld surface analysis of {2-[bis(pyridin-2-ylmethyl)amino]ethane-1-thiolato}chloridocadmium(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1081-1086
2023263 CIF
Paper
C19 H20 Cl N4 O2.5P -19.5599; 11.8056; 17.5322
94.808; 104.562; 95.408
1894.7Uppu, Rao M.; Chikkula, Krishnaveni; Saneei, Soheil; Babu, Sainath; Fronczek, Frank R.
Structure of 2,3,5-triphenyltetrazol-3-ium chloride hemipentahydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1097-1100
2023264 CIF
Paper
C18 H42 Au2 Cl4 P2 S2P 1 2/n 114.2552; 9.0574; 23.0043
90; 96.703; 90
2949.9Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023265 CIF
Paper
C20 H46 Au2 Cl4 P2 S2P -111.7607; 16.4174; 17.2173
79.931; 76.467; 78.015
3133.59Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023266 CIF
Paper
C24 H54 Au2 Cl4 P2 S2P -18.5541; 9.155; 12.0421
107.427; 97.511; 102.841
857.31Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023267 CIF
Paper
C20 H46 Au2 Br4 P2 S2P 1 21/c 113.7871; 10.4042; 22.724
90; 93.035; 90
3255.04Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023268 CIF
Paper
C20 H46 Au2 Br4 P2 Se2P 1 21/c 113.7265; 10.5615; 22.7782
90; 94.096; 90
3293.78Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023269 CIF
Paper
C24 H54 Au2 Br4 P2 S2P -18.4858; 9.3738; 11.991
105.533; 97.476; 99.318
891.63Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023270 CIF
Paper
C24 H54 Au2 Br4 P2 Se2P -18.4403; 9.2135; 12.6496
106.172; 101.1; 97.485
909.28Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Crystal structures of seven mixed-valence gold compounds of the form [(R 1 R 2 R 3PE)2AuI]+[AuIII X 4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1087-1096
2023271 CIF
Paper
C19 H25 N5 OP 1 21/c 15.782; 26.5057; 11.7704
90; 90.407; 90
1803.84El Atrassi, Zakaria; Benzekri, Zakaria; Blacque, Olivier; Hökelek, Tuncer; Mazzah, Ahmed; Cherkaoui, Hassan; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, and calculations of intermolecular interaction energies and energy frameworks of 1-[(1-hexyl-1H-1,2,3-triazol-4-yl)methyl]-3-(1-methylethenyl)-benzimidazol-2-one
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1075-1080
2023272 CIF
Paper
C66 H78 Cl3 Ir3 O6 P2P -113.15698; 13.5836; 17.547
88.5722; 87.003; 79.7149
3080.99Thackeray, Sachin; Mahoney, James; Arrington, Ashleigh; Wilklow-Marnell, Miles; Brennessel, William W.
Crystal structures of the (η2:η2-cycloocta-1,5-diene)(η6-toluene)iridium(I) cation and μ-chlorido-iridium(III) complexes of 2-(phosphinito)- and 2-(phosphinomethyl)anthraquinone ligands
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1101-1109
2023273 CIF
Paper
C48 H54 Cl2 Ir2 O6 P2P -18.8215; 12.1331; 14.4895
81.5747; 84.576; 76.465
1488.57Thackeray, Sachin; Mahoney, James; Arrington, Ashleigh; Wilklow-Marnell, Miles; Brennessel, William W.
Crystal structures of the (η2:η2-cycloocta-1,5-diene)(η6-toluene)iridium(I) cation and μ-chlorido-iridium(III) complexes of 2-(phosphinito)- and 2-(phosphinomethyl)anthraquinone ligands
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1101-1109
2023274 CIF
HKL
Paper
C11 H10 N4 O5P 1 21/n 13.6374; 11.3412; 26.751
90; 92.162; 90
1102.76Książkiewicz, Olga
A salt from biologically active compounds pyridine-2,3-dicarboxylic (quinolinic) acid and cytosine.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 742-747
2023275 CIF
Paper
C20 H49.6 Cl N8 O4.8 S4 Sb Zn2P 1 c 19.11238; 13.67434; 27.49214
90; 92.9206; 90
3421.23Näther, Christian; Lühmann, Henning; Bensch, Wolfgang
Synthesis, crystal structure and properties of μ-tetrathioantimonato-bis[(cyclam)zinc(II)] perchlorate 0.8-hydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1151-1156
2023276 CIF
Paper
C5 H19 Na O5 P S2P -16.7412; 8.2961; 11.8621
79.608; 89.207; 87.03
651.63Nell, Bryan P.; Tyler, David R.; Zakharov, Lev N.; Johnston, Dean H.
Synthesis and crystal structure of sodium (ethane-1,2-diyl)bis[(3-methoxypropyl)phosphinodithiolate] octahydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1138-1141
2023277 CIF
Paper
C28 H22 Br2 N2 O5 S2P 1 21/n 19.5718; 14.4498; 20.0041
90; 92.874; 90
2763.3Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.
The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1110-1117
2023278 CIF
Paper
C36 H27 Br2 N3 O6 S3P 1 21/n 18.2664; 34.7886; 12.5972
90; 104.55; 90
3506.5Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.
The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1110-1117
2023279 CIF
Paper
C19 H45 Hg I2 N5 O P2 Se2P 1 21/n 19.1747; 17.3698; 20.841
90; 101.049; 90
3259.7Selby-Karney, Troy; Sampath, Kalpana; Arumugam, Kuppuswamy; Chandrasekaran, Chandru P.
Mercury(II) halide complex of cis-[( t BuNH)(Se)P(μ-N t Bu)2P(Se)(NH t Bu)]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1142-1145
2023280 CIF
Paper
C25 H23 Br N2 O2P 1 21/c 19.4306; 8.5084; 26.7891
90; 93.27; 90
2146.04Lamssane, Houda; Haoudi, Amal; Kartah, Badr Eddine; Mazzah, Ahmed; Mague, Joel T.; Hökelek, Tuncer; Kandri Rodi, Youssef; Sebbar, Nada Kheira
Crystal structure and Hirshfeld surface analyses, crystal voids, intermolecular interaction energies and energy frameworks of 3-benzyl-1-(3-bromopropyl)-5,5-diphenylimidazolidine-2,4-dione
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1118-1124
2023281 CIF
Paper
C16 H22 Cl2 N2P 1 21/n 17.1738; 7.2872; 32.0348
90; 91.111; 90
1674.37Marmande, Mary Helene; Baxter, Bailey N.; Zeller, Matthias; Forbes, David C.
N,N′-Dibenzylethylenediammonium dichloride
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1130-1134
2023282 CIF
Paper
C22 H18 N4 O6P 1 21/n 112.3711; 3.8255; 21.4175
90; 104.195; 90
982.65Gotingco, Angela; Villanueva Contreras, Merary; Wolfarth, Jeanette A.; Stieber, S. Chantal E.; Marr, Zoe Y.
Crystal structure of a hydrogen-bonded 2:1 co-crystal of 4-nitrophenol and 4,4′-bipyridine
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1135-1137
2023283 CIF
Paper
C8 H20 N6 Ni O6P 1 21/n 18.7321; 15.2444; 10.8545
90; 94.973; 90
1439.46Reibenspies, Joseph; Small, Nadia; Bhuvanesh, Nattamai; Chiarella, Gina; Salazar, Vivian; Pery, Bréayshia; Smith, Rukiyah; Toole, Deja; Hewage, Shamika; Fernando, Harschica; Reinheimer, Eric
Crystal structure and Hirshfeld surface analysis of (nitrato-κ2 O,O′)(1,4,7,10-tetraazacyclododecane-κ4 N)nickel(II) nitrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1157-1160
2023284 CIF
Paper
C22 H23 N O6P 1 21/n 19.05718; 6.71363; 32.8419
90; 95.9308; 90
1986.31Shibata, Hiroki; Sakon, Aya; Takata, Noriyuki; Takiyama, Hiroshi
Crystal structures of two different multi-component crystals consisting of 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline and fumaric acid
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1146-1150
2023285 CIF
Paper
C26 H27 N O10P -19.529; 10.5445; 12.6509
91.606; 104.98; 97.823
1213.86Shibata, Hiroki; Sakon, Aya; Takata, Noriyuki; Takiyama, Hiroshi
Crystal structures of two different multi-component crystals consisting of 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline and fumaric acid
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1146-1150
2023286 CIF
Paper
C2 H7 N5 OP 1 21/c 13.8056; 9.49424; 14.01599
90; 92.9639; 90
505.738Inoue, Kazuki; Nakami, Shun; Kumasaki, Mieko; Matsumoto, Shinya
Synthesis and crystal structure of 1H-1,2,4-triazole-3,5-diamine monohydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1161-1164
2023287 CIF
Paper
C13 H16 O4C 1 2 117.4126; 5.0996; 14.9856
90; 109.652; 90
1253.17Peixoto de Abreu Lima, Alejandro; Pandolfi, Enrique; Schapiro, Valeria; Suescun, Leopoldo
Synthesis, crystal structure and absolute configuration of (3aS,4R,5S,7aR)-7-(but-3-en-1-yn-1-yl)-2,2-dimethyl-3a,4,5,7a-tetrahydro-2H-1,3-benzodioxole-4,5-diol
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1165-1169
2023288 CIF
Paper
C26 H24 Cd Cl4 N6P -19.6288; 11.5103; 13.0302
78.734; 81.153; 77.708
1374.33Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Goreshnik, Evgeny A.
Triclinic polymorph of bis[2-methyl-3-(pyridin-2-yl)imidazo[1,5-a]pyridin-2-ium] tetrachloridocadmium(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1125-1129
2023289 CIF
HKL
Mn13 Zn126.044P 63/m m c12.9051; 12.9051; 57.6398
90; 90; 120
8313.3Mondal, Amit; Pan, Rahul; Kuila, Sandip Kumar; Dey, Riju; Jana, Partha Pratim
Synthesis and structural study of the partially disordered complex hexagonal phase δ<sub>1</sub>-MnZn<sub>9.7</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 688-694
2023290 CIF
HKL
Mn13 Zn126.103P 63/m m c12.9085; 12.9085; 57.6528
90; 90; 120
8319.6Mondal, Amit; Pan, Rahul; Kuila, Sandip Kumar; Dey, Riju; Jana, Partha Pratim
Synthesis and structural study of the partially disordered complex hexagonal phase δ<sub>1</sub>-MnZn<sub>9.7</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 688-694
2023291 CIF
Paper
C3 H8 N2 O2P b c a9.4484; 7.0977; 15.3781
90; 90; 90
1031.28Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Dyakonenko, Viktoriya V.; Lampeka, Rostyslav D.
Synthesis, structures and Hirshfeld surface analyses of 2-hydroxy-N′-methylacetohydrazide and 2-hydroxy-N-methylacetohydrazide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1170-1174
2023292 CIF
Paper
C3 H8 N2 O2C 1 2/c 111.646; 9.304; 10.514
90; 105.65; 90
1097Vashchenko, Oleksandr V.; Khomenko, Dmytro M.; Dyakonenko, Viktoriya V.; Lampeka, Rostyslav D.
Synthesis, structures and Hirshfeld surface analyses of 2-hydroxy-N′-methylacetohydrazide and 2-hydroxy-N-methylacetohydrazide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1170-1174
2023293 CIF
Paper
C22 H18 Cl4 N4 O Zn2F d d 235.5812; 29.757; 8.8942
90; 90; 90
9417.09Kubono, Koji; Tanaka, Kanata; Tani, Keita; Kashiwagi, Yukiyasu
Crystal structure of (μ2-7-{[bis(pyridin-2-ylmethyl)amino-1κ3 N,N′,N′′]methyl}-5-chloroquinolin-8-olato-2κN;1:2κ2 O)trichlorido-1κCl,2κ2 Cl-dizinc(II)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1175-1179
2023294 CIF
Paper
C20 H31 N3 Ni O6P -110.6348; 11.139; 11.7989
72.392; 64.047; 75.829
1187.52Siddikova, Kyzlarkhan; Sardor, Murodov; Tojiboyev, Akmaljon; Kadirova, Zukhra; Ashurov, Jamshid; Daminova, Shahlo
Synthesis, crystal structure and Hirshfeld surface analysis of (2-amino-1-methylbenzimidazole-κN 3)aquabis(4-oxopent-2-en-2-olato-κ2 O,O′)nickel(II) ethanol monosolvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1186-1189
2023295 CIF
Paper
C25 H17 N O3P 1 21 19.3141; 6.7593; 15.3574
90; 105.163; 90
933.19Harish Kumar, Mahadevaiah; Santhosh Kumar, Shivakumar; Devarajegowda, Hirehalli Chikkegowda; Srinivasa, Hosapalya Thimmaiah; Palakshamurthy, Bandrehalli Siddagangaiah
Crystal structure, Hirshfeld surface analysis, and DFT and molecular docking studies of 6-cyanonaphthalen-2-yl 4-(benzyloxy)benzoate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1180-1185
2023296 CIF
Paper
C5 H6 Br I N2P -15.2152; 7.8039; 10.1294
93.3762; 104.111; 96.4297
395.71Mukda, Benjamin A.; Dickie, Diane A.; Turnbull, Mark M.
Salts of 2-amino-5-iodopyridinium
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1230-1234
2023297 CIF
Paper
C10 H11 Br0.51 Cl2.48 Co I2 N4P 1 21/n 19.6998; 13.5527; 13.8518
90; 107.336; 90
1738.2Mukda, Benjamin A.; Dickie, Diane A.; Turnbull, Mark M.
Salts of 2-amino-5-iodopyridinium
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1230-1234
2023298 CIF
Paper
C2 H7 I2 NP 1 21/c 18.3073; 8.88; 9.3838
90; 102.004; 90
677.09Petrosova, Hanna R.; Naumova, Dina D.; Golenya, Irina A.; Buta, Ildiko; Gural'skiy, Il'ya A.
Crystal structure and Hirshfeld surface analysis of the salt 2-iodoethylammonium iodide – a possible side product upon synthesis of hybrid perovskites
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1226-1229
2023299 CIF
Paper
C20 H18 Cl N3 O2P 1 21 110.1898; 6.7445; 14.2538
90; 110.901; 90
915.13Assila, Hamza; Zaoui, Younes; Kalonji Mubengayi, Camille; Guerrab, Walid; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef; Ansar, Mhammed
Synthesis, crystal structure and Hirshfeld surface analysis of 2-{4-[(2-chlorophenyl)methyl]-3-methyl-6-oxopyridazin-1-yl}-N-phenylacetamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1221-1225
2023300 CIF
Paper
C14 H12 Br4 Co N4 O6C 1 2/c 118.805; 12.2925; 10.8938
90; 121.853; 90
2138.98Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro
Crystal structure of catena-poly[[diaquadiimidazolecobalt(II)]-μ2-2,3,5,6-tetrabromobenzene-1,4-dicarboxylato]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1217-1220
2023301 CIF
Paper
C34 H28 Cl2 N12 Ni O2P b c n12.8146; 10.1523; 27.5618
90; 90; 90
3585.7Znovjyak, Kateryna; Shova, Sergiu; Panov, Dmitriy M.; Kariaka, Nataliia S.; Fritsky, Igor O.; Malinkin, Sergey O.; Seredyuk, Maksym
Crystal structure of bis{5-(4-chlorophenyl)-3-[6-(1H-pyrazol-1-yl)pyridin-2-yl]-1H-1,2,4-triazol-1-ido}nickel(II) methanol disolvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1235-1239
2023302 CIF
Paper
C33 H33 N9P 21 21 2111.0204; 16.1387; 16.2772
90; 90; 90
2894.98Koch, Niklas; Förster, Sebastian; Mazik, Monika
Synthesis and crystal structure of 1,3,5-tris[(1H-benzotriazol-1-yl)methyl]-2,4,6-triethylbenzene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1240-1243
2023303 CIF
Paper
Cd4 O14 Te5C 1 2/c 111.9074; 14.3289; 8.7169
90; 113.629; 90
1362.58Eder, Felix; Weil, Matthias
The cadmium oxidotellurates(IV) Cd5(TeO3)4(NO3)2 and Cd4Te5O14
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023304 CIF
Paper
Cd5 N2 O18 Te4P 1 21/c 19.9442; 5.6173; 16.6136
90; 102.737; 90
905.19Eder, Felix; Weil, Matthias
The cadmium oxidotellurates(IV) Cd5(TeO3)4(NO3)2 and Cd4Te5O14
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023305 CIF
Paper
C25 H35 N10 O28 Te V9P 1 21/c 111.661; 23.251; 19.602
90; 122.53; 90
4480.9Mrad, Houda; Maalaoui, Ahlem; Rzaigui, Mohamed; Akriche, Samah
Synthesis and structure of pentakis(2-aminopyridinium) nonavanado(V)tellurate(VI)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023306 CIF
Paper
C22 H24 O7 UP 1 21/n 18.55214; 26.0026; 10.3057
90; 102.829; 90
2234.55Jabborova, Xolida; Tursinboyeva, Xusnida; Ruzieva, Bakhtigul; Turgunov, Kambarali; Ashurov, Jamshid; Tojiboev, Akmaljon; Daminova, Shahlo
Crystal structure and Hirshfeld surface analysis of bis(benzoylacetonato)(ethanol)dioxidouranium(VI)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023307 CIF
HKL
Paper
C4 H20 Br6 N4 ZnP 1 21/m 16.394; 19.838; 6.668
90; 93.18; 90
844.5Czapla, Zbigniew; Krawczyk, Monika K.; Kinzhybalo, Vasyl
Atypical phase transition, twinning and ferroelastic domain structure in bis(ethylenediammonium) tetrabromozincate(II) bromide, [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>NH<sub>3</sub>]<sub>2</sub>[ZnBr<sub>4</sub>]Br<sub>2</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 738-745
2023308 CIF
HKL
Paper
C4 H20 Br6 N4 ZnP 1 21/m 16.438; 19.945; 6.726
90; 93.16; 90
862.3Czapla, Zbigniew; Krawczyk, Monika K.; Kinzhybalo, Vasyl
Atypical phase transition, twinning and ferroelastic domain structure in bis(ethylenediammonium) tetrabromozincate(II) bromide, [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>NH<sub>3</sub>]<sub>2</sub>[ZnBr<sub>4</sub>]Br<sub>2</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 738-745
2023309 CIF
HKL
Paper
C17 H14 F6 S2P 1 21/c 112.047; 17.4; 16.281
90; 92.306; 90
3410Isobe, Mami; Kitagawa, Daichi; Kobatake, Seiya
Morphological control for hollow rod crystals of a photochromic diarylethene on spherulites by surface properties of substrates.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 732-737
2023310 CIF
Paper
C34 H48 Cl4 Cu2 N8 O6 S4P 1 21/n 110.229; 13.0681; 16.9601
90; 98.377; 90
2242.9Le, Canh Dinh; Nguyen, Hoang Phuc; Pham, Chien Thang
Crystal structure of a solvated dinuclear CuII complex derived from 3,3,3′,3′-tetraethyl-1,1′-(furan-2,5-dicarbonyl)bis(thiourea)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023311 CIF
Paper
C40 H30 N2 Ni O2P 1 21 19.5487; 17.8992; 18.0001
90; 94.103; 90
3068.59Ito, Masataka; Chikaraishi Kasuga, Noriko; Matsuse, Ryo; Hirotsu, Masakazu
Crystal structures and circular dichroism of {2,2′-[(1S,2S)-1,2-diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II) and its ethanol solvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023312 CIF
Paper
C44 H42 N2 Ni O4P 110.583; 12.411; 13.9837
94.352; 100.599; 90.584
1799.61Ito, Masataka; Chikaraishi Kasuga, Noriko; Matsuse, Ryo; Hirotsu, Masakazu
Crystal structures and circular dichroism of {2,2′-[(1S,2S)-1,2-diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II) and its ethanol solvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023313 CIF
Paper
C8 H9 Br N2 O2P 1 21/c 14.1538; 8.9978; 25.487
90; 92.468; 90
951.7Mahadevaiah, Harish Kumar; Shivanna, Harishkumar; Hanumaiah, Anil Kumar; Hirehalli Chikkegowda, Devarajegowda; Bandrehalli Siddagangaiah, Palakshamurthy
Crystal structure, Hirshfeld surface analysis, DFT and molecular docking studies of ethyl 5-amino-2-bromoisonicotinate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023314 CIF
Paper
C21 H21 F2 N O2C 1 2/c 118.4793; 10.4036; 18.5669
90; 93.035; 90
3564.5Mohan Kumar, Thaluru M.; Bhaskar, Besagarahally L.; Priyanka, Prabhakar; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean
Crystal structure and Hirshfeld-surface analysis of an etoxazole metabolite designated R13
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023315 CIF
Paper
Al Cl8P b c m6.2653; 13.5033; 14.0112
90; 90; 90
1185.38Seo, Hyeonjin; Shin, Seungyong; Hong, Seung-Tae
Crystal structure of AlPCl8
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023316 CIF
Paper
C18 H12 Br N2 O4 Re SP 1 21/c 112.7442; 10.6851; 14.4027
90; 96.645; 90
1948.08Matsuda, Yuki; Nakamura, Ryota; Ozawa, Yoshiki; Abe, Masaaki
Crystal structures of two polymorphs for fac-bromidotricarbonyl[4-(4-methoxyphenyl)-2-(pyridin-2-yl)thiazole-κ2 N,N′]rhenium(I)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023317 CIF
Paper
C18 H12 Br N2 O4 Re SP n a 2113.2169; 11.2764; 25.8716
90; 90; 90
3855.88Matsuda, Yuki; Nakamura, Ryota; Ozawa, Yoshiki; Abe, Masaaki
Crystal structures of two polymorphs for fac-bromidotricarbonyl[4-(4-methoxyphenyl)-2-(pyridin-2-yl)thiazole-κ2 N,N′]rhenium(I)
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023318 CIF
Paper
C20 H24 N8 O13P 1 21/c 18.247; 12.0714; 25.771
90; 98.572; 90
2536.9Seidel, Rüdiger W.; Kolev, Tsonko M.
Crystal structure of 1,10-phenanthrolinium violurate violuric acid pentahydrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023319 CIF
Paper
C13 H12 N2 O2P 1 21/n 15.0082; 20.728; 11.1549
90; 96.998; 90
1149.4Burieva, Dilnoza; Torambetov, Batirbay; Bobonazarova, Sarvinoz; Abdushukurov, Anvar; Kholikov, Tursinali; Khan, Akram A.; Ashurov, Jamshid; Yusufov, Mukhriddin
Synthesis, crystal structure and Hirshfeld surface analysis of N-(4-methoxyphenyl)picolinamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023320 CIF
Paper
C10 H19 N13 O7P -113.2412; 14.3856; 21.3601
108.186; 99.785; 91.272
3796.9Gettings, Matthew; Zeller, Matthias; Piercey, Davin
Crystal structure of the 1:1 cocrystal 5,5′-(triaz-1-ene-1,3-diyl)bis(3-nitro-1H-1,2,4-triazole)–triethylammonium nitrate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023321 CIF
Paper
C28 H22 Br2 O4P 1 21/c 17.7456; 24.4234; 13.059
90; 101.611; 90
2419.87Li, Kun; Yao, Jiali; Iitsuka, Hiroaki; Yonezawa, Noriyuki; Okamoto, Akiko
Crystal structure and Hirshfeld surface analysis of (2,7-diethoxynaphthalene-1,8-diyl)bis[(4-bromophenyl)methanone]
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023322 CIF
Paper
C22 H6 F8P 1 21/c 121.8447; 13.014; 12.1123
90; 92.62; 90
3439.8Bosch, Eric; Bowling, Nathan P.
Intra- and intermolecular C—H...F hydrogen bonds in the crystal structure of 1,2-bis[2-(2,3,4,5-tetrafluorophenyl)ethynyl]benzene
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023323 CIF
Paper
C19 H13 Br N2 O3 SP n a 2110.5425; 3.8532; 42.419
90; 90; 90
1723.2Santhosh Kumar, S.; Srinivasa, H.T; Harish Kumar, M.; Devarajegowda, H. C.; Palakshamurthy, B. S.
Crystal structure, Hirshfeld surface, DFT and molecular docking studies of 2-{4-[(E)-(4-acetylphenyl)diazenyl]phenyl}-1-(5-bromothiophen-2-yl)ethanone; a compound with bromine...oxygen-type contacts
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023324 CIF
Paper
C16 H20 O48 Si24P 21 21 2120.128; 19.816; 13.429
90; 90; 90
5356.2Hwang, In-Chul
Crystal structure of p-xylene@silicalite-1
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023325 CIF
Paper
C18 H23 Cu N3 O4P n m a9.0322; 13.974; 16.0004
90; 90; 90
2019.51Siddikova, Kyzlarkhan; Ziyatov, Daminbek; Tojiboev, Akmaljon; Ashurov, Jamshid; Kadirova, Zukhra; Daminova, Shahlo
Synthesis, crystal structure and Hirshfeld surface analysis of bis(acetylacetonato-κ2 O,O′)(2-amino-1-methyl-1H-benzimidazole-κN 3)copper(II)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023326 CIF
Paper
C30 H23 N O2P -19.6337; 9.8825; 12.8446
87.546; 86.605; 70.914
1153.26Madhan, Sundarasamy; Nizam Mohideen, Mohamed Hanifa; Viswanathan, Vijayan; Velmurugan, Devadasan
Crystal structure and Hirshfeld surface analysis of the chalcone derivative (2E)-3-[4-(diphenylamino)phenyl]-1-[4-(prop-1-yn-2-yloxy)phenyl]prop-2-en-1-one
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023327 CIF
Paper
C20 H9 F21 O3P 1 21/c 17.0271; 19.2243; 17.7558
90; 97.332; 90
2379.04Peloquin, Andrew J.; Balaich, Gary J.; Jennings, Abby R.
Crystal structure and Hirshfeld surface analysis of 1,3,3,4,4,5,5-heptafluoro-2-(3-[(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxy]-2-{[(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxy]methyl}-2-methylpropoxy)cyclopentene
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023328 CIF
Paper
C28 H22 Br2 N2 O5 S2P 1 21/n 19.5718; 14.4498; 20.0041
90; 92.874; 90
2763.3Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.
The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1110-1117
2023329 CIF
Paper
C36 H27 Br2 N3 O6 S3P 1 21/n 18.2664; 34.7886; 12.5972
90; 104.55; 90
3506.5Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; MohanaKrishnan, Arasambattu K.
The crystal structures determination and Hirshfeld surface analysis of N-(4-bromo-3-methoxyphenyl)- and N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}- derivatives of N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}benzenesulfonamide
Acta Crystallographica Section E Crystallographic Communications, 2024, 80, 1110-1117
2023330 CIF
Paper
C4 H16 Br4 N2 O2 SnC 1 2/c 18.4947; 8.3064; 21.6425
90; 96.15; 90
1518.31Sirenko, Valerii Y.; Apostu, Mircea-Odin; Golenya, Irina A.; Naumova, Dina D.; Partsevska, Sofiia V.
Crystal structure of catena-poly[bis(N,O-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023331 CIF
Paper
C41 H48 N8 O10P -19.1493; 12.3058; 20.1432
76.076; 84.791; 71.829
2091.19Filley, Jonathan
Binary solvent participation in crystals of a multi-aromatic 1,2,3-triazole
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023332 CIF
Paper
C6 H8 Br2 Cd N2C m c e7.9334; 15.4735; 15.4898
90; 90; 90
1901.49Näther, Christian
Synthesis, crystal structure and thermal properties of poly[di-μ-bromido-(μ-2,5-dimethylpyrazine)cadmium(II)]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023333 CIF
Paper
C33 H21 Cl2 Cu F3 N4P -19.3994; 10.8016; 15.2355
104.272; 99.186; 101.529
1432.86Le Thi Hong, Hai; Nguyen Van, Hau; Hoang Tuan, Duong; Tran Quang, Hung; Dang Thanh, Tuan; Van Meervelt, Luc
Syntheses, structures and anticancer activities of CuII and ZnII complexes containing 1,1′-[(3-fluorophenyl)methylene]bis[3-(3-fluorophenyl)imidazo[1,5-a]pyridine]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023334 CIF
Paper
C4 H14 Ge I6 N2P 1 21/n 18.1431; 8.8362; 25.1787
90; 97.264; 90
1797.17Kucheriv, Olesia I.; Apostu, Mircea-Odin; Prysiazhna, Olena; Potaskalov, Vadim A.; Malinkin, Sergey O.
Crystal structure and Hirshfeld surface analysis of the layered hybrid metal halide poly[bis(2-iodoethylammonium) [di-μ-iodido-diiodidogermanate(II)]]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023335 CIF
Paper
C10 H18 Co N4 O8 S4P 1 21/c 15.195; 10.0347; 18.909
90; 91.892; 90
985.19Kinshakova, Ekaterina; Torambetov, Batirbay; Kaur, Simranjeet; Ashurov, Jamshid; Kadirova, Shakhnoza
Synthesis, crystal structure, Hirshfeld surface analysis and DFT calculations of the coordination compound tetraaquabis{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetato-κO}cobalt(II)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023336 CIF
Paper
C14 H14 Co N4 S2C 1 2/c 120.1106; 9.2112; 19.2309
90; 116.353; 90
3192.2Näther, Christian; Boeckmann, Jan
Synthesis, crystal structure and properties of catena-poly[[bis(4-methylpyridine-κN)cobalt(II)]-di-μ-thiocyanato-κ2 N:S;κ2 S:N], which shows a rare coordination geometry
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023337 CIF
Paper
C15 H20 Br F4 I2 NC 1 2/c 129.0324; 9.1477; 15.0296
90; 108.533; 90
3784.56Gurbanov, Atash V.; Hökelek, Tuncer; Mammadova, Gunay Z.; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.
Crystal structure and Hirshfeld surface analysis of supramolecular aggregate of 2,2,6,6-tetramethylpiperidin-1-ium bromide with 1,2,3,4-tetrafluoro-5,6-diiodobenzene
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023338 CIF
Paper
C13 H17 N3 O3P 1 21/c 116.2304; 6.5804; 13.2222
90; 107.156; 90
1349.33Maimoune, Imane; Kariuki, Benson M.; El Moutaouakil Ala Allah, Abderrazzak; Nchioua, Intissar; Alsubari, Abdulsalam; Mague, Joel T.; Zarrouk, Abdelkader; Ramli, Youssef
Crystal structure and Hirshfeld surface analysis of N-(4-nitrophenyl)-2-(piperidin-1-yl)acetamide (lidocaine analogue)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023339 CIF
HKL
Paper
C12 H20 Ba N2 O11P -16.813; 8.058; 16.011
101.781; 91.365; 92.345
859.3Zhao, Xin-Yi; Yu, Hai-Yan; Zhang, Hong-Tao
A twofold interpenetrated three-dimensional barium(II) metal–organic framework constructed from 2,2′-[terephthaloylbis(azanediyl)]diacetate: synthesis, structure, dihydrogen bonding and spectroscopic properties
Acta Crystallographica Section C Structural Chemistry, 2025, 81, 43-53
2023340 CIF
Paper
C37 H30 Cl2 N4P 1 21/c 19.8527; 28.716; 10.7754
90; 109.085; 90
2881.11Kubono, Koji; Tani, Keita; Kashiwagi, Yukiyasu
Synthesis and crystal structure of anti-10-(4-cyanophenyl)-10,11,22,23-tetrahydro-9H,21H-5,8:15,12-bis(metheno)[1,5,11]triazacyclohexadecino[1,16-a:5,6-a′]diindole dichloromethane monosolvate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81, 20-23
2023341 CIF
Paper
C14 H9 Cl2 N3 S2P 1 21 19.0136; 8.1561; 10.8718
90; 95.778; 90
795.189Ben, Anna; Chęcińska, Lilianna
Crystal structure of luliconazole
Acta Crystallographica Section E Crystallographic Communications, 2025, 81, 24-28
2023342 CIF
Paper
C10 H24 N4 Ni O4 SP -17.9935; 8.3181; 12.1998
108.308; 102.767; 99.145
727.87Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Bahrin, Lucian G.; Lampeka, Yaroslaw D.
Syntheses and structures of two coordination polymers formed by Ni(cyclam)2+ cations and sulfate anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023343 CIF
Paper
C66 H86 N8 Ni2 O16 S2I 1 2/a 112.1299; 18.5163; 35.621
90; 94.777; 90
7972.7Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Bahrin, Lucian G.; Lampeka, Yaroslaw D.
Syntheses and structures of two coordination polymers formed by Ni(cyclam)2+ cations and sulfate anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023344 CIF
Paper
C H4 N4 O7 SrA e a 29.3527; 9.9701; 17.0496
90; 90; 90
1589.83Bektursinova, Aysanem; Djumanazarova, Zulfiya; Uzakbergenova, Zamira; Ashurov, Jamshid; Khan, Akram A.; Kadirova, Shakhnoza; Torambetov, Batirbay
Synthesis, crystal structure and Hirshfeld surface analysis of [Sr(urea)(NO3)2] n
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023345 CIF
Paper
C6 H3 N3 O2 SeP 1 21/c 17.0105; 13.2765; 8.1311
90; 114.808; 90
686.96Gurbanov, Atash V.; Hökelek, Tuncer; Mammadova, Gunay Z.; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.
Crystal structure, Hirshfeld surface analysis and crystal voids of 4-nitrobenzo[c][1,2,5]selenadiazole
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023346 CIF
Paper
C36 H28 F6 Ir N4 PP b c a11.413; 17.1627; 31.7109
90; 90; 90
6211.46Gienau, Trevor J.; Clay, Malachi; Brennessel, William W.; Reed, Carly R.
(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023347 CIF
Paper
C42 H40.44 F6 Ir N4.78 O0.61 PP -19.17379; 13.10065; 16.55352
74.8888; 78.9993; 88.7599
1884.53Gienau, Trevor J.; Clay, Malachi; Brennessel, William W.; Reed, Carly R.
(2,9-Dimethyl-1,10-phenanthroline)bis[2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate and (2,9-dimethyl-1,10-phenanthroline)bis[5-methyl-2-(pyridin-2-yl)phenyl]iridium(III) hexafluorophosphate–diethyl ether–acetonitrile (1/0.61/0.78)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023348 CIF
Paper
C8 H5 Br Cl2 OP -17.0317; 9.78938; 14.444
87.5944; 84.7254; 72.0372
941.7Gurbanov, Atash V.; Guseinov, Firudin I.; Samigullina, Aida I.; Hökelek, Tuncer; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.
Syntheses, crystal structures, Hirshfeld surface analyses and crystal voids of 1-(4-bromophenyl)-2,2-dichloroethan-1-one and 2,2-dibromo-1-(p-tolyl)ethan-1-one
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023349 CIF
Paper
C9 H8 Br2 OP 1 21/c 16.6243; 9.9574; 14.3804
90; 92.52; 90
947.63Gurbanov, Atash V.; Guseinov, Firudin I.; Samigullina, Aida I.; Hökelek, Tuncer; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.
Syntheses, crystal structures, Hirshfeld surface analyses and crystal voids of 1-(4-bromophenyl)-2,2-dichloroethan-1-one and 2,2-dibromo-1-(p-tolyl)ethan-1-one
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023350 CIF
Paper
C24 H16 Cl2 Cu N4 O4C 1 2/c 115.7143; 11.6386; 13.0138
90; 115.227; 90
2153.12Plutenko, Maksym O.; Vynohradov, Oleksandr S.; Haukka, Matti; Golenya, Irina A.; Gaidai, Snizhana V.
Crystal structure and Hirshfeld surface analysis of a new polymorph of chloridobis(1,10-phenanthroline-κ2 N,N′)copper(II) perchlorate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023351 CIF
Paper
C18 H14 Cl2 N2 O2 ZnP -17.5164; 7.8002; 15.1156
96.172; 92.052; 96.284
874.77Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023352 CIF
Paper
C18 H14 Br2 N2 O2 ZnC 1 2/c 117.1095; 7.202; 14.9534
90; 96.472; 90
1830.9Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023353 CIF
Paper
C18 H14 I2 N2 O2 ZnP -17.7325; 8.9596; 14.8297
93.205; 99.873; 104.852
972.98Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023354 CIF
Paper
C54 H42 Cl2 N6 O14 ZnR -3 :H12.8217; 12.8217; 26.5684
90; 90; 120
3782.6Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023355 CIF
Paper
C27 H31 N5 O14 ZnP -19.736; 11.591; 14.6381
74.352; 74.62; 81.633
1528.8Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023356 CIF
Paper
C21 H30 N2P 1 21/n 18.9895; 11.8589; 17.6765
90; 102.419; 90
1840.32Smirnov, Daniil E.; Morozov, Oleg S.; Afanasyeva, Ekaterina S.; Avdeev, Viktor V.
Synthesis and crystal structures of 4,4′-methylenebis(2,6-diethylaniline) and 4,4′-methylenebis(3-chloro-2,6-diethylaniline)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023357 CIF
Paper
C21 H28 Cl2 N2P -18.993; 9.654; 12.216
69.352; 77.257; 87.67
967.2Smirnov, Daniil E.; Morozov, Oleg S.; Afanasyeva, Ekaterina S.; Avdeev, Viktor V.
Synthesis and crystal structures of 4,4′-methylenebis(2,6-diethylaniline) and 4,4′-methylenebis(3-chloro-2,6-diethylaniline)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023358 CIF
Paper
C9 H9 Cl N2 OP b c m10.1221; 13.6533; 6.6248
90; 90; 90
915.55Davlatboev, Muzaffar; Allabergenova, Sevara; Zulpanov, Fazliddin; Yakubov, Ubaydullo; Tojiboev, Akmaljon; Sattarov, Tulkinjon
Crystal structure and Hirshfeld surface analysis of 2-methylquinazolin-4(3H)-one hydrochloride
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023359 CIF
Paper
C26 H14 Ce2 O18 S4P n a 2117.91596; 11.08917; 17.25666
90; 90; 90
3428.43Ruser, Niklas; Näther, Christian; Stock, Norbert
Syntheses and crystal structures of the cerium-based coordination polymers poly[(acetic acid)bis(μ-5-carboxythiophene-2-carboxylato)bis(μ-thiophene-2,5-dicarboxylato)dicerium(III)] and poly[(μ-acetato)aqua(μ4-thiophene-2,5-dicarboxylato)cerium(III)]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023360 CIF
Paper
C8 H7 Ce O7 SP 1 21/c 110.031; 14.6755; 7.6765
90; 102.354; 90
1103.89Ruser, Niklas; Näther, Christian; Stock, Norbert
Syntheses and crystal structures of the cerium-based coordination polymers poly[(acetic acid)bis(μ-5-carboxythiophene-2-carboxylato)bis(μ-thiophene-2,5-dicarboxylato)dicerium(III)] and poly[(μ-acetato)aqua(μ4-thiophene-2,5-dicarboxylato)cerium(III)]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023361 CIF
Paper
C6 H21 Bi I9 N3P -18.5014; 12.8233; 13.6364
107.689; 107.067; 92.749
1338.49Kucheriv, Olesia I.; Ovdenko, Valeriia M.; Kuzevanova, Iryna S.; Golenya, Irina A.; Gural'skiy, Il'ya A.
Crystal structure and Hirshfeld surface analysis of the organic–inorganic hybrid compound tris(2-iodoethylammonium) hexaiodidobismuthate(III)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023362 CIF
Paper
C14 H14 Cl3 N5 O3P -15.6812; 9.79735; 30.9679
84.834; 86.9814; 83.8568
1705.22Voss, J.; Stammler, H.G.; Sewald, N.
Synthesis and crystal structure of 2,2,2-trichloroethyl N-{4-[6-(1-hydroxyethyl)-1,2,4,5-tetrazin-3-yl]benzyl}carbamate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023363 CIF
Paper
C23 H19 N O2 SC 1 c 116.1416; 12.8991; 19.0656
90; 107.416; 90
3787.71Aliyeva, Khatira N.; Hökelek, Tuncer; Khrustalev, Victor N.; Rzayev, Rovnag M.; Bhattarai, Ajaya; Maharramov, Abel M.; Shikhaliyev, Namig G.
Synthesis, crystal structure and Hirshfeld surface analysis of 5-oxo-N-phenyl-3-(thiophen-2-yl)-2,3,4,5-tetrahydro-[1,1′-biphenyl]-4-carboxamide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023364 CIF
Paper
C28 H22 O4 S2P n a 2117.2598; 10.0898; 13.181
90; 90; 90
2295.44Sakami, Toshiki; Watanabe, Hikaru; Sato, Takuma; Okuda, Yasuhiro; Wakamatsu, Kan; Akashi, Haruo; Orita, Akihiro
Synthesis and crystal structure of 5,10-bis(phenylsulfonyl)tetrahydrodibenzopentalene
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023365 CIF
Paper
C9 H10 N2 SP 21 21 217.4512; 14.7799; 15.8912
90; 90; 90
1750.07Gurbanov, Atash V.; Guseinov, Firudin I.; Samigullina, Aida I.; Hökelek, Tuncer; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.
Synthesis and crystal structure analysis of 1-ethyl-1,3-dihydro-2H-benzo[d]imidazole-2-thione
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023366 CIF
Paper
C20 H27 PP 1 2/n 16.5476; 5.991; 21.5676
90; 96.02; 90
841.36Liu, Mo; Izod, Keith; Waddell, Paul G.
Polymorphism in a secondary phosphine
Acta Crystallographica Section C Structural Chemistry, 2025, 81, 109-113
2023367 CIF
Paper
C20 H27 PP 1 21/c 112.8874; 8.8455; 15.4635
90; 104.108; 90
1709.6Liu, Mo; Izod, Keith; Waddell, Paul G.
Polymorphism in a secondary phosphine
Acta Crystallographica Section C Structural Chemistry, 2025, 81, 109-113
2023368 CIF
Paper
C7 H10 Cl N3 Na O6.5 S2P -18.3728; 9.0819; 9.6533
83.013; 74.055; 70.189
663.7Brydson, Rowan K. H.; Gray, Morven L.; Kennedy, Alan R.; O'Hara, Benjamin C.; Reid, Michael W.; Ugbolue, Ifeka
On the deprotonation of chlorothiazide
Acta Crystallographica Section C Structural Chemistry, 2025, 81, 102-108
2023369 CIF
Paper
C7 H10 Cl K N3 O6.5 S2C 1 2/c 118.3139; 7.3622; 19.967
90; 99.734; 90
2653.4Brydson, Rowan K. H.; Gray, Morven L.; Kennedy, Alan R.; O'Hara, Benjamin C.; Reid, Michael W.; Ugbolue, Ifeka
On the deprotonation of chlorothiazide
Acta Crystallographica Section C Structural Chemistry, 2025, 81, 102-108
2023370 CIF
Paper
C7 H7 Cl Cs N3 O5 S2P -17.7126; 9.0593; 10.1381
93.976; 107.539; 107.8
632.841Brydson, Rowan K. H.; Gray, Morven L.; Kennedy, Alan R.; O'Hara, Benjamin C.; Reid, Michael W.; Ugbolue, Ifeka
On the deprotonation of chlorothiazide
Acta Crystallographica Section C Structural Chemistry, 2025, 81, 102-108
2023371 CIF
Paper
C16 H19 N3 O11 P2P 1 21/c 14.7217; 26.167; 16.7888
90; 98.082; 90
2053.7Gutiérrez, Eduardo L; Russo, Marcos G.; Narda, Griselda E.; Brusau, Elena V.; Ayala, Alejandro P.; Ellena, Javier
Supra-molecular assembly of mebendazolium and di-hydrogen phosphate ions in a new anthelmintic salt.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 195-199
2023372 CIF
Paper
C20 H46 Cl2 P2 Pd Se2P -17.9312; 8.5664; 10.1483
88.993; 88.01; 77.063
671.55Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023373 CIF
Paper
C22 H50 Cl2 P2 Pd Se2P 1 21/c 115.3744; 13.2969; 16.0503
90; 117.306; 90
2915.57Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023374 CIF
Paper
C22 H50 Br2 P2 Pd Se2P 1 21/c 115.3561; 13.4695; 16.1371
90; 116.558; 90
2985.6Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023375 CIF
Paper
C22 H50 Br2 P2 Pd S2P 1 21/n 17.8595; 17.5019; 10.674
90; 94.551; 90
1463.65Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023376 CIF
Paper
C22 H50 Cl2 P2 Pt S2P 1 21/c 114.5283; 14.4191; 13.9428
90; 94.571; 90
2911.52Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023377 CIF
Paper
C20 H46 Cl4 P2 Pd2 S2P -16.9753; 8.7642; 13.0718
88.93; 78.488; 79.804
770.56Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023378 CIF
Paper
C22 H50 Br8 P2 Pd2 S2P 1 21/c 17.8691; 22.7255; 10.5879
90; 98.386; 90
1873.18Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023379 CIF
Paper
C22 H50 Br8 P2 Pd2 Se2C 1 2/c 119.355; 14.8165; 16.3047
90; 125.957; 90
3784.8Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023380 CIF
Paper
C24 H58 O4 P4 Pd Se4P 1 21/n 17.56435; 10.0914; 24.1396
90; 92.7641; 90
1840.55Upmann, Daniel; Jones, Peter G.
Crystal structures of six complexes of phosphane chalcogenides <i>R</i> <sup>1</sup> <i>R</i> <sup>2</sup> <i>R</i> <sup>3</sup>P<i>E</i> (<i>R</i> = <i>tert</i>-butyl or isopropyl, <i>E</i> = S or Se) with the metal halides <i>MX</i> <sub>2</sub> (<i>M</i> = Pd or Pt, <i>X</i> = Cl or Br), two halochalcogenyl-phospho-nium derivatives ( <sup><i>t</i></sup> Bu<sub>2</sub> <sup>i</sup>PrP<i>E</i>Br)<sub>2</sub>[Pd<sub>2</sub>Br<sub>6</sub>] and one hydrolysis product.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 183-194
2023381 CIF
Paper
C16 H9 Br O4P 21 21 215.4003; 6.367; 38.404
90; 90; 90
1320.5Bationo, Valentin; Kambo, Konan René; Sorgho, Brahima; Sombié, Charles Bavouma; Thiam, El Walda; Semdé, Rasmané; Djandé, Abdoulaye; Lecomte, Claude; Wenger, Emmanuel
Synthesis and structure of 2-oxo-2<i>H</i>-chromen-4-yl 4-bromo-benzoate: work carried out as part of the CNRS AFRAMED project.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 200-203
2023382 CIF
Paper
C18 H28 Co N2 O12P -16.886; 6.945; 12.0366
85.543; 84.371; 83.981
568.37Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro
Crystal structure of <i>catena</i>-poly[[[tetra-aquacobalt(II)]-μ<sub>2</sub>-1,5-di-hydroxy-naphthalene-2,6-di-carboxyl-ato] di-methyl-formamide disolvate].
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 204-207
2023383 CIF
HKL
Ca3 O SnP m -3 m4.827; 4.827; 4.827
90; 90; 90
112.47Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023384 CIF
HKL
O Sn Sr3P m -3 m5.1394; 5.1394; 5.1394
90; 90; 90
135.75Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023385 CIF
HKL
Eu3 O SnP m -3 m5.077; 5.077; 5.077
90; 90; 90
130.86Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023386 CIF
HKL
Ba3 O SnP m -3 m5.444; 5.444; 5.444
90; 90; 90
161.34Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023387 CIF
HKL
Ca3 O PbP m -3 m4.8402; 4.8402; 4.8402
90; 90; 90
113.39Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023388 CIF
HKL
O Pb Sr3P m -3 m5.151; 5.151; 5.151
90; 90; 90
136.67Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023389 CIF
HKL
Eu3 O PbP m -3 m5.091; 5.091; 5.091
90; 90; 90
131.95Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023390 CIF
HKL
Ba3 O PbP m -3 m5.489; 5.489; 5.489
90; 90; 90
165.4Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023391 CIF
HKL
Eu3 O SiP b n m7.0138; 7.0383; 9.9501
90; 90; 90
491.19Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023392 CIF
HKL
Ca3 O SiP b n m6.66; 6.646; 9.411
90; 90; 90
416.6Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023393 CIF
HKL
Ca3 O SiP m -3 m4.741; 4.741; 4.741
90; 90; 90
106.6Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023394 CIF
HKL
Ca3 Ge OP m -3 m4.7452; 4.7452; 4.7452
90; 90; 90
106.85Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023395 CIF
Paper
Ba3 O PbI b m m7.693; 7.693; 10.88
90; 90; 90
643.9Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023396 CIFBa3 O SnI b m m7.676; 7.676; 10.856
90; 90; 90
639.65Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023397 CIFEu3 Ge OP b n m7.0448; 7.0448; 9.9628
90; 90; 90
494.45Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023398 CIFCa3 O SiI b m m6.6679; 6.6679; 9.43
90; 90; 90
419.27Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023399 CIFCa3 Ge OI b m m6.6761; 6.6761; 9.4414
90; 90; 90
420.81Nuss, Jürgen; Mühle, Claus; Hayama, Kyouhei; Abdolazimi, Vahideh; Takagi, Hidenori
Tilting structures ininverseperovskites,M3TtO (M= Ca, Sr, Ba, Eu;Tt= Si, Ge, Sn, Pb)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 300-312
2023400 CIF
Paper
C20 H16 O3P 1 2/c 131.9237; 7.0199; 6.9184
90; 91.864; 90
1549.6Kumar, M. Harish; Vinduvahini, M.; Srinivasa, H. T.; Devarajegowda, H. C.; Palakshamurthy, B. S.
Crystal structure, Hirshfeld surface analysis, DFT and mol-ecular docking studies of 4'-(benz-yloxy)-[1,1'-biphen-yl]-3-carb-oxy-lic acid.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 208-213
2023401 CIF
Paper
C21 H19 Br OP 1 21/c 119.2056; 10.5517; 17.4704
90; 107.512; 90
3376.32Fischer, Julian; Hebenbrock, Marian
Synthesis and structure of 1,1',1''-[(2-bromo-eth-oxy)methane-tri-yl]tri-benzene and 1,1',1''-[(2-iodoeth-oxy)methane-tri-yl]tri-benzene.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 214-218
2023402 CIFC21 H19 I OP 1 21/c 119.35; 10.5936; 17.5475
90; 105.945; 90
3458.6Fischer, Julian; Hebenbrock, Marian
Synthesis and structure of 1,1',1''-[(2-bromo-eth-oxy)methane-tri-yl]tri-benzene and 1,1',1''-[(2-iodoeth-oxy)methane-tri-yl]tri-benzene.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 214-218
2023403 CIF
Paper
C11 H6 Cl N3 S SeP -17.142; 8.824; 10.255
101.566; 107.022; 97.55
592.8Sapronov, Alexander A.; Dukhnovsky, Evgeny A.; Kubasov, Alexey S.; Novikov, Alexander S.; Grishina, Maria M.; Dobrokhotova, Ekaterina V.; Komarovskikh, Milena R.; Shikhaliyev, Namiq Q.; Akkurt, Mehmet; Bhattarai, Ajaya; Tskhovrebov, Alexander G.
Synthesis, structural characterization, Hirshfeld surface analysis and QTAIM analysis of 3-(4-cyano-thio-phen-3-yl)-[1,2,4]selena-diazolo[4,5-<i>a</i>]pyridin-4-ium chloride.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 224-228
2023404 CIF
Paper
C24 H24 O6P 1 21 110.6205; 14.816; 12.7073
90; 96.209; 90
1987.81Saekee, Amporn; Kuhakarn, Chutima; Chakarawet, Khetpakorn; Hongthong, Sakchai
Synthesis and crystal structure of 5,10-dihy-droxy-9-meth-oxy-2,2-dimethyl-12-(2-methyl-but-3-en-2-yl)-2<i>H</i>,6<i>H</i>-pyrano[3,2-<i>b</i>]xanthen-6-one.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 219-223
2023405 CIF
Paper
C19 H19 Cl F5 NP 1 21/c 19.3155; 22.2529; 8.2699
90; 90.165; 90
1714.32Mewis, Ryan E.; Hulme, Matthew C.; Marron, Jack; Langley, Stuart K.; Sutcliffe, Oliver B.; Benjamin, Sophie L.
Synthesis and crystal structures of five fluorinated diphenidine derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 229-234
2023406 CIF
Paper
C16 H18 Cl F2 NP 1 21/c 17.9474; 12.7652; 15.3998
90; 99.368; 90
1541.48Mewis, Ryan E.; Hulme, Matthew C.; Marron, Jack; Langley, Stuart K.; Sutcliffe, Oliver B.; Benjamin, Sophie L.
Synthesis and crystal structures of five fluorinated diphenidine derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 229-234
2023407 CIF
Paper
C18 H20 Cl F2 NP -18.1365; 12.7421; 16.0451
88.059; 82.349; 86.14
1644.42Mewis, Ryan E.; Hulme, Matthew C.; Marron, Jack; Langley, Stuart K.; Sutcliffe, Oliver B.; Benjamin, Sophie L.
Synthesis and crystal structures of five fluorinated diphenidine derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 229-234
2023408 CIF
Paper
C33 H38 Cl4 F4 N2I 1 2/a 122.9963; 7.8729; 19.033
90; 92.13; 90
3443.5Mewis, Ryan E.; Hulme, Matthew C.; Marron, Jack; Langley, Stuart K.; Sutcliffe, Oliver B.; Benjamin, Sophie L.
Synthesis and crystal structures of five fluorinated diphenidine derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 229-234
2023409 CIF
Paper
C18 H22 Cl F2 NP 1 21/c 111.3115; 10.54; 14.8039
90; 105.044; 90
1704.48Mewis, Ryan E.; Hulme, Matthew C.; Marron, Jack; Langley, Stuart K.; Sutcliffe, Oliver B.; Benjamin, Sophie L.
Synthesis and crystal structures of five fluorinated diphenidine derivatives.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 229-234
2023410 CIF
Paper
C23 H16 Cl F3 N2P 1 21/c 112.12054; 8.93314; 17.75198
90; 90.4278; 90
1922.03Guseinov, Firudin I.; Afanaseva, Ksenia A.; A Vil, Vera; Ugrak, Bogdan I.; Samigullina, Aida I.; Zangrando, Ennio; Belay, Alebel N.
Crystal structure of 1-[(4-chloro-phen-yl)di-phenylyl-meth-yl]-3-(tri-fluoro-meth-yl)-1<i>H</i>-pyrazole.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 235-238
2023411 CIF
Paper
C9 H25 Co1.5 N11 O15 S3P 1 21/c 122.8868; 10.7978; 10.1946
90; 95.359; 90
2508.35Nuralieva, Guzal; Umirzakova, Oydinoy; Torambetov, Batirbay; Rasulov, Abdusamat; Ashurov, Jamshid; Kadirova, Shakhnoza
Synthesis, crystal structure and Hirshfeld analysis of a novel supra-molecular compound [Co(tsc)<sub>3</sub>]<sub>2</sub>[Co(cit)<sub>2</sub>](NO<sub>3</sub>)<sub>4</sub>·4H<sub>2</sub>O.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 248-251
2023412 CIF
Paper
C10 H6 Br2 Cl4 Cu N2P 1 21/c 13.86683; 14.1943; 13.7347
90; 91.453; 90
753.61Landee, Christopher P.; Dickie, Diane A.; Turnbull, Mark M.
CuBr<sub>2</sub> complexes with 3,5-disubstituted pyridine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 243-247
2023413 CIFC14 H18 Br2 Cu N2P 1 21/c 13.9901; 14.2902; 13.8338
90; 93.638; 90
787.2Landee, Christopher P.; Dickie, Diane A.; Turnbull, Mark M.
CuBr<sub>2</sub> complexes with 3,5-disubstituted pyridine ligands.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 243-247
2023414 CIF
Paper
C21 H23 F2 N O2P 1 21/n 110.2254; 12.2767; 14.7404
90; 93.726; 90
1846.51Sowbhagya, Chaluvarangaiah; Mohan Kumar, Thaluru M.; Yathirajan, Hemmige S.; Parkin, Sean
Crystal structure and Hirshfeld-surface analysis of the pesticide etoxazole.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 239-242
2023415 CIF
Paper
C6 H4 Cl F N2 SeP 1 21/c 16.889; 7.25; 15.183
90; 90.9; 90
758.2Gurbanov, Atash V.; Hökelek, Tuncer; Mammadova, Gunay Z.; Hasanov, Khudayar I.; Javadzade, Tahir A.; Belay, Alebel N.
Synthesis, crystal structure, Hirshfeld surface and crystal void analysis of 4-fluoro-benzo[<i>c</i>][1,2,5]selena-diazol-1-ium chloride.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 252-256
2023416 CIF
Paper
C21 H25 N O4C 1 2/c 117.9534; 15.8109; 14.6429
90; 113.189; 90
3820.7Sunitha Kumari, M.; Harish Kumar, M.; Deevith, D. V.; Devarajegowda, H. C.; Palakshamurthy, B. S.
Crystal structure, Hirshfeld surface, DFT, mol-ecular docking of 1-[(6-<i>tert</i>-butyl-2-oxo-2<i>H</i>-chromen-4-yl)meth-yl]-4,4-di-methyl-piperidine-2,6-dione and cytotoxic effects on breast cancer (MDA-MB 231), human alveolar basal epithelial (A549) cell lines.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 257-263
2023417 CIF
Paper
C21 H15 Br O4P n a 215.9754; 7.2962; 39.537
90; 90; 90
1723.7Anilkumar, Hanumaiah; Selvanandan, Selvaraj; Omkariah, Metikurke Amruthesh; Harish Kumar, Mahadevaiah; Srinivasa, Hosapalya Thimmaiah; Palakshamurthy, Bandrehalli Siddagangaiah
Synthesis, crystal structure, Hirshfeld surface analysis, density function theory calculations and photophysical properties of methyl 4'-[(4-bromobenzo-yl)-oxy]biphenyl-4-carboxyl-ate: a compound with bromine⋯oxygen contacts.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 264-270
2023418 CIF
Paper
C20 H6 F8 N6 O6P -17.1461; 8.66; 9.28
90.742; 101.274; 113.887
512.2Kawasaki, Tadashi; Hori, Akiko
Polymorphism and Hirshfeld surface analysis of tetra-oxa[2]perfluoro-arene[2]triazine.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 289-295
2023419 CIF
Paper
C20 H6 F8 N6 O6P -17.1729; 9.7282; 16.307
104.42; 91.293; 99.274
1085.3Kawasaki, Tadashi; Hori, Akiko
Polymorphism and Hirshfeld surface analysis of tetra-oxa[2]perfluoro-arene[2]triazine.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 289-295
2023420 CIF
HKL
Paper
C16 H16 Cl N3 O3 SP -16.555; 10.14; 12.403
83.15; 89.65; 88.82
818.3Wójcicka, Anna; Bryndal, Iwona; Krupińska, Magdalena; Wolska, Aleksandra; Milewski, Jakub; Pyra, Anna; Becan, Lilianna; Mączyński, Marcin; Matera-Witkiewicz, Agnieszka
7-(4-Chlorophenyl)-1-hydroxy-5-methylpyrido[3,4-d]pyridazin-4(3H)-one: synthesis, solvatomorphism, in vitro anti-inflammatory and cytotoxic activity studies and in silico analysis.
Acta crystallographica. Section C, Structural chemistry, 2025, 81, 198-211
2023421 CIF
HKL
Paper
C34 H38 Cl2 N6 O7 S3C 1 2/c 126.379; 6.539; 22.02
90; 103.05; 90
3700.2Wójcicka, Anna; Bryndal, Iwona; Krupińska, Magdalena; Wolska, Aleksandra; Milewski, Jakub; Pyra, Anna; Becan, Lilianna; Mączyński, Marcin; Matera-Witkiewicz, Agnieszka
7-(4-Chlorophenyl)-1-hydroxy-5-methylpyrido[3,4-d]pyridazin-4(3H)-one: synthesis, solvatomorphism, in vitro anti-inflammatory and cytotoxic activity studies and in silico analysis.
Acta crystallographica. Section C, Structural chemistry, 2025, 81, 198-211
2023422 CIF
Paper
C20 H21 N3 O5 SP c a 219.2969; 14.0662; 15.1168
90; 90; 90
1976.85Mohamed-Ezzat, Reham A; Kariuki, Benson M.; Al-Ashmawy, Aisha A K; Srour, Aladdin M.
Synthesis and crystal structure of 5-{(<i>E</i>)-[(1<i>H</i>-indol-3-ylformamido)-imino]-meth-yl}-2-meth-oxy-phenyl propane-1-sulfonate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 310-313
2023423 CIF
Paper
C17 H15 N3 O7P 1 21/c 110.27958; 11.1877; 15.09983
90; 105.676; 90
1671.96Naghiyev, Farid N.; Hökelek, Tuncer; Khrustalev, Victor N.; Mamedov, Huseyn M.; Belay, Alebel N.; Ashurov, Jamshid; Mamedov, Ibrahim G.
Crystal structure and Hirshfeld surface analyses, inter-molecular inter-action energies and energy frameworks of methyl 6-amino-5-cyano-2-(2-meth-oxy-2-oxoeth-yl)-4-(4-nitro-phen-yl)-4<i>H</i>-pyran-3-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 296-302
2023424 CIF
Paper
C30 H30 N6 O12P 1 21/n 114.172; 15.902; 14.644
90; 110.46; 90
3092Asprilla-Herrera, Lina Maria; Techert, Simone; Velazquez-Garcia, Jose de Jesus
Synthesis and structure of tris-(2-methyl-1<i>H</i>-imidazol-3-ium) 5-carb-oxy-benzene-1,3-di-carboxyl-ate 3,5-di-carb-oxy-benzoate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 303-309
2023425 CIFCa H2 O6 Sn2A e a 25.8502; 15.1396; 5.4376
90; 90; 90
481.61Bogdan, Tatiana V.; Ivakin, Yurii D.; Chernyshev, Vladimir V.; Mashchenko, Nikolay V.; Koklin, Aleksey E.; Tararushkin, Evgeny V.; Fedoseev, Timofei V.; Skiba, Mariia A.; Bogdan, Viktor I.
A new crystal phase of calcium stannate CaSn2O4(OH)2 and its physico-chemical properties
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2025, 81
2023426 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.72432; 8.72432; 8.72432
90; 90; 90
664.041Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023427 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.72726; 8.72726; 8.72726
90; 90; 90
664.712Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023428 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.72976; 8.72976; 8.72976
90; 90; 90
665.284Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023429 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.73232; 8.73232; 8.73232
90; 90; 90
665.869Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023430 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.73626; 8.73626; 8.73626
90; 90; 90
666.771Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023431 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.73747; 8.73747; 8.73747
90; 90; 90
667.048Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023432 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.7365; 8.7365; 8.7365
90; 90; 90
666.826Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023433 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.73916; 8.73916; 8.73916
90; 90; 90
667.435Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023434 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74145; 8.74145; 8.74145
90; 90; 90
667.96Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023435 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74034; 8.74034; 8.74034
90; 90; 90
667.706Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023436 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74112; 8.74112; 8.74112
90; 90; 90
667.884Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023437 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74364; 8.74364; 8.74364
90; 90; 90
668.462Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023438 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74259; 8.74259; 8.74259
90; 90; 90
668.221Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023439 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74393; 8.74393; 8.74393
90; 90; 90
668.529Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023440 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74648; 8.74648; 8.74648
90; 90; 90
669.114Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023441 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.74867; 8.74867; 8.74867
90; 90; 90
669.616Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023442 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.75212; 8.75212; 8.75212
90; 90; 90
670.409Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023443 CIF
HKL
Paper
Ga5.1 Ge0.9 Mn0.72 Sm2F m -3 m8.75451; 8.75451; 8.75451
90; 90; 90
670.958Khalaniya, Roman A.; Mironov, Andrei V.; Kulchu, Aleksandr; Khrykina, Olga; Shevelkov, Andrei V.
Disorder- and magnetism-driven structural changes in Sm<sub>2</sub>Mn<sub>1-x</sub>Ga<sub>6-y</sub>Ge<sub>y</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 235-243
2023444 CIF
Paper
C16 H15 Br N2 O2C 1 2/c 134.6329; 4.84061; 19.1365
90; 109.86; 90
3017.33Shikhaliyev, Namiq Q.; Babazade, Aliyar A.; Atakishiyeva, Gulnar T.; Shikhaliyeva, Irada M.; Maharramov, Abel M.; Khrustalev, Victor N.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structures and Hirshfeld surface analyses of methyl (2<i>Z</i>)-(4-bromo-phen-yl)[2-(4-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-(4-bromophen-yl)[2-(3,5-di-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-[2-(4-meth-oxy-phen-yl)hydrazinyl-idene](3-nitro-phen-yl)acetate, methyl (2<i>E</i>)-(4-chlorophen-yl)(2-phenyl-hydrazinyl-idene)acetate and methyl (2<i>Z</i>)-[2-(4-bromo-phen-yl)hydrazinylidene](4-chloro-phen-yl)acetate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 314-323
2023445 CIF
Paper
C17 H17 Br N2 O2P -19.8859; 12.3021; 13.979
83.48; 73.266; 81.695
1606.4Shikhaliyev, Namiq Q.; Babazade, Aliyar A.; Atakishiyeva, Gulnar T.; Shikhaliyeva, Irada M.; Maharramov, Abel M.; Khrustalev, Victor N.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structures and Hirshfeld surface analyses of methyl (2<i>Z</i>)-(4-bromo-phen-yl)[2-(4-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-(4-bromophen-yl)[2-(3,5-di-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-[2-(4-meth-oxy-phen-yl)hydrazinyl-idene](3-nitro-phen-yl)acetate, methyl (2<i>E</i>)-(4-chlorophen-yl)(2-phenyl-hydrazinyl-idene)acetate and methyl (2<i>Z</i>)-[2-(4-bromo-phen-yl)hydrazinylidene](4-chloro-phen-yl)acetate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 314-323
2023446 CIF
Paper
C16 H15 N3 O5C 1 2/c 118.8022; 21.9649; 7.43092
90; 96.156; 90
3051.19Shikhaliyev, Namiq Q.; Babazade, Aliyar A.; Atakishiyeva, Gulnar T.; Shikhaliyeva, Irada M.; Maharramov, Abel M.; Khrustalev, Victor N.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structures and Hirshfeld surface analyses of methyl (2<i>Z</i>)-(4-bromo-phen-yl)[2-(4-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-(4-bromophen-yl)[2-(3,5-di-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-[2-(4-meth-oxy-phen-yl)hydrazinyl-idene](3-nitro-phen-yl)acetate, methyl (2<i>E</i>)-(4-chlorophen-yl)(2-phenyl-hydrazinyl-idene)acetate and methyl (2<i>Z</i>)-[2-(4-bromo-phen-yl)hydrazinylidene](4-chloro-phen-yl)acetate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 314-323
2023447 CIF
Paper
C15 H13 Cl N2 O2P b c a15.86326; 8.79608; 19.2468
90; 90; 90
2685.59Shikhaliyev, Namiq Q.; Babazade, Aliyar A.; Atakishiyeva, Gulnar T.; Shikhaliyeva, Irada M.; Maharramov, Abel M.; Khrustalev, Victor N.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structures and Hirshfeld surface analyses of methyl (2<i>Z</i>)-(4-bromo-phen-yl)[2-(4-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-(4-bromophen-yl)[2-(3,5-di-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-[2-(4-meth-oxy-phen-yl)hydrazinyl-idene](3-nitro-phen-yl)acetate, methyl (2<i>E</i>)-(4-chlorophen-yl)(2-phenyl-hydrazinyl-idene)acetate and methyl (2<i>Z</i>)-[2-(4-bromo-phen-yl)hydrazinylidene](4-chloro-phen-yl)acetate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 314-323
2023448 CIF
Paper
C15 H12 Br Cl N2 O2P c a 2114.0199; 16.594; 6.4471
90; 90; 90
1499.9Shikhaliyev, Namiq Q.; Babazade, Aliyar A.; Atakishiyeva, Gulnar T.; Shikhaliyeva, Irada M.; Maharramov, Abel M.; Khrustalev, Victor N.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structures and Hirshfeld surface analyses of methyl (2<i>Z</i>)-(4-bromo-phen-yl)[2-(4-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-(4-bromophen-yl)[2-(3,5-di-methyl-phen-yl)hydrazinyl-idene]acetate, methyl (2<i>Z</i>)-[2-(4-meth-oxy-phen-yl)hydrazinyl-idene](3-nitro-phen-yl)acetate, methyl (2<i>E</i>)-(4-chlorophen-yl)(2-phenyl-hydrazinyl-idene)acetate and methyl (2<i>Z</i>)-[2-(4-bromo-phen-yl)hydrazinylidene](4-chloro-phen-yl)acetate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 314-323
2023449 CIF
Paper
K2 Ni O12 P4C 1 c 111.07179; 12.50386; 7.53969
90; 103.235; 90
1016.07Thiam, El Waleda Moustapha; Ba, Kalidou Mamadou; Kane, Aichata Yaya; Thiam, Ibrahima Elhadji; Claiser, Nicolas; Souhassou, Mohamed; Barry, Aliou Hamady; Gaye, Mohamed
Synthesis and crystal structure of dipotassium nickel polyphosphate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 324-327
2023450 CIF
Paper
C14 H17 N3 O5 ZnC 1 2 118.3835; 7.7141; 13.38
90; 123.787; 90
1576.99Yoshizawa, Fumishi; Okui, Anna; Nakane, Daisuke; Akitsu, Takashiro
Crystal structure and Hirshfeld surface analysis of aqua-(1<i>H</i>-imidazole-κ<i>N</i> <sup>3</sup>)[<i>N</i>-(2-oxido-benzyl-idene)threonato-κ<sup>3</sup> <i>O</i>,<i>N</i>,<i>O</i>']zinc(II).
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 332-335
2023451 CIF
Paper
C13 H16 N4 SP 1 21/c 114.482; 9.385; 10.59
90; 108.07; 90
1368.3Salieva, Gulrukh; Kholikov, Tursunali; Okmanov, Rasul Ya; Matchanov, Alimjon; Khodjaniyazov, Khamid U.; Kadirova, Shakhnoza; Torambetov, Batirbay
Synthesis, crystal structure and Hirshfeld surface analysis of 2-[(2,4-di-methyl-benz-yl)sulfan-yl]pyrimidine-4,6-di-amine.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 328-331
2023452 CIF
Paper
C13 H15 Cl N4 O4C 1 2/c 132.1977; 4.6431; 26.4
90; 127.495; 90
3131.4Ummer, Muhammed Rafi; NizamMohideen, M.; Noorulla, Mohammed Nazrudeen; Moolan Khaja, Abubacker Sidhik
Synthesis, crystal structure, and <i>in silico</i> mol-ecular docking studies of 4-hy-droxy-3,5-di-meth-oxy-benzaldehyde (6-chloro-pyridazin-3-yl)hydrazone monohydrate.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 336-340
2023453 CIF
Paper
C69 H108 F2 N10 O14P 1 21 110.1248; 28.7263; 12.6378
90; 96.484; 90
3652.17Akiko, Asano; Sakata, Mizuki; Takuma, Kato; Doi, Mitsunobu
Fluorine-hydrogen inter-actions observed in a helix structure having an orn-free gramicidin S sequence incorporating 4-<i>trans</i>-fluoro-proline.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 345-349
2023454 CIF
Paper
C36 H30 Cd Cl4 S2P 1 21/n 19.2696; 17.6682; 21.4072
90; 99.801; 90
3454.84Artis, Rylan; Heyward, Elizabeth; Reyes, Naomi; Van Ostenbridge, Kaitlyn; Lynch, Will E.; Padgett, Clifford W.
Syntheses and crystal structures of three tri-phenyl-sulfonium halometallate salts of zinc, cadmium and mercury.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 358-363
2023455 CIF
Paper
C37 H34 Cl4 Hg O S2P 1 21/n 19.43577; 18.0709; 21.2467
90; 95.1778; 90
3608.05Artis, Rylan; Heyward, Elizabeth; Reyes, Naomi; Van Ostenbridge, Kaitlyn; Lynch, Will E.; Padgett, Clifford W.
Syntheses and crystal structures of three tri-phenyl-sulfonium halometallate salts of zinc, cadmium and mercury.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 358-363
2023456 CIF
Paper
C36 H30 Cl4 S2 ZnP 1 21/n 19.163; 17.5749; 21.1697
90; 99.322; 90
3364.12Artis, Rylan; Heyward, Elizabeth; Reyes, Naomi; Van Ostenbridge, Kaitlyn; Lynch, Will E.; Padgett, Clifford W.
Syntheses and crystal structures of three tri-phenyl-sulfonium halometallate salts of zinc, cadmium and mercury.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 358-363
2023457 CIF
Paper
C12 H10 F NP 1 21/n 17.5248; 15.1897; 17.1823
90; 99.176; 90
1938.8Yun-Deng, Wu; Hui, Wan; Yun, Xia; Jie, Ni; Jian, Li; Hui, Zhang; Xiang-Yang, Xu; Jun, Xie
Crystal structure of the possible sulindac impurity 2-(5-fluoro-2-methyl-1<i>H</i>-inden-3-yl)aceto-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 341-344
2023458 CIF
Paper
C11 H14 Br N3P 1 21/c 119.6908; 4.7431; 12.6482
90; 100.4; 90
1161.88Lerch, Timothy G.; Albert, Daniel R.; Gau, Michael; Rajaseelan, Edward
Syntheses and crystal structures of 4-benzyl-1-ethyl-1,2,4-triazolium bromide and its corresponding NHC complexes of rhodium and iridium.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 350-357
2023459 CIFC19 H25 Cl N3 RhP -110.1404; 10.2958; 10.3306
116.818; 103.489; 93.997
916.78Lerch, Timothy G.; Albert, Daniel R.; Gau, Michael; Rajaseelan, Edward
Syntheses and crystal structures of 4-benzyl-1-ethyl-1,2,4-triazolium bromide and its corresponding NHC complexes of rhodium and iridium.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 350-357
2023460 CIFC37 H40 B F4 Ir N3 PP 19.47197; 9.50712; 18.7104
79.8203; 86.1222; 89.3859
1654.57Lerch, Timothy G.; Albert, Daniel R.; Gau, Michael; Rajaseelan, Edward
Syntheses and crystal structures of 4-benzyl-1-ethyl-1,2,4-triazolium bromide and its corresponding NHC complexes of rhodium and iridium.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 350-357
2023461 CIFC38.5 H61 B Cl3 F4 Ir N3 PP 1 21/c 112.1281; 14.4399; 23.7057
90; 92.016; 90
4148.98Lerch, Timothy G.; Albert, Daniel R.; Gau, Michael; Rajaseelan, Edward
Syntheses and crystal structures of 4-benzyl-1-ethyl-1,2,4-triazolium bromide and its corresponding NHC complexes of rhodium and iridium.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 350-357
2023462 CIF
Paper
C21 H18 N2 O4P -16.3757; 7.7506; 17.9997
100.967; 97.373; 100.127
847.49Faraj, Imane; El Ghayati, Lhoussaine; Blacque, Olivier; Hökelek, Tuncer; Mazzah, Ahmed; Essassi, El Mokhtar; Sebbar, Nada Kheira
Synthesis and crystal structure of 2-(2,4-dioxo-6-methyl-pyran-3-yl-idene)-4-(4-hy-droxy-phen-yl)-2,3,4,5-tetra-hydro-1<i>H</i>-1,5-benzodiazepine.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 381-384
2023463 CIF
Paper
C11 H26 Cl5 Fe N2 OP 21 21 217.607; 11.587; 21.8705
90; 90; 90
1927.7Klotz, Franziska Dorothea; Alonso Felipe, Clara; Villafañe, Fernando; Strohmann, Carsten
Synthesis and crystal structure study of (<i>R</i>,<i>R</i>)-TMCDA ethanol derivatives doubly protonated with FeCl<sub>4</sub> <sup>-</sup> and Cl<sup>-</sup> as counter-ions.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 372-376
2023464 CIFC10 H24 Cl5 Fe N2P 1 21 110.2322; 9.2378; 10.7384
90; 116.797; 90
906.02Klotz, Franziska Dorothea; Alonso Felipe, Clara; Villafañe, Fernando; Strohmann, Carsten
Synthesis and crystal structure study of (<i>R</i>,<i>R</i>)-TMCDA ethanol derivatives doubly protonated with FeCl<sub>4</sub> <sup>-</sup> and Cl<sup>-</sup> as counter-ions.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 372-376
2023465 CIF
Paper
C15 H15 N3 O2P -18.3562; 9.2666; 9.9151
76.685; 65.316; 84.909
678.83Maheswari, Subramani Uma; Senthilkumar, Srinivasan; Selvanayagam, Sivashanmugam
Crystal structure, Hirshfeld surface analysis and DFT studies of 4-amino-<i>N</i>'-[(1<i>E</i>)-1-(3-hy-droxyphen-yl)ethyl-idene]benzohydrazide.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 389-392
2023466 CIF
Paper
Ba Na2 O8 Si2 ZrP -35.3966; 5.3966; 7.2153
90; 90; 120
181.981Yamane, Hisanori; Funahashi, Shiro; Hirosaki, Naoto; Takeda, Takashi
Orthosilicates with glaserite-type crystal structures: Na<sub>2</sub>BaZr[SiO<sub>4</sub>]<sub>2</sub> and Na<sub>2</sub>BaHf[SiO<sub>4</sub>]<sub>2</sub>.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 368-371
2023467 CIF
Paper
Ba Hf Na2 O8 Si2P -35.3889; 5.3889; 7.1996
90; 90; 120
181.067Yamane, Hisanori; Funahashi, Shiro; Hirosaki, Naoto; Takeda, Takashi
Orthosilicates with glaserite-type crystal structures: Na<sub>2</sub>BaZr[SiO<sub>4</sub>]<sub>2</sub> and Na<sub>2</sub>BaHf[SiO<sub>4</sub>]<sub>2</sub>.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 368-371
2023468 CIF
Paper
C20 H14 Br Cl O3P 21 21 218.8347; 9.4124; 20.5526
90; 90; 90
1709.07Palakshamurthy, B. S.; Anil Kumar, H.; Devarajegowda, H. C.; Srinivasa, H. T.; Harish Kumar, M.
Synthesis and structure of 4-bromo-2-chloro-phenyl 4'-meth-oxy-[1,1'-biphen-yl]-4-carboxyl-ate featuring short halogen⋯oxygen contacts.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 364-367
2023469 CIF
Paper
C60 H50 N16 Ni2 O19 S2P -19.5384; 10.1543; 16.2521
81.511; 75.79; 75.92
1473.62Li, Yi; Xie, Wang; Lin, Chen
An Ni-based coordination polymer with a bamboo-like crystal structure.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 377-380
2023470 CIF
Paper
C17 H22 Cl N3 OP 1 21/c 121.1989; 9.5096; 17.633
90; 110.483; 90
3329.95Mohan Kumar, Thaluru M.; Sowbhagya, Chaluvarangaiah; Yathirajan, Hemmige S.; Parkin, Sean
Crystal structure and Hirshfeld surface analysis of the fungicide metconazole.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 385-388
2023471 CIF
Paper
C44 H55.4 Cd4 Cl8 N12 O5.7P 1 21/n 111.0702; 13.5058; 19.07
90; 102.006; 90
2788.82Stoeckli-Evans, Helen; Shankar, M. G.; Kumaravel, R.; Subashini, A.; Sabari Girisun, T.; Ramamurthi, K.; Kučeráková, Monika; Dušek, Michal; Crochet, Aurélien
Di-μ<sub>3</sub>-chlorido-1:2:3κ<sup>3</sup> <i>Cl</i>;2:3:4κ<sup>3</sup> <i>Cl</i>-di-μ<sub>2</sub>-chlorido-1:2κ<sup>2</sup> <i>Cl</i>;3:4κ<sup>2</sup> <i>Cl</i>-tetra-kis-[(4-amino-1,5-dimethyl-2-phenyl-2,3-di-hydro-1<i>H</i>-pyrazol-3-one-κ<sup>2</sup> <i>N</i> <sup>4</sup>,<i>O</i>)chlorido-cadmium(II)] 1.7-hydrate: a new six-coordinate geometry index, τ<sub>6</sub>.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 393-400
2023472 CIF
Paper
C10 H12 O3P 1 21 16.4819; 7.4766; 9.0627
90; 99.546; 90
433.12König, Julien A; Morgenstern, Bernd; Jauch, Johann
Synthesis and crystal structure analysis of substituted bi-cyclo-[3.3.1]nona-nones.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 405-411
2023473 CIF
Paper
C12 H20 O4P -17.733; 10.976; 13.874
101.984; 92.032; 90.293
1151.1König, Julien A; Morgenstern, Bernd; Jauch, Johann
Synthesis and crystal structure analysis of substituted bi-cyclo-[3.3.1]nona-nones.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 405-411
2023474 CIF
Paper
C22 H32 O3P 1 21/n 114.1871; 6.3306; 22.4159
90; 101.702; 90
1971.39König, Julien A; Morgenstern, Bernd; Jauch, Johann
Synthesis and crystal structure analysis of substituted bi-cyclo-[3.3.1]nona-nones.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 405-411
2023475 CIF
Paper
C26 H42 O3P 1 21/c 115.1165; 13.9068; 12.815
90; 113.218; 90
2475.81König, Julien A; Morgenstern, Bernd; Jauch, Johann
Synthesis and crystal structure analysis of substituted bi-cyclo-[3.3.1]nona-nones.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 405-411
2023476 CIF
Paper
C12 H28 B F N2P -16.3603; 7.644; 16.4098
84.334; 84.82; 67.518
732.38Lenz, Tabea; Hebenbrock, Marian
Crystal structure of bis-(diiso-propyl-amino)-fluoro-borane.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 401-404
2023477 CIF
Paper
C18 H14 N2 O2P -111.3526; 12.0162; 13.3087
97.08; 114.406; 107.335
1513.47El Moutaouakil Ala Allah, Abderrazzak; Massera, Chiara; Guerrab, Walid; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 5,5-diphenyl-3-(prop-2-yn-1-yl)imidazolidine-2,4-dione.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 412-416
2023478 CIF
Paper
C14 H18 Co N4 O2 S2P 1 21/c 110.1901; 12.2379; 7.6165
90; 103.379; 90
924.04Näther, Christian; Boeckmann, Jan
Synthesis, crystal structure and thermal properties of di-aqua-bis-(4-methyl-pyridine-κ<i>N</i>)bis-(thio-cyanato-κ<i>N</i>)cobalt(II).
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 420-424
2023479 CIF
Paper
C19 H24 N2 O SP -17.9057; 10.1929; 12.2794
83.238; 89.201; 71.122
929.45Jayadevan, Sarayu; Sujith, K. V.; Biju, A. R.
Crystal structure, Hirshfeld surface analysis and DFT studies of 2-[4-(2-methyl-prop-yl)phen-yl]-<i>N</i>'-[(1<i>Z</i>)-1-(thio-phen-2-yl)ethyl-idene]propane-hydrazide.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 417-419
2023480 CIF
Paper
C19 H24 N2 O6I 1 2/a 120.3154; 6.6466; 28.077
90; 96.389; 90
3767.6Shaposhnyk, Anna M.; Rudiuk, Vitalii V.; Baumer, Vyacheslav N.
Crystal structure and Hirshfeld surface analysis of ketorolac tromethamine.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 433-437
2023481 CIF
Paper
C24 H14 Cl8 Cu2 N4 O11P 1 21/n 110.975; 6.7837; 21.803
90; 90.222; 90
1623.2Kumagai, Hitoshi; Kawata, Satoshi; Ogihara, Nobuhiro
Crystal structure of poly[[aqua-(μ<sub>2</sub>-pyrazine-κ<sup>2</sup> <i>N</i>:<i>N</i>')(μ<sub>2</sub>-2,3,5,6-tetra-chloro-benzene-1,4-di-car-boxyl-ato-κ<sup>2</sup> <i>O</i> <sup>1</sup>:<i>O</i> <sup>4</sup>)copper(II)] hemihydrate].
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 429-432
2023482 CIF
Paper
C30 H28 N2 O4P b c a11.26039; 12.26667; 33.0963
90; 90; 90
4571.51Jiang, Christina Yu; Staples, Richard J.; Biros, Shannon M.
Crystal structure of a bis-4-aza-tetra-cyclo[5.3.2.0<sup>2,6</sup>.0<sup>8,10</sup>]dodec-11-ene-3,5-dione compound.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 425-428
2023483 CIF
Paper
C36 H54 N8 O6R 3 2 :H14.5942; 14.5942; 15.4565
90; 90; 120
2851.03Baisch, Ulrich; Scicluna, Marie Christine; Vella-Zarb, Liana
Rapid and facile one-step microwave synthesis of macrobicyclic cryptands.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 448-451
2023484 CIF
Paper
C13 H17 Cl2 F O3P 21 21 2110.5608; 10.8048; 12.8872
90; 90; 90
1470.52Guseynova, Saadet N.; Samigullina, Aida I.; Demir, Cemile Baydere; Dege, Necmi; Sepay, Nayim; Zangrando, Ennio; Hasanov, Khudayar I.; Belay, Alebel N.
Synthesis, crystal structure and Hirshfeld surface analysis of 2,2-di-chloro-3,3-dieth-oxy-1-(4-fluoro-phen-yl)propan-1-ol.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 444-447
2023485 CIF
Paper
C22 H22 N6 O2C 1 2/c 120.2393; 10.6519; 19.4225
90; 106.614; 90
4012.4Kumaravel, R.; Stoeckli-Evans, Helen; Subashini, A.; Shankar, M. G.; Kučeráková, Monika; Dušek, Michal; Crochet, Aurélien; Ramamurthi, K.
Structure of (<i>E</i>)-4-amino-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-di-hydro-1<i>H</i>-pyrazol-4-yl)imino]-meth-yl}-1-methyl-2-phenyl-2,3-di-hydro-1<i>H</i>-pyrazol-3-one: aerial oxidation of 4-amino-anti-pyrine in di-methyl-formamide.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 438-443
2023486 CIF
Paper
C18 H20 N4 O6P 1 21/n 16.6576; 17.1463; 15.8105
90; 98.935; 90
1782.92Aboutofil, Fatima Ezzahra; Mustaphi, Nour El Hoda; Blacque, Olivier; Hökelek, Tuncer; Mazzah, Ahmed; El Ghayati, Lhoussaine; Sebbar, Nada Kheira
Synthesis and crystal structure of 3-(2-{3-[2-(2-oxooxazolidin-3-yl)ethoxy]quinoxalin-2-yloxy}ethyl)oxazolidin-2-one
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023487 CIF
Paper
C102 H120 Cl4 O12C 1 2/c 138.722; 10.4622; 23.891
90; 106.978; 90
9256.8Vinodh, Mickey; Abdeljaber, Nour O.; Alipour, Fatemeh H.; Al-Azemi, Talal F.
Crystal structures and supramolecular interactions of prism[6]arene-based host–guest systems with dihalohexanes
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023488 CIF
Paper
C102 H120 I4 O12C 1 2/c 138.728; 10.5427; 24.0234
90; 106.814; 90
9389.4Vinodh, Mickey; Abdeljaber, Nour O.; Alipour, Fatemeh H.; Al-Azemi, Talal F.
Crystal structures and supramolecular interactions of prism[6]arene-based host–guest systems with dihalohexanes
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023489 CIF
Paper
C16 H34 Cl2 Cu N6 O4P 1 21/c 110.0036; 15.8231; 6.9325
90; 99.808; 90
1081.29Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Stoica, Alexandru-Constantin; Lampeka, Yaroslaw D.
Synthesis and structural characterization of the dichloride complex formed by carboxy-functionalized Cu(diazacyclam)2+ cation and its heterometallic coordination polymer with CdCl2
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023490 CIF
Paper
C16 H36.5 Cd Cl2 Cu N6 O6.25P -110.1565; 10.4249; 14.6531
80.305; 80.117; 64.149
1367.82Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Stoica, Alexandru-Constantin; Lampeka, Yaroslaw D.
Synthesis and structural characterization of the dichloride complex formed by carboxy-functionalized Cu(diazacyclam)2+ cation and its heterometallic coordination polymer with CdCl2
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023491 CIF
Paper
C20 H22 N4 O S2P -110.6654; 13.5974; 15.7917
109.206; 101.687; 107.789
1938.8Moussaif, Ahmed; El Ghayati, Lhoussaine; Kalonji Mubengayi, Camille; Alsubari, Abdulsalam; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 1,1′-[oxybis(ethane-2,1-diyl)]bis(2-methylsulfanyl-1H-benzo[d]imidazole)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023492 CIF
Paper
C28 H24 Cd N10 O10C 1 2/c 115.9012; 11.0897; 18.9475
90; 109.182; 90
3155.69Razzoqova, Surayyo; Ruzimov, Yodgor; Toshov, Akobir; Torambetov, Batirbay; Ibragimov, Aziz; Ashurov, Jamshid; Kadirova, Shakhnoza
Synthesis, crystal structure and Hirshfeld surface analysis of a coordination compound of cadmium nitrate with 2-aminobenzoxazole
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023493 CIF
Paper
C20 H14 N4 O4P 1 21/c 116.429; 8.05961; 13.72324
90; 106.758; 90
1739.94Näther, Christian; Businski, Artjom; Herges, Rainer
Reversible phase transition in 8,19-dimethyl-2,3,8,19-tetraazapentacyclo[13.7.0.04,12.06,10.017,21]docosa-1(15),2,4(12),5,10,16,21-heptaene-7,9,18,20-tetrone
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023494 CIF
Paper
C20 H14 N4 O4P -17.9465; 13.7201; 16.2592
106.993; 90.914; 90.1121
1695.04Näther, Christian; Businski, Artjom; Herges, Rainer
Reversible phase transition in 8,19-dimethyl-2,3,8,19-tetraazapentacyclo[13.7.0.04,12.06,10.017,21]docosa-1(15),2,4(12),5,10,16,21-heptaene-7,9,18,20-tetrone
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023495 CIF
Paper
C13 H15 N3 O4P 1 21/c 113.9944; 11.0371; 9.056
90; 99.936; 90
1377.79Maheswari, Subramani Uma; Senthilkumar, Srinivasan; Selvanayagam, Sivashanmugam
Crystal structure and Hirshfeld surface analysis of (E)-2-cyano-N′-(3,4,5-trimethoxybenzylidene)acetohydrazide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023496 CIF
Paper
C34 H42 Cd2 N26 O30 S4P -110.5367; 10.9088; 14.1593
92.782; 109.796; 104.077
1469.98Santhakumaria, R.; Ramamurthi, K.; Kaur, Manpreet; Jasinski, Jerry P.; Sagadevane, Suresh; Stoeckli-Evans, Helen
Bis(μ-thiosemicarbazide-κ3 N 1,S:S;κ3 S:N 1,S)bis[(dimethylformamide-κO)(thiosemicarbazide-κ2 N 1,S)cadmium(II)] tetrakis(2,4,6-trinitrophenolate): synthesis, crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023497 CIF
Paper
C11 H11 F O S2P -17.6956; 8.6895; 8.9468
74.633; 83.237; 73.008
551.18Mohan Kumar, Thaluru M.; Bhaskar, Besagarahally L.; Bhavya, Papegowda; Divakara, Thayamma R.; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean
Crystal structure and Hirshfeld-surface analysis of 1-(4-fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023498 CIF
Paper
C17 H20 N2 O8P 1 21/c 111.5409; 10.9018; 14.3799
90; 103.427; 90
1759.78Lo, Mamadou; Sene, Bineta; Pouye, Adji Fatou Fall; Lee, Arie van der; Gassama, Abdoulaye; Richeter, Sébastien
Synthesis and structure of (E)-3,4,5-trihydroxy-N′-(3,4,5-trimethoxybenzylidene)benzohydrazide monohydrate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023499 CIF
Paper
C15 H12 Cl3 N O2P 1 21/c 115.1487; 9.2389; 10.8661
90; 94.242; 90
1516.62Keydel, Tobias; Bandaru, Siva S. M.; Schulig, Lukas; Link, Andreas; Schulzke, Carola
Crystal structure of chloromethyl 2-[2-(2,6-dichlorophenylamino)phenyl]acetate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023500 CIF
Paper
C44 H33 F6 I P2 PdP 1 21/c 112.4498; 14.5714; 22.1464
90; 97.726; 90
3981.1Bosch, Eric
Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023501 CIF
Paper
C46 H41 I N2 O6 P2 PdP 1 21/c 111.7692; 34.87; 10.4381
90; 99.92; 90
4219.7Bosch, Eric
Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023502 CIF
Paper
C42 H32 F3 I P2 PdI 1 2/a 111.6327; 12.8059; 23.4327
90; 93.218; 90
3485.2Bosch, Eric
Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023503 CIF
Paper
C44 H34 Cl4 F3 I3 P2 PdP -111.5608; 11.6437; 18.1311
76.426; 77.722; 81.344
2305.16Bosch, Eric
Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023504 CIF
Paper
C19 H19 N O4P 21 21 214.8393; 12.4928; 27.3101
90; 90; 90
1651.07Abubakar Magaji, Mubarak; Chen, Beining; Robertson, Craig Collumbine
Synthesis, crystal structure and Hirshfeld surface analysis of Fmoc-β-amino butyric acid and Fmoc carbamate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023505 CIF
Paper
C15 H13 N O2P c a 2115.356; 5.04; 31.0254
90; 90; 90
2401.19Abubakar Magaji, Mubarak; Chen, Beining; Robertson, Craig Collumbine
Synthesis, crystal structure and Hirshfeld surface analysis of Fmoc-β-amino butyric acid and Fmoc carbamate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023506 CIF
Paper
C18 H18 O2 S2P 1 21/c 15.1639; 11.1078; 14.8132
90; 92.868; 90
848.61O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.
Some thioether-ketones and their related derivatives
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023507 CIF
Paper
C16 H14 O2 SI 1 2/a 113.1307; 5.0945; 19.2847
90; 93.167; 90
1288.07O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.
Some thioether-ketones and their related derivatives
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023508 CIF
Paper
C30 H32 N6 S2P 1 21/n 15.3442; 24.9746; 10.3552
90; 99.789; 90
1361.98O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.
Some thioether-ketones and their related derivatives
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023509 CIF
Paper
C10 H18 N4 S3P 1 21/c 19.1219; 8.6565; 17.7935
90; 92.195; 90
1404.01O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.
Some thioether-ketones and their related derivatives
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023510 CIF
Paper
C18 H16 N6I 1 2/a 134.4957; 10.4262; 37.9992
90; 115.604; 90
12324.7O'Connor, Molly A.; Pavlishchuk, Anna V.; Butcher, Raymond J.; Pavlishchuk, Vitaly V.; Addison, Anthony W.
Some thioether-ketones and their related derivatives
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023511 CIF
Paper
C39 H30 O SP 1 21/n 110.2352; 14.3939; 19.12
90; 98.121; 90
2788.6Wen, Yuewei; Thamattoor, Dasan M.
Synthesis and structure of 1′,4′-diphenyl-1a,1′,4′,4′′,5′′,9b-hexahydro-2′′H-dispiro[cyclopropa[l]phenanthrene-1,2′-[1,4]epoxynaphthalene-3′,3′′-thiophene]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023512 CIF
Paper
C10 H9 Cl2 F N2 O3P 1 21/c 115.6136; 7.2214; 10.7929
90; 104.622; 90
1177.51Guseinov, Firudin I.; Hökelek, Tuncer; Afanaseva, Ksenia A.; Shuvalova, Elena V.; Glukhov, Lev M.; Samigullina, Aida I.; Belay, Alebel N.
Syntheses and structures of 1-[2,2-dichloro-1-hydroxy-3-(4-methylphenyl)-3-oxopropyl]urea and 1-[2,2-dichloro-3-(4-fluorophenyl)-1-hydroxy-3-oxopropyl]urea
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023513 CIF
Paper
C11 H12 Cl2 N2 O3P 1 21/c 112.62183; 8.77585; 11.5993
90; 94.8294; 90
1280.26Guseinov, Firudin I.; Hökelek, Tuncer; Afanaseva, Ksenia A.; Shuvalova, Elena V.; Glukhov, Lev M.; Samigullina, Aida I.; Belay, Alebel N.
Syntheses and structures of 1-[2,2-dichloro-1-hydroxy-3-(4-methylphenyl)-3-oxopropyl]urea and 1-[2,2-dichloro-3-(4-fluorophenyl)-1-hydroxy-3-oxopropyl]urea
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023514 CIF
Paper
C36 H36 Ni S4P 1 21/c 18.4446; 14.0911; 13.588
90; 96.133; 90
1607.63Das Gupta, Titir; Guite, Jackson; Hirt, LiWen; Zhang, Xiaodong; Donahue, James P.
Bis[1,2-bis(3,5-dimethylphenyl)ethylene-1,2-dithiolato(1−)]nickel(II)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023515 CIF
Paper
C11 H10 F N3 O3P 1 21/c 14.2126; 9.6687; 26.8628
90; 94.186; 90
1091.21Sangavi, Marimuthu; Mohana, Marimuthu; Butcher, Ray J.; McMillen, Colin D.
Crystal engineering of a 1:1 5-fluorocytosine–4-hydroxybenzaldehyde cocrystal: insights from X-ray crystallography and Hirshfeld analysis
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023516 CIF
Paper
C29 H22 F3 N O7 SP 1 21/c 17.6375; 11.0324; 30.2019
90; 93.983; 90
2538.7Burkin, Gleb M.; Annadurdyyeva, Selbi; Kutasevich, Alexandra G.; Guliyeva, Narmina A.; Hasanov, Khudayar I.; Akkurt, Mehmet; Manahelohe, Gizachew Mulugeta
Crystal structure and Hirshfeld surface analysis of dimethyl 3-methyl-8-{[4-(trifluoromethyl)phenyl]sulfonyl}-7,8-dihydro-4H-4,6a-epoxybenzo[b]naphtho[1,8-de]azepine-5,6-dicarboxylate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023517 CIF
Paper
C44 H30 OP 1 21/n 112.9873; 13.2021; 17.91
90; 95.796; 90
3055.14Roth, Alexander D.; Thamattoor, Dasan M.
Crystal structure, computational study, and Hirshfeld analysis of exo-1,2,3,5-tetraphenyl-1a',9b'-dihydrospiro[bicyclo[3.1.0]hexane-6,1′-cyclopropa[l]phenanthren]-2-en-4-one
Acta Crystallographica Section E Crystallographic Communications, 2025, 81, 554-558
2023518 CIF
Paper
C42 H52 N10 O17 Zn2C 1 2/c 125.577; 18.632; 22.463
90; 94.335; 90
10674Kummuang, Chanikarn; Chainok, Kittipong; Wannarit, Nanthawat
Crystal structure and characterization of a new chain-like polyrotaxane zinc(II) coordination polymer with mixed pyridine-2,6-dicarboxylate and 1,4-bis(1H-imidazol-1-ylmethyl)benzene ligands
Acta Crystallographica Section E Crystallographic Communications, 2025, 81, 559-564
2023519 CIF
HKL
Paper
B2 Ca F8 H8 O4P -15.5192; 7.6756; 11.6518
77.439; 89.579; 88.625
481.65Armel Le Bail
Ca(BF~4~)~2~.<i>x</i>H~2~O redefined from powder diffraction as hydrogen-bonded Ca(H~2~O)~4~(BF~4~)~2~ ribbons
Acta Crystallographica, Section C, 2025, 81, 338-341
2023520 CIF
Paper
C12 H18 N8 O10 SrC 1 2 124.9533; 4.6575; 8.1543
90; 105.695; 90
912.36Marimuthu, Sathish; Balakrishnan, Thangavelu; Percino, M. Judith; Venkatesan, Perumal
Synthesis and crystal structure of catena-poly[[bis(nitrato-κ2 O,O′)strontium(II)]-di-μ-L-histidine-κ3 O,O′:O;κ2 O:O′]
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023521 CIF
Paper
C10 H12 N4 OP -14.853; 7.3504; 29.862
93.584; 90.385; 99.905
1047.13El Moutaouakil Ala Allah, Abderrazzak; Kariuki, Benson M.; Al-Sulami, Ahlam I.; Basha, Maram T.; Allehyani, Basmah H.; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 2-azido-N-(2,6-dimethylphenyl)acetamide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023522 CIF
Paper
C23 H22 O4P -18.5327; 11.0216; 11.4369
111.817; 96.977; 99.925
963.1Kavitha, Manivel; Jayakodi, Chandiran; Meenambigai, Ganesan; Janarthanan, Sekar; Pazhamalai, Srinivasan; Selvanayagam, Sivashanmugam
Crystal structures and Hirshfeld surface analyses of diphenylmethyl 2-(3,5-dimethoxyphenyl)acetate and diphenylmethyl 2-(3,4,5-trimethoxyphenyl)acetate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023523 CIF
Paper
C24 H24 O5P 1 21/n 117.229; 5.5037; 22.114
90; 92.256; 90
2095.3Kavitha, Manivel; Jayakodi, Chandiran; Meenambigai, Ganesan; Janarthanan, Sekar; Pazhamalai, Srinivasan; Selvanayagam, Sivashanmugam
Crystal structures and Hirshfeld surface analyses of diphenylmethyl 2-(3,5-dimethoxyphenyl)acetate and diphenylmethyl 2-(3,4,5-trimethoxyphenyl)acetate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023524 CIF
Paper
C16 H17 B F2 N2 O SiC 1 2/c 119.2621; 7.20455; 23.1309
90; 92.2617; 90
3207.48Shchevnikov, Dmitriy M.; Kutasevich, Alexandra G.; Khrustalev, Victor N.; Guliyeva, Narmina A.; Hasanov, Khudayar I.; Akkurt, Mehmet; Manahelohe, Gizachew Mulugeta
Crystal structure and Hirshfeld surface analysis of 5,5-difluoro-10-[5-(trimethylsilyl)furan-2-yl]-5H-4λ4,5λ4-dipyrrolo[1,2-c:2′,1′-f][1,3,2]diazaborinine
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023525 CIF
Paper
C34 H36 N8 O4 S2 Zn2P 1 21/c 110.8384; 20.0381; 8.2914
90; 91.342; 90
1800.24Parry, Christian S.; Abraham, Alex R.; Kwofie, Samuel K.; Wilson, Michael D.; Ramadhar, Timothy R.; Butcher, Raymond J.
Syntheses and structures of dinuclear zinc(II) acetate-bridged coordination compounds with the aromatic Schiff base chelators N,N-dimethyl-2-[phenyl(pyridin-2-yl)methylidene]hydrazine-1-carbothioamide and N-ethyl-2-[phenyl(pyridin-2-yl)methylidene]hydrazine-1-carbothioamide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023526 CIF
Paper
C36 H40 N8 O4 S2 Zn2P -19.328; 9.9979; 10.5761
67.101; 83.267; 87.15
902.33Parry, Christian S.; Abraham, Alex R.; Kwofie, Samuel K.; Wilson, Michael D.; Ramadhar, Timothy R.; Butcher, Raymond J.
Syntheses and structures of dinuclear zinc(II) acetate-bridged coordination compounds with the aromatic Schiff base chelators N,N-dimethyl-2-[phenyl(pyridin-2-yl)methylidene]hydrazine-1-carbothioamide and N-ethyl-2-[phenyl(pyridin-2-yl)methylidene]hydrazine-1-carbothioamide
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023527 CIF
Paper
C15 H19 N5 O SP 1 21/c 19.728; 19.9593; 8.0087
90; 93.23; 90
1552.5Nizamuddin, Syed; Prasad, T. N. Mahadeva; Sreenatha, N. R.; Sharath, C. L.; Lakshminarayana, B. N.; Vishnumurthy, K. A.
X-ray structural insights and computational analysis of the compound 5-ethyl-4-[(4-morpholinobenzylidene)amino]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023528 CIF
Paper
C19 H15 N OP 1 21/c 17.447; 20.916; 8.446
90; 93.347; 90
1313.3Eltayeb, Naser E.; Hökelek, Tuncer; Lasri, Jamal
Crystal structure and Hirshfeld surface analyses, crystal voids, interaction energy calculations and energy frameworks of (E)-2-[(pyren-1-ylmethylidene)amino]ethanol
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023529 CIF
Paper
C8 H12 Cl N3 O3P -18.581; 11.1448; 11.5757
98.662; 93.164; 103.444
1059.71Mohan Kumar, Thaluru M.; Bhavya, Papegowda; Bhaskar, Besagarahally L.; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean
Crystal structure and Hirshfeld surface analysis of 1-[2-(2-chloroethoxy)ethyl]-2-methyl-4-nitro-1H-imidazole
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023530 CIF
Paper
C21 H24 N6 O6P -18.8634; 10.3453; 11.6777
74.199; 79.749; 87.58
1013.85Łukaszczyk, Weronika; Lohse, Allegra; Leibing, Julia; Yildizbas, Sudem; Rizvanovic, Irwana; Techert, Simone; Velazquez-Garcia, Jose de Jesus
Crystal structure of tris(2-methyl-1H-imidazol-3-ium) benzene-1,3,5-tricarboxylate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023531 CIF
Paper
C23 H23 Cl N4 PtP -17.7053; 9.701; 15.0316
104.535; 95.922; 90.227
1081.31Repina, Olga V.; Nevskaya, Elena Yu.; Kritchenkov, Ilya S.; Khrustalev, Victor N.; Novikov, Alexander S.; Tskhovrebov, Alexander G.; Shikhaliyev, Namiq Q.; Niyazova, Aytan A.; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of chlorido(2,6-dimethylphenyl isocyanide)[N′-(2,6-dimethylphenyl)-N-(pyridin-2-yl)carbamimidoyl]platinum(II)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023532 CIF
Paper
C20 H24 Cl2 Cu N8 O12 S4P -16.31; 9.8179; 13.3493
90.522; 98.818; 99.478
805.57Khojabaeva, Gulnaz; Torambetov, Batirbay; Gonnade, Rajesh G.; Uzakbergenova, Zamira; Rasulov, Abdusamat; Kadirova, Shakhnoza
Synthesis, crystal structure and Hirshfeld surface analysis of bis[2-amino-5-(ethylsulfanyl)-1,3,4-thiadiazol-3-ium] bis(perchlorato-κO)bis(picolinato-κ2 N,O)copper(II)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023533 CIF
Paper
C6 H5 N3 S3P 1 21/c 110.6463; 7.7151; 11.1774
90; 103.272; 90
893.56Kinshakova, Ekaterina; Torambetov, Batirbay; Bharty, Manoj K.; Atashov, Aziz; Rasulov, Abdusamat; Kadirova, Shakhnoza; Gonnade, Rajesh G.
Synthesis, crystal structure and Hirshfeld surface analysis of 5-methyl-2-[(1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazole
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023534 CIF
Paper
C12 H28 Au Br5 N2C 1 2/c 112.6882; 18.853; 9.3914
90; 102.806; 90
2190.6Döring, Cindy; Jones, Peter G.
Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023535 CIF
Paper
C12 H28 Au Cl5 N2P 1 21/n 111.9196; 8.5545; 19.9052
90; 102.955; 90
1978Döring, Cindy; Jones, Peter G.
Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023536 CIF
Paper
C12 H28 Au Cl5 N2P 1 2/c 118.7771; 10.6891; 20.5603
90; 99.284; 90
4072.6Döring, Cindy; Jones, Peter G.
Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023537 CIF
Paper
C12 H28 Au Cl5 N2P -114.4553; 15.1302; 24.3885
90.797; 98.137; 106.407
5057.2Döring, Cindy; Jones, Peter G.
Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023538 CIF
Paper
C36 H84 Au4 Cl19 I N6P -19.5362; 13.4772; 13.7179
98.422; 108.961; 96.954
1622.37Döring, Cindy; Jones, Peter G.
Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023539 CIF
Paper
C18 H12 F2 N2 OC 1 2/c 132.9033; 6.02694; 7.14998
90; 95.5021; 90
1411.35Lauer, Moira K.; Balaich, Gary J.; Iacono, Scott T.; Weeks, Nathan J.
Molecular and crystal structure of 2,5-bis[(4-fluorophenyl)iminomethyl]furan
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023540 CIF
Paper
C24 H28 La N11 O13C 1 2/c 120.9094; 9.0361; 19.3753
90; 122.36; 90
3092.2Halushchenko, Valeriia; Korovin, Oleksandr; Rusakova, Natalya; Dyakonenko, Viktoriya; Khomenko, Dmytro; Lampeka, Rostyslav; Smola, Serhii
Crystal structure and supramolecular features of bis{ethyl 2-[1-methyl-3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetate}trinitratolanthanum(III)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023541 CIF
Paper
C26 H16 N4 S4 ZnC 1 2/c 119.9559; 9.8232; 14.0704
90; 118.642; 90
2420.7Abdullayeva, Gulchekhra; Torambetov, Batirbay; Kadirova, Shakhnoza; Daminova, Shahlo
Synthesis and crystal structure analysis of bis(benzothiazole-2-thiolato-κS)(1,10-phenanthroline-κ2 N,N′)zinc(II)
Acta Crystallographica Section E Crystallographic Communications, 2025, 81
2023542 CIF
Paper
C19 H14 N2 O3P b c a7.781; 15.6978; 25.966
90; 90; 90
3171.6El-Mrabet, Ayoub; Haoudi, Amal; Capet, Frederic; Hökelek, Tuncer; Ahmed, Mazzah
Crystal structure and Hirshfeld surface analyses, interaction energy calculations and energy frameworks of methyl 2-[(4-cyanophenyl)methoxy]quinoline-4-carboxylate
Acta Crystallographica Section E Crystallographic Communications, 2025, 81, 650-656
2023543 CIF
HKL
Paper
C26 H28 F N3 O6P 21 21 217.1788; 13.0274; 25.979
90; 90; 90
2429.6Patel, Bhumi C.; Modi, Krunal M.; Reddy, J. Prakasha
Crystal structure and Hirshfeld surface analysis of anhydrous salt of levofloxacin and 4-methylbenzoic acid
Acta Crystallographica Section E Crystallographic Communications, 2025, 81, 1149-1152
2023544 CIF
Paper
C13 H18 N2 OP 1 21/n 19.0478; 11.668; 11.3885
90; 91.523; 90
1201.86Naeem, Marilyn; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Syntheses and structures of two norpsilocin derivatives: N-ethyl-4-hydroxytryptamine (4-HO-NET) and 4-hydroxy-N-propyltryptamine (4-HO-NPT)
Acta Crystallographica Section E Crystallographic Communications, 2026, 82, 1082-1086
2023545 CIF
Paper
C12 H16 N2 OP 1 21/c 18.3887; 9.0776; 14.5657
90; 100.132; 90
1091.87Naeem, Marilyn; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Syntheses and structures of two norpsilocin derivatives: N-ethyl-4-hydroxytryptamine (4-HO-NET) and 4-hydroxy-N-propyltryptamine (4-HO-NPT)
Acta Crystallographica Section E Crystallographic Communications, 2026, 82, 1082-1086
2023546 CIF
Paper
C15 H15 N O2P -110.1536; 10.276; 13.5207
103.632; 107.867; 100.974
1251.14Sridharan, Makuteswaran; Thiruvalluvar, Aravazhi Amalan
Synthesis and structure of (Z)-2-(ethoxymethylidene)-2,3,4,9-tetrahydro-1H-carbazol-1-one
Acta Crystallographica Section E Crystallographic Communications, 2026, 82, 1004-1007
2023547 CIF
Paper
C26 H20 N4 O5 ZnC 1 2/c 151.1233; 6.1213; 7.2534
90; 90.788; 90
2269.67Huang, Yu-Ying; Zhang, Bing-Guang; Sun, Qiao-Zhen
Synthesis and crystal structure of catena-poly[[aquazinc(II)]-bis[μ2-4-(phenyldiazenyl)benzoato-κ2 O:O′]]
Acta Crystallographica Section E Crystallographic Communications, 2026, 82, 803-805
2023548 CIF
Paper
C21 H24 N2 O SP 1 21/n 112.7849; 10.177; 14.4793
90; 93.627; 90
1880.16El Moutaouakil Ala Allah, Abderrazzak; Massera, Chiara; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
Synthesis, crystal structure and Hirshfeld surface analysis of 2-(ethylsulfanyl)-3-(2-methylpropyl)-5,5-diphenyl-4,5-dihydro-3H-imidazol-4-one
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023549 CIF
Paper
C24 H24 O2 SiP 1 21/n 19.8031; 13.062; 17.1604
90; 105.412; 90
2118.3Tang, Xiaoxiao; Zhang, Liyun
Synthesis and structure of ethyl 2,2-dimethyl-3-(naphthalen-1-yl)-1,2-dihydrobenzo[c]siline-4-carboxylate
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023550 CIF
Paper
C13 H18 N2 O SP -16.105; 10.702; 11.891
63.29; 81.6; 84.34
686.08Kumar, Sharatha; Hökelek, Tuncer
Synthesis, crystal structure determination, Hirshfeld surface and crystal void analyses, interaction energy calculations and energy frameworks of N-(2-methylphenyl)-N′-pivaloylthiourea
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023551 CIF
Paper
C18 H16 F2 N4 O4 S2 ZnP n a 218.26379; 27.6342; 9.214
90; 90; 90
2104.14Amanova, Dilshoda; Radjabova, Zubaydabegim; Murodov, Sardor; Erkinboyeva, Sevinch; Choriev, Odil; Ashurov, Jamshid; Daminova, Shahlo
Synthesis, structure and computational study of diacetatobis(2-amino-6-fluoro-1,3-benzothiazole-κN 3)zinc(II)
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023552 CIF
Paper
C10 H12 Br N O4P -18.5524; 9.5175; 14.9678
95.923; 99.795; 100.461
1169.27Akerele, Oluwatoyin; Lemmerer, Andreas
Crystal structure and Hirshfeld surface of 5-bromosalicylic acid dimethylformamide monosolvate
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023553 CIF
Paper
C22 H17 Cl N2 O2 S2C 1 2/c 120.7798; 13.1963; 16.1047
90; 102.44; 90
4312.49Jain, Shailakshi; Kumar, Sharatha; Hökelek, Tuncer
Synthesis, crystal structure and Hirshfeld surface analysis of 3-[5-(4-chlorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]-3-(4-methylphenyl)-1-(thiophen-2-yl)propan-1-one
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023554 CIF
Paper
C46 H68 O7P 17.9162; 13.1285; 21.944
101.178; 99.094; 96.991
2181.7Wakasa, Yui; Minoura, Mao
Crystal structure of fucoxanthin: resolving a long-standing crystallographic challenge
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023555 CIF
HKL
Paper
C40 H86 Be2 O34 U3P 3216.583; 16.583; 41.67
90; 90; 120
9924Pirozhkov, Pavel A.; Yusupova, Maria V.; Vologzhanina, Anna V.; Dorovatovskii, Pavel V.; Savchenkov, Anton V.
Uranyl derivatives: discovering features by comparing related crystal structures
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023556 CIF
HKL
Paper
C12 H21 O8 Rb UP 21 21 2111.728; 11.7946; 12.7517
90; 90; 90
1763.9Pirozhkov, Pavel A.; Yusupova, Maria V.; Vologzhanina, Anna V.; Dorovatovskii, Pavel V.; Savchenkov, Anton V.
Uranyl derivatives: discovering features by comparing related crystal structures
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023557 CIF
HKL
Paper
C48 H65 Ba2 O34.5 U4P -113; 22.21; 27.97
106.11; 97.75; 103.67
7363Pirozhkov, Pavel A.; Yusupova, Maria V.; Vologzhanina, Anna V.; Dorovatovskii, Pavel V.; Savchenkov, Anton V.
Uranyl derivatives: discovering features by comparing related crystal structures
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023558 CIF
HKL
Paper
As6 Eu5 Ga2P n m a11.2986; 9.6077; 12.4312
90; 90; 90
1349.45Alam, Md. Rashed; Lane, Robert; Khajkini, Mojib Pourashouri; Baranets, Sviatoslav
Eu5Ga2As6 and Ba5In2As6–x Sb x : new As-containing members of the Sr5Al2Sb6 structure type
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023559 CIF
HKL
Paper
As5.51 Ba5 In2 Sb0.49P n m a12.0735; 10.3287; 13.3046
90; 90; 90
1659.13Alam, Md. Rashed; Lane, Robert; Khajkini, Mojib Pourashouri; Baranets, Sviatoslav
Eu5Ga2As6 and Ba5In2As6–x Sb x : new As-containing members of the Sr5Al2Sb6 structure type
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023560 CIF
HKL
Paper
As3.08 Ba5 In2 Sb2.92P n m a12.2961; 10.5249; 13.7557
90; 90; 90
1780.2Alam, Md. Rashed; Lane, Robert; Khajkini, Mojib Pourashouri; Baranets, Sviatoslav
Eu5Ga2As6 and Ba5In2As6–x Sb x : new As-containing members of the Sr5Al2Sb6 structure type
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023561 CIF
HKL
Paper
As3 Eu3 GaC m c e18.9798; 6.4415; 12.5646
90; 90; 90
1536.13Alam, Md. Rashed; Lane, Robert; Khajkini, Mojib Pourashouri; Baranets, Sviatoslav
Eu5Ga2As6 and Ba5In2As6–x Sb x : new As-containing members of the Sr5Al2Sb6 structure type
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023562 CIF
HKL
Paper
C27 H26 N6 O3P 21 21 2113.2445; 16.5273; 22.826
90; 90; 90
4996.5Murillo, Maria Isabel; Cuenú-Ibargüen, Yahaira; Le Lagadec, Ronan; Cuenú-Cabezas, Fernando; Gómez Castaño, Jovanny Arles
Conformation and supramolecular assembly in an azo–azomethine–pyrazole hybrid: crystal structure, Hirshfeld surface and QTAIM analyses
Acta Crystallographica Section C Structural Chemistry, 2026, 82
2023563 CIF
Paper
C26 H34 Cl2 N6 O6P 1 21/n 19.0061; 15.1053; 21.2487
90; 96.752; 90
2870.6Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Goreshnik, Evgeny
2,2′-(Ethane-1,2-diyl)bis[3-(pyridin-2-yl)imidazo[1,5-a]pyridin-2-ium] dichloride hexahydrate
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023564 CIF
Paper
C24 H14 F2 N2 O2P 1 21/c 113.767; 16.914; 8.447
90; 104.423; 90
1905Dyakonenko, Viktoriya V.; Shaposhnyk, Anna M.; Iliashenko, Rodion Yu.; Doroshenko, Andrey O.; Kyrychenko, Alexander V.
Crystal structure and Hirshfeld surface analysis of 1,2-bis[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzene
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023565 CIF
Paper
As2 O6 ZnC 1 2/c 110.1061; 9.0308; 5.2801
90; 108.374; 90
457.33Pfeiffer, Maximilian; Stöger, Berthold; Weil, Matthias
Zn(AsO3)2, a unique structure among arsenates with composition M IIAsV 2O6
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023566 CIF
Paper
C13 H19 N O8P 21 21 217.190512; 8.421634; 24.69323
90; 90; 90
1495.32Salazar, Jacob K.; Kaduk, James A.; Dosen, Anja; Blanton, Thomas N.
Structure of metaraminol hydrogen tartrate from synchrotron X-ray data and density functional theory calculations
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2023567 CIF
Paper
C13 H19 N O8P 21 21 217.18988; 8.42062; 24.69
90; 90; 90
1494.81Salazar, Jacob K.; Kaduk, James A.; Dosen, Anja; Blanton, Thomas N.
Structure of metaraminol hydrogen tartrate from synchrotron X-ray data and density functional theory calculations
Acta Crystallographica Section E Crystallographic Communications, 2026, 82
2100000 CIF
Paper
C22 H12 Cl2 N6 O4P -14.2753; 8.311; 14.092
107.23; 93.53; 97.17
471.9Schmidt, Martin U.; Ermrich, Martin; Dinnebier, Robert E.
Determination of the structure of the violet pigment C~22~H~12~Cl~2~N~6~O~4~ from a non-indexed X-ray powder diagram
Acta Crystallographica Section B, 2005, 61, 37-45
2100001 CIF
Paper
C22 H12 Cl2 N6 O4P -14.3346; 8.4193; 13.9057
106.947; 92.9106; 95.118
481.934Schmidt, Martin U.; Ermrich, Martin; Dinnebier, Robert E.
Determination of the structure of the violet pigment C~22~H~12~Cl~2~N~6~O~4~ from a non-indexed X-ray powder diagram
Acta Crystallographica Section B, 2005, 61, 37-45
2100002 CIFCa F6 TbP 42/m5.2696; 5.2696; 7.7105
90; 90; 90
214.106Josse, Michaël; Dubois, Marc; El-Ghozzi, Malika; Cellier, Joël; Avignant, Daniel
Anti-KSbF~6~ structure of CaTbF~6~ and CdTbF~6~: a confirmation of the singular crystal chemistry of Tb^4+^ in fluorides
Acta Crystallographica, Section B: Structural Science, 2005, 61, 1-10
2100003 CIFCd F6 TbP 42/m5.1877; 5.1877; 7.69451
90; 90; 90
207.077Josse, Michaël; Dubois, Marc; El-Ghozzi, Malika; Cellier, Joël; Avignant, Daniel
Anti-KSbF~6~ structure of CaTbF~6~ and CdTbF~6~: a confirmation of the singular crystal chemistry of Tb^4+^ in fluorides
Acta Crystallographica, Section B: Structural Science, 2005, 61, 1-10
2100004 CIFCu0.63 O5 V2C 1 2/m 115.1; 3.6382; 10.0595
90; 105.585; 90
532.32Streltsov, Victor A.; Nakashima, Philip N. H.; Sobolev, Alexandre N.; Ozerov, Ruslan P.
Crystal structure study of a β'-copper vanadium bronze, Cu~x~V~2~O~5~ (x= 0.63), by X-ray and convergent beam electron diffraction
Acta Crystallographica, Section B: Structural Science, 2005, 61, 17-24
2100005 CIF
HKL
Paper
C6 H11 N O2P n 21 a10.8548; 9.752; 6.1152
90; 90; 90
647.331Asiloé J. Mora; Edward E. Ávila; Gerzon E. Delgado; Andrew N. Fitch; Michella Brunelli
Temperature effects on the hydrogen-bond patterns in 4-piperidinecarboxylic acid
Acta Crystallographica Section B, 2005, 61, 96-102
2100006 CIF
Paper
C6 H11 N O2P 21 21 2111.7537; 10.1013; 5.5787
90; 90; 90
662.35Asiloé J. Mora; Edward E. Ávila; Gerzon E. Delgado; Andrew N. Fitch; Michella Brunelli
Temperature effects on the hydrogen-bond patterns in 4-piperidinecarboxylic acid
Acta Crystallographica Section B, 2005, 61, 96-102
2100007 CIF
Paper
C16 H16 N4P n a 2119.499; 4.7884; 15.106
90; 90; 90
1410.4Eugenia V. Peresypkina; Mark B. Bushuev; Alexander V. Virovets; Victor P. Krivopalov; Ludmila G. Lavrenova; Stanislav V. Larionov
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100008 CIF
HKL
Paper
C16 H16 Cl2 Cu N4P 1 21/c 17.2156; 11.6522; 20.3956
90; 99.841; 90
1689.58Peresypkina, Eugenia V.; Bushuev, Mark B.; Virovets, Alexander V.; Krivopalov, Victor P.; Lavrenova, Ludmila G.; Larionov, Stanislav V.
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100009 CIF
HKL
Paper
C16 H16 Cl2 Cu N4P b c a11.6899; 14.9843; 19.2115
90; 90; 90
3365.2Peresypkina, Eugenia V.; Bushuev, Mark B.; Virovets, Alexander V.; Krivopalov, Victor P.; Lavrenova, Ludmila G.; Larionov, Stanislav V.
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100010 CIF
Paper
C16 H16 Cl2 Cu N4P 1 21/n 19.7652; 18.7631; 9.8115
90; 108.544; 90
1704.38Peresypkina, Eugenia V.; Bushuev, Mark B.; Virovets, Alexander V.; Krivopalov, Victor P.; Lavrenova, Ludmila G.; Larionov, Stanislav V.
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100011 CIF
HKL
Paper
C14 H10 Cr N2P 1 21/n 17.73; 12.0887; 11.1762
90; 91.683; 90
1043.92Khrustalev, Victor N.; Vasil'kov, Alexander Yu.; Antipin, Mikhail Yu.
Substituent effects in bis(arene)chromium compounds containing a CN group in the aromatic ring
Acta Crystallographica Section B, 2005, 61, 304-311
2100012 CIF
HKL
Paper
C14 H13 Cr NP b c a12.9628; 12.0803; 13.61
90; 90; 90
2131.3Khrustalev, Victor N.; Vasil'kov, Alexander Yu.; Antipin, Mikhail Yu.
Substituent effects in bis(arene)chromium compounds containing a CN group in the aromatic ring
Acta Crystallographica Section B, 2005, 61, 304-311
2100013 CIF
HKL
Paper
C14 H10 Cr F3 NP 1 21/c 19.7145; 7.8227; 15.74
90; 98.276; 90
1183.7Khrustalev, Victor N.; Vasil'kov, Alexander Yu.; Antipin, Mikhail Yu.
Substituent effects in bis(arene)chromium compounds containing a CN group in the aromatic ring
Acta Crystallographica Section B, 2005, 61, 304-311
2100014 CIFC H2 Cl2P b c n3.984; 7.863; 9.357
90; 90; 90
293.12Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak
In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane
Acta Crystallographica, Section B, 2005, 61, 595-600
2100015 CIFC H2 Cl2P b c n3.924; 7.793; 9.335
90; 90; 90
285.46Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak
In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane
Acta Crystallographica, Section B, 2005, 61, 595-600
2100016 CIF
Paper
C18 H26 OP -19.883; 11.579; 15.089
75.71; 73.51; 74.46
1567.67Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100017 CIF
Paper
C16 H18 Cl2 N6 O8 PdP -114.89; 7.968; 4.844
81.51; 84.22; 82.93
562.091Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100018 CIF
Paper
C48 H70 I N11 O13C 1 2 140.254; 12.53; 11.134
90; 98.48; 90
5554.4Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100019 CIF
Paper
C20 H44 O4 Sn2P -16.1757; 9.5349; 11.118
74.89; 81.36; 85.96
624.537Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100020 CIF
Paper
C30 H23 Cl3 N2 O P Re SP -110.369; 11.459; 13.787
91.08; 89.92; 106.98
1566.44Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100021 CIF
Paper
C32 H42 O6 Ti2C 1 2 123.2475; 7.9835; 23.097
90; 132.93; 90
3138.68Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100022 CIF
Paper
C22 H40 N6 Ni O2P -18.278; 8.8263; 9.1436
68.31; 70.64; 76
580.208Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100023 CIF
Paper
C28 H70 Cu3 F12 N8 O20 S4P -110.345; 10.72; 13.619
80.4; 71.41; 85.14
1410.67Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100024 CIF
Paper
C22.5 H28 N5 O1.5 S3P -110.1701; 12.2024; 12.395
75.76; 69.47; 73.75
1364.14Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100025 CIF
Paper
C44 H50 Cl2 N6 O8 PdP -17.9009; 9.3964; 15.9253
77.99; 77.34; 82.23
1123.32Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100026 CIF
Paper
C32 H64 B2 Ga2 O2P -19.209; 10.184; 10.503
69.55; 67.75; 77.23
849.734Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100027 CIF
Paper
C90 H98 B2 N2 Ni P4P -113.581; 13.11; 13.483
118.45; 116.09; 80.22
1893.23Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100028 CIF
Paper
C40 H46 N2 O14P -17.705; 10.871; 11.54
100.4; 91.38; 98.01
940.243Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100029 CIF
Paper
C10 H36 Cl2 Nd2 O20P -17.877; 8.781; 10.444
110.69; 95.24; 103.48
645.094Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100030 CIF
Paper
C35 H56 Si SmP -19.6021; 10.066; 18.8579
75.47; 79.54; 67.68
1624.62Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100031 CIF
Paper
C42 H54 N4P -111.915; 12.05; 13.544
105.67; 99.14; 93.4
1837.83Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100032 CIF
Paper
C7 H6 N2 O5C 1 c 13.854; 14.985; 14.476
90; 93.03; 90
834.852Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100033 CIF
Paper
C34 H52 Cl2 N2 O6P -18.909; 9.158; 11.841
73.41; 76.51; 80.38
895.079Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100034 CIF
Paper
C32 H54 Ca2 O39 S24 Te W6P -110.982; 16.604; 22.314
106.29; 95.71; 91.74
3878.88Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100035 CIF
Paper
C44 H44 N2 O6P -110.3654; 12.1845; 7.5077
92.5; 97.77; 93.56
936.385Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100036 CIF
Paper
C50 H44 N2 O6P -111.278; 11.879; 7.9492
95.74; 97.15; 102.08
1024.53Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100037 CIF
Paper
C12 H14 Cl8 N2 Sb2P -15.7068; 9.3857; 11.7427
66.77; 89.3; 78.68
565.246Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100038 CIF
Paper
C18 H44 Fe N15 Ni2 O5P -18.9298; 9.9353; 10.1319
85.91; 65.12; 81.74
806.959Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100039 CIF
Paper
C22 H20 F6 Fe P RuP -19.35; 10.777; 10.98
91.84; 96.66; 111.12
1021.85Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100040 CIF
Paper
C33 H33 N SiR 324.95; 24.95; 10.878
90; 90; 120
5864.36Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100041 CIF
Paper
C36 H32 Ag2 Cl2 N4 O8 S4P -18.1587; 8.4447; 14.745
87.31; 82.64; 72.72
962.01Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100042 CIF
Paper
C49 H35 Cl12 F7 O7 Sb2 ZnP -111.4503; 11.8509; 14.6041
66.25; 67.06; 74.78
1657.29Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100043 CIF
Paper
C14 H16 N4 O4P -16.591; 8.541; 14.062
98.24; 95.42; 97.08
772.374Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100044 CIF
Paper
C38 H30 Cl2 O2 P2 RuP -19.0866; 10.3456; 11.003
108.29; 113.67; 100.07
843.934Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100045 CIF
Paper
C32 H78 N6 Ni2 O22P -19.829; 10.796; 11.473
95.39; 98.82; 93.07
1194.87Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100046 CIF
Paper
C56 H50 N2 O2 TiC 1 c 110.912; 21.334; 19.529
90; 106.02; 90
4369.73Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100047 CIF
Paper
C68 H80 Fe2 P2 Pt S4P -110.2709; 11.1981; 14.226
95.84; 101.31; 93.95
1589.46Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100048 CIF
Paper
C18 H16 O4P 21 21 2116.047; 19.51; 4.8643
90; 90; 90
1522.9Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100049 CIF
Paper
C20 H44 N6 Si2 ZrP -19.61; 11.869; 12.58
80.98; 76.26; 88.22
1376.56Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100050 CIF
Paper
C32 H70 Cl2 N6 O10 ZnP -19.7472; 9.8061; 12.046
66.69; 76.81; 87.93
1027.61Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100051 CIF
Paper
C12 H17 N3 O2 SP -18.119; 9.064; 9.629
100.43; 101.67; 96.33
674.508Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100052 CIF
Paper
C68 H144 Cr2 N2 O7P -134.33; 7.8; 7.25
103.69; 89.86; 94.13
1881.1Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100053 CIF
Paper
C62 H104 P4 Pt2P -111.781; 12.004; 24.366
89.36; 76.46; 114.07
3036.59Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100054 CIF
Paper
C26 H32 Cl Cu N4 O4P -111.956; 12.073; 10.379
106.49; 106.11; 99.27
1332.52Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100055 CIF
Paper
C34 H25 N O2P -111.683; 13.927; 9.004
102.1; 110.74; 105.05
1247.15Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100056 CIF
Paper
C23.5 H19 Cl Mo N2 O2P -18.673; 10.3368; 12.355
96.58; 98.95; 100.32
1064.82Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100057 CIF
Paper
C44 H60 N10 Nd2 O24 S2P -18.541; 11.915; 15.906
107.22; 98.12; 99.78
1491.79Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100058 CIF
Paper
C54 H48 Br8 Mo6 N6 O4 P2P -111.627; 11.853; 14.234
71.82; 67.59; 62.75
1589.54Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100059 CIF
Paper
C54 H72 N4 O4 Zn2P -18.862; 12.6561; 12.8004
107.61; 96.48; 103.36
1305.25Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100060 CIF
Paper
C50 H64 N4 O4 Zn2P -110.9851; 11.0493; 11.0703
109.1; 94.37; 107.8
1185.52Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100061 CIF
Paper
C42 H32 S4 Sn2P -16.526; 9.815; 16.821
87.2; 87.21; 71.13
1017.69Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100062 CIF
Paper
C46 H45 B Cl4 N2 O PdP -112.868; 13.682; 13.831
91.02; 91.61; 117.97
2148.48Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100063 CIF
Paper
C71 H76 O8 Ti2P -111.037; 12.215; 12.659
73.7; 70.09; 78.34
1529.37Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100064 CIF
Paper
C12 H28 N4 O2 P2P -18.724; 8.341; 6.335
98.15; 85.6; 105.51
439.341Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100065 CIF
Paper
C44 H32 N4 Ni5 S50P -112.939; 20.379; 8.807
102.07; 103.17; 74.04
2147.25Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100066 CIF
Paper
C28 H44 Cu F6 O10P -19.762; 9.861; 10.409
107.14; 111.35; 94.39
872.56Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100067 CIF
Paper
C8 H22 Cl2 O5 Ru S4P -18.863; 14.462; 7.543
103.39; 113.31; 77.23
854.676Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100068 CIF
Paper
C52 H44 Cd N4 O4P -111.327; 11.614; 9.845
102.59; 114.16; 65.5
1073.47Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100069 CIF
Paper
C18 H42 Fe N6 O6 S6 W2P -18.778; 9.467; 11.362
71.51; 74.78; 74.78
847.307Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100070 CIF
Paper
C85 H85 B Cl3 Cs O10P -113.7451; 16.314; 17.1382
91.16; 93.15; 100.34
3773.13Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100071 CIF
Paper
C16 H15 N3 O2P -19.2694; 9.4267; 9.6076
76; 62.89; 89.87
719.391Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100072 CIF
Paper
C18 H32 N11 O11 PrP -110.19; 10.631; 14.062
82.49; 69.36; 83.35
1409.33Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100073 CIF
Paper
C46 H46 O8I -419.86; 19.86; 4.953
90; 90; 90
1953.56Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100074 CIF
Paper
C68 H94 N8 O2 Si3P -110.0622; 12.4188; 13.788
92.86; 107.29; 94.75
1634.42Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100075 CIF
Paper
C52 H62 N8 O2 Si3P -19.758; 9.974; 13.562
78.85; 73.69; 78.88
1229.38Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100076 CIF
Paper
C13 H14 N2 O5 SC 1 c 18.016; 14.258; 12.6
90; 104.35; 90
1395.15Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100077 CIF
Paper
C82.5 H105.5 N6.5 O6.5P -114.692; 16.59; 19.134
73.51; 73.22; 66.77
4025.84Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100078 CIF
Paper
C21 H46 Cl12 N O2.5 Te6C 1 c 112.426; 22.219; 8.782
90; 94.63; 90
2416.74Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100079 CIF
Paper
C13 H21 Cl N2 O5 SC 1 2 119.127; 6.897; 15.147
90; 119.85; 90
1733.08Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100080 CIF
Paper
C38 H39 Mo N O4 P2C 1 m 113.796; 16.637; 9.462
90; 124.43; 90
1791.3Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100081 CIF
Paper
C16 H24 O2P -113.514; 23.4672; 7.658
90.91; 100.4; 77.78
2333.97Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100082 CIF
Paper
C30 H26 B2 Cu F18 N12P -110.2686; 10.828; 11.4112
113.56; 99.74; 111.22
1008.39Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100083 CIF
Paper
C14 H16 Co N6 O4 S2P -18.264; 7.57; 9.018
69.93; 106.98; 113.32
478.561Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100084 CIF
Paper
C48 H50 Ag2 F6 N2 O6 P2P -19.7472; 9.5883; 15.104
83.85; 73.8; 62.91
1206.51Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100085 CIF
Paper
C32 H52 P2 PtP -18.238; 9.677; 10.806
66.07; 77.7; 89.39
766.549Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100086 CIF
Paper
C13 H25 O10.5C 1 2 121.735; 4.93; 17.386
90; 123.5; 90
1553.51Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100087 CIF
Paper
C40 H28 Cl2 O2 S2P -19.997; 10.092; 9.13
82.91; 114.09; 93.65
834.379Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100088 CIF
Paper
C38 H72 Cl8 Mo6 N8 O6P -112.006; 12.084; 12.143
61.97; 75.97; 76.53
1494.04Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100089 CIF
Paper
C44 H84 Br8 Mo6 N8 O2 Se6P -111.014; 12.716; 13.323
78.48; 81.92; 83.11
1802.06Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100090 CIF
Paper
C23 H19 N O3P -18.057; 9.367; 13.226
80.7; 73.44; 84.75
943.097Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100091 CIF
Paper
C20 H29 N O4C 1 2 117.138; 9.998; 13.404
90; 119.2; 90
2004.86Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100092 CIF
Paper
C17 H14 N2 O3P -18.153; 8.96; 10.443
73.57; 82.87; 74.41
703.843Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100093 CIF
Paper
C10 H12 I N3 OP -17.504; 8.959; 9.586
104.2; 109.3; 89.9
587.428Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100094 CIF
Paper
C22 H32 Cd N6 O8 S2P -111.0107; 11.2093; 11.8222
86.9; 68.26; 80.62
1337.19Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100095 CIF
Paper
C60 H66 Cu2 N3 O12P -111.912; 13.626; 10.04
95.03; 114.8; 73.58
1418.11Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100096 CIF
Paper
C60 H48 N4 O4 P4 S4P -19.165; 12.509; 13.587
109.57; 96.12; 106.49
1371.82Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100097 CIF
Paper
C30 H26 Cu N4 O4P -17.093; 8.662; 11.335
75.96; 76.4; 89.52
655.794Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100098 CIF
Paper
C26 H32 Cu N4 O4P -110.167; 10.377; 13.337
70.46; 70.96; 86.74
1251.35Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100099 CIF
Paper
C17 H20 N2 O2P -19.212; 13.454; 6.69
82.19; 111.22; 109.42
728.84Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100100 CIF
Paper
C21 H30 O3P -18.038; 10.391; 12.299
100.51; 107.29; 104.9
909.795Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100101 CIF
Paper
C63 H49 Cl F6 N3 O2 P3 Ru SP -113.852; 14.375; 16.522
108.34; 109.94; 92.57
2892.59Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100102 CIF
Paper
C45 H30 Au Fe O PP -19.7888; 12.6542; 14.9629
88.49; 74.93; 86.03
1785.34Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100103 CIF
Paper
C41 H34 Cl O5 P2 RhP -19.233; 9.5526; 11.657
109.93; 108.35; 96.83
887.436Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100104 CIF
Paper
C34 H32 Fe N2 O5P -19.396; 10.246; 16.126
99.33; 101.5; 106.72
1416.59Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100105 CIF
Paper
C46 H38 Cu2 I2 N2 P2P -19.2279; 9.4014; 13.3663
107.44; 106.71; 93.48
1045.8Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100106 CIF
Paper
C26 H28 Ag2 Cl2 N4 O8P -19.045; 9.658; 9.949
66.18; 68.22; 69.59
717.804Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100107 CIF
Paper
C70 H86 Cl2 N4 O7 P2 Rh2P -110.3194; 10.5582; 17.3713
97.01; 94.35; 112.15
1724.54Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100108 CIF
Paper
C54 H50 N3 O4 P2 RhP -19.3586; 11.0979; 12.374
73.71; 71.41; 80.67
1165.48Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100109 CIF
Paper
C30 H26 F6 Mo2 N8 O4P -19.0803; 9.9731; 10.9741
64.44; 83.61; 67.1
823.963Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100110 CIF
Paper
C6 H8 Mn N2 O6 SP 1 21 18.4549; 6.6221; 9.0743
90; 91.57; 90
507.872Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100111 CIF
Paper
C8 H25 Cl5 Co N5 ZnP -19.3281; 9.5426; 11.448
105.56; 92.96; 106.29
933.365Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100112 CIF
Paper
C6 H34 B12 N2 O28 ZnP -18.3014; 9.2489; 10.442
106.71; 94.22; 100.02
749.635Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100113 CIF
Paper
C24 H34 N3 O2 Re S3P -19.3604; 11.044; 13.823
89.19; 74.5; 75.04
1328.02Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100114 CIF
Paper
C42 H26 Co3 N4 O14P -17.7709; 10.572; 12.178
88.49; 77.97; 69.84
917.423Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100115 CIF
Paper
C24 H29 N O5 SP -110.3108; 12.1191; 12.307
62.14; 66.18; 89.93
1209.9Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100116 CIF
Paper
C29 H30 O3 SP 1 21/c 114.935; 6.618; 25.302
90; 100.4; 90
2459.76Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100117 CIF
Paper
C48 H44 N8 Ni2 O8P -19.1818; 9.7958; 12.8848
90.24; 90.02; 90.38
1158.86Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100118 CIF
Paper
C11 H16 Cl2 Hg N4P -17.865; 9.282; 11.6
67.21; 70.85; 79.36
735.906Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100119 CIF
Paper
C42 H42 Cl2 Cu2 N12 O15P -19.599; 11.206; 12.48
73.22; 77.84; 76.88
1236.47Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100120 CIF
Paper
C42 H42 B2 Cu2 F8 N12 O7P -19.6285; 11.1703; 12.3806
73.81; 78.15; 76.59
1229.71Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100121 CIF
Paper
C2 H8 O SiP n a 2129.207; 4.524; 7.339
90; 90; 90
969.72Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100122 CIF
Paper
C36 H37 Co F12 O2P -18.979; 10.651; 10.736
100.77; 99.56; 114.06
886.797Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100123 CIF
Paper
C41.5 H41 N4 Ni O4.5P -111.376; 12.09; 14.155
91.53; 104.32; 105.6
1807.76Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100124 CIF
Paper
C34 H34 Cl2 Cu2 N8 S2P -17.544; 11.099; 12.258
65.92; 72.26; 76.24
884.857Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100125 CIF
Paper
C40 H36 Co N10 O4 S2P -19.9613; 10.5477; 11.0869
65.2; 71.95; 74.36
992.174Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100126 CIF
Paper
C20 H25 Cl Fe N5 O7P -18.8643; 11.1566; 12.3585
99.89; 104.14; 90.07
1166.36Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100127 CIF
Paper
C48 H38 N12P -110.307; 12.671; 17.474
72.9; 82.82; 68.48
2028.79Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100128 CIF
Paper
C11 H10 Cl Cu N3 O2P -17.2685; 9.0937; 9.7803
74.54; 84.6; 72.68
594.735Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100129 CIFC27 H30 N8 O4P -18.7035; 12.496; 13.7034
63.416; 89.997; 78.22
1297.62Acta Crystallographica, Section B, 2005, 61, 569-576
2100130 CIFC23 H27 N7 O3C 1 2/c 133.9318; 5.025; 30.4072
90; 122.689; 90
4363.47Acta Crystallographica, Section B, 2005, 61, 569-576
2100131 CIFC25 H36 Cl N9 O6P -110.533; 11.1912; 14.2829
85.532; 81.842; 63.019
1485.02Acta Crystallographica, Section B, 2005, 61, 569-576
2100132 CIFC24 H33 N7 O5P 1 21/a 110.4021; 15.3698; 16.6432
90; 99.085; 90
2627.5Acta Crystallographica, Section B, 2005, 61, 569-576
2100133 CIF
Paper
C12 H17 N O6P 1 21 16.3425; 13.9448; 7.5021
90; 107.66; 90
632.25Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100134 CIF
Paper
C12 H17 N O6P 1 21 17.3025; 22.8901; 8.1193
90; 96.599; 90
1348.19Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100135 CIF
Paper
C12 H17 N O6P 1 21 17.2952; 22.8935; 8.11
90; 96.603; 90
1345.49Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100136 CIF
Paper
C20 H28 N2 O6P 1 21 15.562; 16.063; 11.826
90; 103.281; 90
1028.31Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100137 CIF
Paper
C20 H28 N2 O6P 1 21 18.3381; 22.738; 10.819
90; 90.12; 90
2051.2Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100138 CIF
Paper
C41 H60 N4 O13P 19.0822; 15.7819; 15.904
108.746; 96.858; 90.06
2141.33Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100139 CIF
Paper
C8 H16 N4P 1 21/c 120.247; 18.212; 27.665
90; 102.94; 90
9942.1Hao, Xiang; Chen, Jing; Cammers, Arthur; Parkin, Sean; Brock, Carolyn Pratt
A helical structure with <i>Z</i>' = 10
Acta Crystallographica Section B, 2005, 61, 218-226
2100140 CIF
Paper
C14 H7 I N2 O4P 21 21 214.1092; 6.7843; 48.6775
90; 90; 90
1357.03Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L.
Isomeric <i>N</i>-(iodophenyl)nitrophthalimides: interplay of C—H···O hydrogen bonds, iodo···nitro and iodo···carbonyl interactions, and aromatic π···π stacking interactions
Acta Crystallographica Section B, 2005, 61, 227-237
2100141 CIF
Paper
C14 H7 I N2 O4P 1 21/c 17.9592; 6.5708; 25.648
90; 97.96; 90
1328.4Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L.
Isomeric <i>N</i>-(iodophenyl)nitrophthalimides: interplay of C—H···O hydrogen bonds, iodo···nitro and iodo···carbonyl interactions, and aromatic π···π stacking interactions
Acta Crystallographica Section B, 2005, 61, 227-237
2100142 CIF
Paper
C14 H7 I N2 O4P 1 21/n 113.4591; 7.6018; 14.7086
90; 110.592; 90
1408.74Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L.
Isomeric <i>N</i>-(iodophenyl)nitrophthalimides: interplay of C—H···O hydrogen bonds, iodo···nitro and iodo···carbonyl interactions, and aromatic π···π stacking interactions
Acta Crystallographica Section B, 2005, 61, 227-237
2100143 CIF
Paper
C14 H7 I N2 O4P 1 21/n 17.5238; 22.6556; 7.9201
90; 107.382; 90
1288.38Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L.
Isomeric <i>N</i>-(iodophenyl)nitrophthalimides: interplay of C—H···O hydrogen bonds, iodo···nitro and iodo···carbonyl interactions, and aromatic π···π stacking interactions
Acta Crystallographica Section B, 2005, 61, 227-237
2100144 CIF
Paper
C14 H7 I N2 O4P 21 21 216.807; 13.0955; 14.8369
90; 90; 90
1322.58Glidewell, Christopher; Low, John N.; Skakle, Janet M.S.; Wardell, Solange M. S. V.; Wardell, James L.
Isomeric <i>N</i>-(iodophenyl)nitrophthalimides: interplay of C—H···O hydrogen bonds, iodo···nitro and iodo···carbonyl interactions, and aromatic π···π stacking interactions
Acta Crystallographica Section B, 2005, 61, 227-237
2100145 CIF
HKL
Paper
C11.33 H12.95 O48 Si24P 21 21 2120.099; 19.844; 13.424
90; 90; 90
5354.09Nishi, Koji; Hidaka, Akira; Yokomori, Yoshinobu
Structure of toluene6.4-ZSM-5 and the toluene disproportionation reaction on ZSM-5
Acta Crystallographica Section B, 2005, 61, 160-163
2100146 CIF
HKL
Paper
C6 H5 F OP 1 21 15.651; 5.0642; 9.3185
90; 107.518; 90
254.31Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100147 CIF
Paper
C6 H5 F OP 1 21 15.6747; 5.076; 9.4753
90; 107.832; 90
259.82Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100148 CIF
HKL
Paper
C6 H5 Cl OP 21 21 213.9846; 13.9272; 20.699
90; 90; 90
1148.7Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100149 CIF
Paper
C6 H5 Cl OP 21 21 214.0949; 13.875; 20.716
90; 90; 90
1177Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100150 CIF
HKL
Paper
C6 H5 Cl OP 1 21/c 18.7086; 15.4523; 8.7414
90; 93.954; 90
1173.5Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100151 CIF
Paper
C6 H5 Cl OP 1 21/c 13.9724; 12.7328; 23.155
90; 94.126; 90
1168.1Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100152 CIF
Paper
C6 H5 Cl OP 1 21/c 14.1096; 12.7665; 23.181
90; 94.201; 90
1212.9Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100153 CIF
HKL
Paper
C6 H5 F OC 1 2/c 117.1336; 8.2766; 11.4975
90; 100.234; 90
1604.5Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100154 CIF
Paper
C6 H5 F OP 21 21 215.7168; 9.9997; 17.868
90; 90; 90
1021.4Oswald, Iain D. H.; Allan, David R.; Motherwell, W. D. Samuel; Parsons, Simon
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure
Acta Crystallographica Section B, 2005, 61, 69-79
2100155 CIF
Paper
H18 O10 SrP 4/n c c :18.999; 8.999; 11.566
90; 90; 90
936.6Ricci, John S.; Stevens, Raymond C.; McMullan, Richard K.; Klooster, Wim T.
Structure of strontium hydroxide octahydrate, Sr(OH)~2~·8H~2~O, at 20, 100 and 200K from neutron diffraction
Acta Crystallographica Section B, 2005, 61, 381-386
2100156 CIF
Paper
H18 O10 SrP 4/n c c :18.99; 8.99; 11.534
90; 90; 90
932.2Ricci, John S.; Stevens, Raymond C.; McMullan, Richard K.; Klooster, Wim T.
Structure of strontium hydroxide octahydrate, Sr(OH)~2~·8H~2~O, at 20, 100 and 200K from neutron diffraction
Acta Crystallographica Section B, 2005, 61, 381-386
2100157 CIF
Paper
H18 O10 SrP 4/n c c :18.984; 8.984; 11.517
90; 90; 90
929.6Ricci, John S.; Stevens, Raymond C.; McMullan, Richard K.; Klooster, Wim T.
Structure of strontium hydroxide octahydrate, Sr(OH)~2~·8H~2~O, at 20, 100 and 200K from neutron diffraction
Acta Crystallographica Section B, 2005, 61, 381-386
2100158 CIF
Paper
C20 H16 Cl2 ZrC 1 2/c 115.387; 10.512; 11.927
90; 121.85; 90
1638.7Stash, Adam I.; Tanaka, Kiyoaki; Shiozawa, Kazunari; Makino, Hitoshi; Tsirelson, Vladimir G.
Atomic interactions in ethylenebis(1-indenyl)zirconium dichloride as derived by experimental electron density analysis
Acta Crystallographica Section B, 2005, 61, 418-428
2100159 CIF
Paper
B32 K16 Nb16 O96P b n 217.3056; 31.1632; 9.1659
90; 90; 90
2086.8Schmid, Siegbert; Wagner, Trixie
Structure of KNbOB~2~O~5~ ‒ a commensurately modulated structure
Acta Crystallographica Section B, 2005, 61, 361-366
2100160 CIF
Paper
C12 H24 Cl Mn N6 O6C -130.5936; 18.8967; 12.8288
90.18; 111.561; 90.083
6897.5A. David Rae; Susanne Mossin; Henning O. Sørensen
Structure refinement of a twinned pseudo-symmetric crystal of [Mn(C~10~H~24~N~4~)(NCO)~2~]^+^·ClO_4^-
Acta Crystallographica Section B, 2005, 61, 407-417
2100161 CIF
Paper
C18 H42 N8 O10P 1 21/c 113.825; 5.0531; 18.804
90; 102.9; 90
1280.5Vijayan, M
X-ray studies on crystalline complexes involving amino acids and peptides. XLII. Adipic acid complexes of <small>L</small>- and <small>DL</small>-arginine and supramolecular association in arginine–dicarboxylic acid complexes
Acta Crystallographica Section B, 2005, 61, 89-95
2100162 CIF
Paper
C18 H38 N8 O8P 1 21 112.494; 5.951; 16.719
90; 105.977; 90
1195.1Vijayan, M
X-ray studies on crystalline complexes involving amino acids and peptides. XLII. Adipic acid complexes of <small>L</small>- and <small>DL</small>-arginine and supramolecular association in arginine–dicarboxylic acid complexes
Acta Crystallographica Section B, 2005, 61, 89-95
2100163 CIF
Paper
C3 H4 N2 O2C 1 2/c 19.3538; 12.1757; 7.2286
90; 104.593; 90
796.7Day, G. M.; Motherwell, W. D. S.; Ammon, H. L.; Boerrigter, S. X. M.; Della Valle, R. G.; Venuti, E.; Dzyabchenko, A.; Dunitz, J. D.; Schweizer, B.; van Eijck, B. P.; Erk, P.; Facelli, J. C.; Bazterra, V. E.; Ferraro, M. B.; Hofmann, D. W. M.; Leusen, F. J. J.; Liang, C.; Pantelides, C. C.; Karamertzanis, P. G.; Price, S. L.; Lewis, T. C.; Nowell, H.; Torrisi, A.; Scheraga, H. A.; Arnautova, Y. A.; Schmidt, M. U.; Verwer, P.
A third blind test of crystal structure prediction
Acta Crystallographica Section B, 2005, 61, 511-527
2100164 CIF
Paper
C22 H8 I2 O2P 1 21/c 14.202; 20.956; 9.276
90; 100.63; 90
802.8Day, G. M.; Motherwell, W. D. S.; Ammon, H. L.; Boerrigter, S. X. M.; Della Valle, R. G.; Venuti, E.; Dzyabchenko, A.; Dunitz, J. D.; Schweizer, B.; van Eijck, B. P.; Erk, P.; Facelli, J. C.; Bazterra, V. E.; Ferraro, M. B.; Hofmann, D. W. M.; Leusen, F. J. J.; Liang, C.; Pantelides, C. C.; Karamertzanis, P. G.; Price, S. L.; Lewis, T. C.; Nowell, H.; Torrisi, A.; Scheraga, H. A.; Arnautova, Y. A.; Schmidt, M. U.; Verwer, P.
A third blind test of crystal structure prediction
Acta Crystallographica Section B, 2005, 61, 511-527
2100165 CIF
Paper
C9 H9 N3 O5P 1 21/n 112.5693; 4.8531; 17.2663
90; 99.1624; 90
1039.81Day, G. M.; Motherwell, W. D. S.; Ammon, H. L.; Boerrigter, S. X. M.; Della Valle, R. G.; Venuti, E.; Dzyabchenko, A.; Dunitz, J. D.; Schweizer, B.; van Eijck, B. P.; Erk, P.; Facelli, J. C.; Bazterra, V. E.; Ferraro, M. B.; Hofmann, D. W. M.; Leusen, F. J. J.; Liang, C.; Pantelides, C. C.; Karamertzanis, P. G.; Price, S. L.; Lewis, T. C.; Nowell, H.; Torrisi, A.; Scheraga, H. A.; Arnautova, Y. A.; Schmidt, M. U.; Verwer, P.
A third blind test of crystal structure prediction
Acta Crystallographica Section B, 2005, 61, 511-527
2100166 CIF
Paper
C3 H7 NP 1 21/c 19.507; 9.122; 9.79
90; 117.469; 90
753.3Day, G. M.; Motherwell, W. D. S.; Ammon, H. L.; Boerrigter, S. X. M.; Della Valle, R. G.; Venuti, E.; Dzyabchenko, A.; Dunitz, J. D.; Schweizer, B.; van Eijck, B. P.; Erk, P.; Facelli, J. C.; Bazterra, V. E.; Ferraro, M. B.; Hofmann, D. W. M.; Leusen, F. J. J.; Liang, C.; Pantelides, C. C.; Karamertzanis, P. G.; Price, S. L.; Lewis, T. C.; Nowell, H.; Torrisi, A.; Scheraga, H. A.; Arnautova, Y. A.; Schmidt, M. U.; Verwer, P.
A third blind test of crystal structure prediction
Acta Crystallographica Section B, 2005, 61, 511-527
2100183 CIF
Paper
C12 H22 O11P 17.65217; 19.8637; 4.98773
92.0279; 106.261; 97.1529
720.18Platteau, Cyril; Lefebvre, Jacques; Affouard, Frederic; Willart, Jean-François; Derollez, Patrick; Mallet, Franck
Structure determination of the stable anhydrous phase of α-lactose from X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 185-191
2100184 CIF
HKL
Paper
Bi2 Cu3.26 I2.62 S3.38C 1 2/m 128.056; 4.1048; 10.58
90; 110.572; 90
1140.7Tonci Balic-Zunic; Konstantin Mariolacos; Emil Makovicky
Structure of a synthetic halogen sulfosalt, Cu~3~Bi~2~S~3~I~3~
Acta Crystallographica Section B, 2005, 61, 239-245
2100185 CIF
Paper
C144 H144 N24 O36P 1 21/n 110.6907; 47.1248; 6.80017
90; 94.1849; 90
3416.77Platteau, Cyril; Lefebvre, Jacques; Hemon, Stephanie; Baehtz, Carsten; Danede, Florence; Prevost, Dominique
Structure determination of forms I and II of phenobarbital from X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 80-88
2100186 CIF
Paper
C144 H144 N24 O36P -110.7313; 23.5112; 6.78309
90.9687; 94.4757; 88.1533
1705.13Platteau, Cyril; Lefebvre, Jacques; Hemon, Stephanie; Baehtz, Carsten; Danede, Florence; Prevost, Dominique
Structure determination of forms I and II of phenobarbital from X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 80-88
2100187 CIF
Paper
C Ca O3P m c n4.96183; 7.96914; 5.742852
90; 90; 90
227.081Caspi, El'ad N.; Pokroy, Boaz; Lee, Peter L.; Quintana, John P.; Zolotoyabko, Emil
On the structure of aragonite
Acta Crystallographica Section B, 2005, 61, 129-132
2100188 CIF
Paper
O2 SiP 32 2 14.91427; 4.91427; 5.4058
90; 90; 120
113.06Caspi, El'ad N.; Pokroy, Boaz; Lee, Peter L.; Quintana, John P.; Zolotoyabko, Emil
On the structure of aragonite
Acta Crystallographica Section B, 2005, 61, 129-132
2100189 CIF
Paper
C Ca O3R -3 c :H4.987; 4.987; 17.058
90; 90; 120
367.4Caspi, El'ad N.; Pokroy, Boaz; Lee, Peter L.; Quintana, John P.; Zolotoyabko, Emil
On the structure of aragonite
Acta Crystallographica Section B, 2005, 61, 129-132
2100190 CIF
Paper
C12 D18P -16.1803; 6.1898; 6.1993
90.041; 90.129; 90.239
237.15Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100191 CIF
Paper
C12 D18P -16.1934; 6.2008; 6.2102
90.012; 90.116; 90.266
238.49Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100192 CIF
Paper
C12 D18P -16.2055; 6.212; 6.2214
90; 90.06; 90.195
239.82Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100193 CIF
Paper
C12 D18P -16.211; 6.219; 6.2257
90; 90.02; 90.17
240.47Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100194 CIF
Paper
C12 D18P -16.2157; 6.2221; 6.2284
90; 90.02; 90.139
240.88Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100195 CIF
Paper
C12 D18P -16.2183; 6.222; 6.2281
90.01; 90.03; 90.12
240.97Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100196 CIF
Paper
C12 D18P -15.236; 6.1845; 7.952
103.816; 98.46; 100.057
241.36Stride, J.A.
Determination of the low-temperature structure of hexamethylbenzene
Acta Crystallographica Section B, 2005, 61, 200-206
2100197 CIFC4 H6 O2P 1 21/a 110.1282; 10.2303; 8.31325
90; 93.2908; 90
859.95Papoular, Robert J; Allouchi, Hassan; Chagnes, Alexandre; Dzyabchenko, Alexander V; Carre, Bernard; Lemordant, Daniel; Agafonov, Viatcheslav
X-Ray powder diffraction structure determination of γ-butyrolactone at 180 K. Phase problem solution from the lattice energy minimization with two independent molecules.
Acta Crystallographica, Section B, 2005, 61
2100198 CIFC21 H22 N2 O2P 21 21 2111.309; 11.785; 12.002
90; 90; 90
1599.65Messerschmidt, Marc; Scheins, Stephan; Luger, Peter
Charge density of (–)-strychnine from 100 to 15 K, a comparison of four data sets
Acta Crystallographica, Section B: Structural Science, 2005, 61, 115-121
2100199 CIF
Paper
C21 H22 N2 O2P 21 21 2111.326; 11.765; 11.994
90; 90; 90
1598.2Messerschmidt, Marc; Scheins, Stephan; Luger, Peter
Charge density of (–)-strychnine from 100 to 15 K, a comparison of four data sets
Acta Crystallographica, Section B: Structural Science, 2005, 61, 115-121
2100200 CIFC21 H22 N2 O2P 21 21 2111.309; 11.785; 12.002
90; 90; 90
1599.65Messerschmidt, Marc; Scheins, Stephan; Luger, Peter
Charge density of (–)-strychnine from 100 to 15 K, a comparison of four data sets
Acta Crystallographica, Section B: Structural Science, 2005, 61, 115-121
2100201 CIF
Paper
C21 H22 N2 O2P 21 21 2111.326; 11.765; 11.994
90; 90; 90
1598.2Messerschmidt, Marc; Scheins, Stephan; Luger, Peter
Charge density of (–)-strychnine from 100 to 15 K, a comparison of four data sets
Acta Crystallographica, Section B: Structural Science, 2005, 61, 115-121
2100202 CIF
Paper
C8 H10 N4 O2R 3 c :H14.9372; 14.9372; 6.898
90; 90; 120
1332.88Derollez, Patrick; Correia, Natália T.; Danède, Florence; Capet, Frédéric; Affouard, Frédéric; Lefebvre, Jacques; Descamps, Marc
<i>Ab initio</i> structure determination of the high-temperature phase of anhydrous caffeine by X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 329-334
2100203 CIF
Paper
C17 H21 N O4P 21 21 217.431; 13.769; 14.944
90; 90; 90
1529Scheins, Stephan; Messerschmidt, Marc; Luger, Peter
Submolecular partitioning of morphine hydrate based on its experimental charge density at 25K
Acta Crystallographica Section B, 2005, 61, 443-448
2100204 CIF
Paper
C12 H22 O11P 17.6258; 19.6559; 5.0613
95.646; 105.43; 80.996
721.01Lefebvre, Jacques; Willart, J.-F.; Caron, V.; Lefort, R.; Affouard, F.; Danède, F.
Structure determination of the 1/1 α/β mixed lactose by X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 455-463
2100205 CIFB4 Fe3 Gd O12P 31 2 19.5305; 9.5305; 7.5479
90; 90; 120
593.73Klimin, S. A.; Fausti, D.; Meetsma, A.; Bezmaternykh, L. N.; van Loosdrecht, P. H. M.; Palstra, T. T. M.
Evidence for differentiation in the iron-helicoidal chain in GdFe3(BO3)4
Acta Crystallographica, Section B: Structural Science, 2005, 61, 481-485
2100206 CIFB4 Fe3 Gd O12R 3 2 :H9.5203; 9.5203; 7.5439
90; 90; 120
592.15Klimin, S. A.; Fausti, D.; Meetsma, A.; Bezmaternykh, L. N.; van Loosdrecht, P. H. M.; Palstra, T. T. M.
Evidence for differentiation in the iron-helicoidal chain in GdFe3(BO3)4
Acta Crystallographica, Section B: Structural Science, 2005, 61, 481-485
2100207 CIF
Paper
C50 H77 Cl O55.25C 1 2 118.998; 24.82; 16.662
90; 105.29; 90
7579Tsorteki, Frantzeska; Bethanis, Kostas; Pinotsis, Nikos; Giastas, Petros; Mentzafos, Dimitris
Inclusion compounds of plant growth regulators in cyclodextrins. V. 4-Chlorophenoxyacetic acid encapsulated in β-cyclodextrin and heptakis(2,3,6-tri-<i>O</i>-methyl)-β-cyclodextrin
Acta Crystallographica Section B, 2005, 61, 207-217
2100208 CIF
Paper
C141.5 H238 Cl2 O80P 1 21 110.926; 25.284; 29.954
90; 92.86; 90
8265Tsorteki, Frantzeska; Bethanis, Kostas; Pinotsis, Nikos; Giastas, Petros; Mentzafos, Dimitris
Inclusion compounds of plant growth regulators in cyclodextrins. V. 4-Chlorophenoxyacetic acid encapsulated in β-cyclodextrin and heptakis(2,3,6-tri-<i>O</i>-methyl)-β-cyclodextrin
Acta Crystallographica Section B, 2005, 61, 207-217
2100209 CIF?R -3 m :H4.27125; 4.27125; 63.8957
90; 90; 120
1009.51Kifune, Kouichi; Kubota, Yoshiki; Matsunaga, Toshiyuki; Yamada, Noboru
Extremely long period stacking structure in the Sb-Te binary system
Acta Crystallographica, Section B: Structural Science, 2005, 61, 492-497
2100210 CIF?R -3 m :H4.28168; 4.28168; 108.7017
90; 90; 120
1725.82Kifune, Kouichi; Kubota, Yoshiki; Matsunaga, Toshiyuki; Yamada, Noboru
Extremely long period stacking structure in the Sb-Te binary system
Acta Crystallographica, Section B: Structural Science, 2005, 61, 492-497
2100211 CIF
Paper
Ba0.0504 Bi0.2661 O1.8165 Ti0.6835?P?10.6914; 3.7963; 3.3457
90; 92.625; 90
135.652Michiue, Yuichi; Yamamoto, Akiji; Onoda, Mitsuko; Sato, Akira; Akashi, Takaya; Yamane, Hisanori
Incommensurate crystallographic shear structure of Ba~<i>x~</i>Bi~2{-~2<i>x</i>}Ti~4{-~<i>x</i>}O~11{-~4<i>x</i>} (<i>x</i> = 0.275)
Acta Crystallographica Section B, 2005, 61, 145-153
2100212 CIF
Paper
C24 H38 O5P 21 21 218.9879; 9.4028; 26.4369
90; 90; 90
2234.22Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100213 CIF
Paper
C24 H38 O5P 21 21 216.3122; 10.8884; 32.0624
90; 90; 90
2203.64Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100214 CIF
Paper
C24 H36 O5P 1 21 110.2677; 7.1108; 15.227
90; 92.34; 90
1110.82Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100215 CIF
Paper
C24 H36 O5P 21 21 218.4953; 12.706; 20.8011
90; 90; 90
2245.3Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100216 CIF
Paper
C24 H37 O5.5C 1 2 126.6049; 7.7044; 22.9126
90; 93.424; 90
4688.12Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100217 CIF
Paper
C24 H34 O5P 1 21 112.0863; 6.8301; 13.1153
90; 101.138; 90
1062.28Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga
Hydrogen-bonded aggregations of oxo-cholic acids
Acta Crystallographica Section B, 2005, 61, 346-356
2100218 CIF
Paper
C4 H9 Cd N7 Ni O0?P?8.4867; 15.951; 7.604
90; 90.48; 90
1029.3Petříček, Václav; Dušek, Michal; Černák, Juraj
Modulated one-dimensional structure of [Cd(NH~3~)~3~Ni(CN)~4~]
Acta Crystallographica Section B, 2005, 61, 280-286
2100219 CIF
Paper
C2 H3 K N8 O2P -17.031; 11.4089; 4.6788
93.158; 106.749; 83.473
356.964Leonid A. Solovyov; Alexander M. Astachov; Maxim S. Molokeev; Alexander D. Vasiliev
Powder diffraction crystal structure analysis using derivative difference minimization: example of the potassium salt of 1-(tetrazol-5-yl)-2-nitroguanidine
Acta Crystallographica Section B, 2005, 61, 435-442
2100220 CIF
Paper
K5 Mo4 O16 Yb?P?10.4054; 6.1157; 19.7751
90; 136.625; 90
864.2Alla Arakcheeva; Gervais Chapuis; Vaclav Petricek; Vladimir Morozov
The role of second coordination-sphere interactions in incommensurately modulated structures, using β-K~5~Yb(MoO~4~)~4~ as an example
Acta Crystallographica Section B, 2005, 61, 400-406
2100221 CIFC2 H2 N4 O3P -15.1233; 10.314; 17.998
106.61; 97.81; 90.13
902.1Bolotina, Nadezhda B.; Kirschbaum, Kristin; Pinkerton, A.Alan
Acta Crystallographica, Section B, 2005, 61, 577-584
2100222 CIF
Paper
C20 H24 O7C 1 2/c 115.3519; 10.4044; 11.8506
90; 109.607; 90
1783.11Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100223 CIF
Paper
C21 H29 Cl N O6.5C 1 2/c 136.0403; 7.8165; 17.0066
90; 111.792; 90
4448.5Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100224 CIF
Paper
C20 H24 O6 SC 1 2/c 18.6029; 12.2965; 17.6032
90; 104.038; 90
1806.55Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100225 CIF
Paper
C20 H24 O7 SC 1 2/c 18.8113; 12.2699; 17.564
90; 103.988; 90
1842.6Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100226 CIF
Paper
C20 H24 O8 SP 1 21/n 18.7886; 15.3454; 15.4972
90; 106.277; 90
2006.25Edwards, David J.; Pritchard, Robin G.; Wallace, Timothy W.
Fine-tuning of biaryl dihedral angles: structural characterization of five homologous three-atom bridged biphenyls by X-ray crystallography
Acta Crystallographica Section B, 2005, 61, 335-345
2100227 CIF
Paper
Li2 O2P 63/m m c3.183; 3.183; 7.7258
90; 90; 120
67.787Luis Guillermo Cota; Pablo de la Mora
On the structure of lithium peroxide, Li~2~O~2~
Acta Crystallographica Section B, 2005, 61, 133-136
2100228 CIF
HKL
Paper
C10 H10 N2 O2P 1 21/c 18.901; 7.666; 6.984
90; 90.091; 90
476.6Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100229 CIF
HKL
Paper
C10 H16 N2 O2P -15.706; 6.7599; 7.0771
100.269; 112.446; 90.163
247.5Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100230 CIF
HKL
Paper
C14 H28 N2 O4P 1 21/n 16.6652; 5.5881; 20.034
90; 94.942; 90
743.4Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100231 CIF
Paper
C16 H16 N2 O2P 1 21/c 16.499; 16.459; 7.1794
90; 112.986; 90
706.98Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100232 CIF
Paper
C16 H28 N2 O2P 1 21/c 110.423; 5.2619; 15.221
90; 109.92; 90
784.85Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100233 CIF
HKL
Paper
C26 H22 N4 O2P -17.82; 8.619; 9.201
111.897; 109.851; 94.657
525.6Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100234 CIF
Paper
C16 H28 N2 O4P -16.9612; 7.3146; 9.659
106.182; 104.481; 106.201
423.96Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100235 CIF
HKL
Paper
C12 H20 N2 O2P -18.962; 9.4944; 14.7119
90.501; 92.919; 99.664
1232.26Oswald, Iain D. H.; Motherwell, W. D. Samuel; Parsons, Simon
Formation of quinol co-crystals with hydrogen-bond acceptors
Acta Crystallographica Section B, 2005, 61, 46-57
2100236 CIF
Paper
C17 H13 N3 O2P 21 21 2123.97; 10.609; 5.457
90; 90; 90
1387.7Ryabova, Svetlana Yu.; Rastorgueva, Nina A.; Sonneveld, Eduard J.; Peschar, Rene; Schenk, Henk; Tafeenko, Viktor A.; Aslanov, Leonid A.; Chernyshev, Vladimir V.
Structural characterization of [1,4]diazepino[6,5-<i>b</i>]indoles by powder diffraction
Acta Crystallographica Section B, 2005, 61, 192-199
2100237 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.5213; 9.172; 5.5847
90; 90; 90
436.49Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100238 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.4365; 8.9506; 5.5512
90; 90; 90
419.18Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100239 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.3702; 8.7699; 5.5103
90; 90; 90
404.49Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100240 CIF
HKL
Paper
C3 H7 N O3P 21 21 218.3266; 8.665; 5.4851
90; 90; 90
395.75Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100241 CIF
Paper
C3 H7 N O3P 21 21 218.298; 8.6; 5.4663
90; 90; 90
390.09Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100242 CIF
Paper
C3 H7 N O3P 21 21 216.9083; 9.644; 5.6166
90; 90; 90
374.2Moggach, Stephen A.; Allan, David R.; Morrison, Carole A.; Parsons, Simon; Sawyer, Lindsay
Effect of pressure on the crystal structure of <small>L</small>-serine-I and the crystal structure of <small>L</small>-serine-II at 5.4GPa
Acta Crystallographica Section B, 2005, 61, 58-68
2100243 CIF
Paper
Mn O4 ReP 1 2/c 14.8022; 5.6318; 5.0803
90; 92.762; 90
137.24Bramnik, Kirill G.; Ehrenberg, Helmut; Buhre, Stephan; Fuess, Hartmut
Preparation, crystal structure and magnetic properties of the high-pressure phase MnReO~4~ with a wolframite-type structure
Acta Crystallographica Section B, 2005, 61, 246-249
2100244 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1798; 9.1869; 5.1978
90; 105.614; 90
468.16Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100245 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1822; 9.1912; 5.1995
90; 105.636; 90
468.6Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100246 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1853; 9.1959; 5.2013
90; 105.649; 90
469.11Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100247 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1893; 9.1996; 5.2043
90; 105.669; 90
469.71Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100248 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.193; 9.2039; 5.2078
90; 105.688; 90
470.37Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100249 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1944; 9.2078; 5.2103
90; 105.699; 90
470.84Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100250 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.1957; 9.2123; 5.2142
90; 105.702; 90
471.47Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100251 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.2047; 9.2255; 5.2249
90; 105.785; 90
473.34Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100252 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.213; 9.2385; 5.2359
90; 105.87; 90
475.19Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100253 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.215; 9.2455; 5.2407
90; 105.928; 90
475.94Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100254 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.2165; 9.2483; 5.2429
90; 105.942; 90
476.32Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100255 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.217; 9.2515; 5.2446
90; 105.964; 90
476.62Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100256 CIF
Paper
Ca Cu Ge2 O6P 1 21/c 110.218; 9.2536; 5.2468
90; 105.975; 90
476.94Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100257 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.2453; 9.2118; 5.4115
90; 106.931; 90
488.59Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100258 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.2405; 9.178; 5.4003
90; 107.072; 90
485.19Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100259 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.243; 9.1821; 5.4015
90; 107.074; 90
485.63Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100260 CIF
Paper
Ca Cu Ge2 O6C 1 2/c 110.2448; 9.1898; 5.4023
90; 107.09; 90
486.16Redhammer, G. J.; Tippelt, G.; Merz, M.; Roth, G.; Treutmann, W.; Amthauer, G.
Structure of the clinopyroxene-type compound CaCuGe~2~O~6~ between 15 and 800K
Acta Crystallographica Section B, 2005, 61, 367-380
2100261 CIF
Paper
C18 H17 N O4P 1 21/c 18.5153; 16.0591; 12.1476
90; 96.801; 90
1649.5Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100262 CIF
Paper
C18 H17 N O4P 1 21/c 16.4499; 14.9693; 16.6559
90; 92.947; 90
1606.01Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100263 CIF
Paper
C18 H17 N O4P 1 21/c 16.4238; 15.1513; 17.0552
90; 93.167; 90
1657.43Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100264 CIF
Paper
C18 H17 N O4P 1 21/n 112.1552; 15.8657; 16.6708
90; 97.425; 90
3188.02Skakle, Janet M. S.; Low, John N.; Wardell, James L.; Glidewell, Christopher
Concomitant polymorphism and a temperature-dependent phase change in (<i>E</i>)-[1-(4-methoxyphenyl)-3-phenyl-2-propenylideneamino]oxyacetic acid
Acta Crystallographica Section B, 2005, 61, 321-328
2100265 CIF
Paper
Nb O6 Sr2 YP 1 21/n 15.81174; 5.86444; 8.24541
90; 90.166; 90
281.024Howard, Christopher J.; Barnes, Paris W.; Kennedy, Brendan J.; Woodward, Patrick M.
Structures of the ordered double perovskites Sr~2~YTaO~6~ and Sr~2~YNbO~6~
Acta Crystallographica Section B, 2005, 61, 258-262
2100266 CIF
Paper
O6 Sr2 Ta YP 1 21/n 15.81216; 5.85937; 8.24479
90; 90.1479; 90
280.78Howard, Christopher J.; Barnes, Paris W.; Kennedy, Brendan J.; Woodward, Patrick M.
Structures of the ordered double perovskites Sr~2~YTaO~6~ and Sr~2~YNbO~6~
Acta Crystallographica Section B, 2005, 61, 258-262
2100267 CIF
Paper
C4 H8 OA b a 29.3789; 13.658; 13.661
90; 90; 90
1749.9Dave Allan, D
The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH)
Acta Crystallographica Section B, 2005, 61, 449-454
2100268 CIF
Paper
C4 H8 OA b a 29.3312; 13.642; 13.619
90; 90; 90
1733.6Dave Allan, D
The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH)
Acta Crystallographica Section B, 2005, 61, 449-454
2100269 CIF
Paper
C4 H8 OP n a 214.9208; 8.2302; 9.598
90; 90; 90
388.71Dave Allan, D
The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH)
Acta Crystallographica Section B, 2005, 61, 449-454
2100270 CIF
HKL
Paper
C4 H8 N2 O5P 1 21/n 16.097; 12.7152; 8.8587
90; 94.051; 90
685.05Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100271 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.113; 12.7149; 8.8564
90; 93.437; 90
687.14Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100272 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.127; 12.7253; 8.8633
90; 93.068; 90
690.06Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100273 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1377; 12.7306; 8.8641
90; 92.528; 90
691.94Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100274 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1313; 12.703; 8.8456
90; 92.187; 90
688.4Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100275 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1538; 12.747; 8.877
90; 91.627; 90
696.1Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100276 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.158; 12.7515; 8.8763
90; 91.263; 90
696.83Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100277 CIF
Paper
C4 H8 N2 O5P 1 21/n 16.1567; 12.733; 8.865
90; 91.18; 90
694.8Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100278 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.177; 12.785; 8.898
90; 90; 90
702.7Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100279 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1626; 12.757; 8.876
90; 90; 90
697.8Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100280 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1624; 12.757; 8.878
90; 90; 90
697.9Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100281 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1665; 12.763; 8.8814
90; 90; 90
699Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100282 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.1739; 12.7594; 8.8831
90; 90; 90
699.77Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100283 CIF
HKL
Paper
C4 H8 N2 O5P m n b6.2144; 12.7512; 8.8841
90; 90; 90
703.99Nichol, Gary S.; Clegg, William
A variable-temperature study of a phase transition in barbituric acid dihydrate
Acta Crystallographica Section B, 2005, 61, 464-472
2100284 CIF
Paper
C21 H27 N5 O4 SP -19.1487; 24.2873; 5.1794
93.118; 101.154; 83.479
1121.18Burley, Jonathan C.
Structure and intermolecular interactions of glipizide from laboratory X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 710-716
2100287 CIF
Paper
C25 H33 N9 O8P -17.69; 9.6995; 20.1404
80.522; 86.792; 72.33
1411.81Ferretti, Valeria; Pretto, Loretta; Tabrizi, Mojgan Aghazadeh; Bertolasi, Valerio
A structural study of new potent and selective antagonists to the A~2B~ adenosine receptor
Acta Crystallographica Section B, 2005, 61, 569-576
2100292 CIF
HKL
Paper
C10 H24 Cu N2 O13P 1 21/n 114.772; 13.987; 43.344
90; 97.33; 90
8882Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100293 CIF
HKL
Paper
C10 H24 Cu N2 O13P 1 21/n 114.659; 14.029; 42.475
90; 96.85; 90
8673Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100294 CIF
HKL
Paper
C10 H24 N2 O13 ZnP 1 21/c 114.721; 14.077; 26.111
90; 96.83; 90
5372.5Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100295 CIF
HKL
Paper
C10 H24 N2 O13 ZnP 1 21/c 114.633; 14.034; 25.561
90; 96.48; 90
5215.7Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100296 CIF
HKL
Paper
C10 H24 Mg N2 O13P 1 21/c 114.601; 14.182; 26.241
90; 96.77; 90
5395.9Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100297 CIF
HKL
Paper
C10 H24 Mg N2 O13P 1 21/c 114.497; 14.181; 25.7
90; 96.46; 90
5249.9Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100298 CIF
HKL
Paper
C10 H24 Co N2 O13P 4111.425; 11.425; 27.248
90; 90; 90
3556.7Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100299 CIF
HKL
Paper
C10 H24 Co N2 O13P 4111.306; 11.306; 27.041
90; 90; 90
3456.5Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures
Acta Crystallographica Section B, 2005, 61, 675-688
2100300 CIF
Paper
C6 Cd3 O12 P2P 1 21 18.7743; 9.4828; 9.167
90; 113.609; 90
698.9Bestaoui, Naima; Ouyang, Xiang; Fredoueil, Florence; Bujoli, Bruno; Clearfield, Abraham
Structural characterization of Cd~3~(O~3~PC~2~H~4~CO~2~)~2~·2H~2~O from in-house X-ray powder data and NMR
Acta Crystallographica Section B, 2005, 61, 669-674
2100301 CIF
HKL
Paper
C7 H5 N O4P 1 21/c 19.7116; 11.1347; 6.4421
90; 108.595; 90
660.26Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100302 CIF
HKL
Paper
C7 H5 N O4P 1 21/c 19.6986; 11.1571; 6.5891
90; 107.804; 90
678.85Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100303 CIF
HKL
Paper
C7 H3 D2 N O4P 1 21/c 19.7196; 11.1396; 6.454
90; 108.754; 90
661.69Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100304 CIF
HKL
Paper
C7 H3 D2 N O4P 1 21/c 19.7217; 11.1545; 6.5112
90; 108.397; 90
669.99Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100305 CIF
HKL
Paper
C7 H3 D2 N O4P 1 21/c 19.7614; 11.2243; 6.643
90; 108.304; 90
691Cowan, John. A.; Howard, Judith A. K.; McIntyre, Garry, J.; Lo, Samuel M.-F; Williams, Ian D.
Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid
Acta Crystallographica Section B, 2005, 61, 724-730
2100306 CIF
Paper
C7 H10 N O5 PP 1 21/c 112.1405; 12.4273; 6.3851
90; 100.122; 90
948.35Bendeif, El-eulmi; Dahaoui, Slimane; François, Michel; Benali-Cherif, Nourredine; Lecomte, Claude
Isostructural phase transition in <i>m</i>-carboxyphenylammonium monohydrogenphosphite
Acta Crystallographica Section B, 2005, 61, 700-709
2100307 CIF
Paper
C7 H10 N O5 PP 1 21/c 113.036; 11.538; 6.6366
90; 104.73; 90
965.4Bendeif, El-eulmi; Dahaoui, Slimane; François, Michel; Benali-Cherif, Nourredine; Lecomte, Claude
Isostructural phase transition in <i>m</i>-carboxyphenylammonium monohydrogenphosphite
Acta Crystallographica Section B, 2005, 61, 700-709
2100328 CIF
Paper
Cl H4 Na9 O20 S4P 4/n :229.6829; 29.6829; 8.4018
90; 90; 90
7402.61Pritchard, Robin Gavin; Begum, Zubeda; Lau, Yuf Fai; Austin, Jonothan
Structures of Na~9~[SO~4~]~4~<i>X</i>·2H~2~O~2~, where <i>X</i> = Cl or Br, in which the halide anions orchestrate extended orientation sequences of H~2~O~2~ solvate molecules
Acta Crystallographica Section B, 2005, 61, 663-668
2100329 CIF
Paper
Br H4 Na9 O20 S4P 4/n :214.9126; 14.9126; 8.4052
90; 90; 90
1869.2Pritchard, Robin Gavin; Begum, Zubeda; Lau, Yuf Fai; Austin, Jonothan
Structures of Na~9~[SO~4~]~4~<i>X</i>·2H~2~O~2~, where <i>X</i> = Cl or Br, in which the halide anions orchestrate extended orientation sequences of H~2~O~2~ solvate molecules
Acta Crystallographica Section B, 2005, 61, 663-668
2100332 CIF
Paper
Al0.21 Ga1.93 K0.152 O7 Ti1.86I 4/m18.0971; 18.0971; 2.9916
90; 90; 90
979.8Michiue, Yuichi; Yoshikado, Shinzo
X-ray diffraction study for one-dimensional ionic conductors K~<i>x~</i>(Ga~1{-~<i>y</i>}Al~y~)~2+<i>x~</i>Ti~2{-~<i>x</i>}O~7~ (<i>x</i> ≃0.14, <i>y</i> ≃0.10, 0.23, 0.39)
Acta Crystallographica Section B, 2005, 61, 608-615
2100333 CIF
Paper
Al0.49 Ga1.65 K0.155 O7 Ti1.86I 4/m18.0606; 18.0606; 2.9839
90; 90; 90
973.3Michiue, Yuichi; Yoshikado, Shinzo
X-ray diffraction study for one-dimensional ionic conductors K~<i>x~</i>(Ga~1{-~<i>y</i>}Al~y~)~2+<i>x~</i>Ti~2{-~<i>x</i>}O~7~ (<i>x</i> ≃0.14, <i>y</i> ≃0.10, 0.23, 0.39)
Acta Crystallographica Section B, 2005, 61, 608-615
2100334 CIF
Paper
Al0.84 Ga1.3 K0.157 O7 Ti1.86I 4/m18.0088; 18.0088; 2.9759
90; 90; 90
965.1Michiue, Yuichi; Yoshikado, Shinzo
X-ray diffraction study for one-dimensional ionic conductors K~<i>x~</i>(Ga~1{-~<i>y</i>}Al~y~)~2+<i>x~</i>Ti~2{-~<i>x</i>}O~7~ (<i>x</i> ≃0.14, <i>y</i> ≃0.10, 0.23, 0.39)
Acta Crystallographica Section B, 2005, 61, 608-615
2100335 CIFO2 SiR -3 :H13.7761; 13.7761; 41.5456
90; 90; 120
6828.23Acta Crystallographica, Section B, 2005, 61, 627-634
2100339 CIF
Paper
C3 H7 NP b c a5.0741; 9.7594; 13.305
90; 90; 90
658.87Lozano-Casal, Patricia; Allan, David R.; Parsons, Simon
Pressure-induced polymorphism in cyclopropylamine
Acta Crystallographica Section B, 2005, 61, 717-723
2100340 CIF
HKL
Paper
C6 H14 O2C 1 2/c 116.36; 16.219; 10.942
90; 90.96; 90
2903Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100341 CIF
HKL
Paper
C6 H14 O2C 1 2/c 116.333; 16.145; 10.916
90; 90.92; 90
2878.1Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100342 CIF
HKL
Paper
C6 H16 O3P 1 2/n 110.582; 7.3637; 10.587
90; 92.13; 90
824.4Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100343 CIF
HKL
Paper
C6 H26 O8P n n m6.308; 6.321; 15.759
90; 90; 90
628.4Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100344 CIF
HKL
Paper
C6 H15 O2.5P 65 2 214.696; 14.696; 13.686
90; 90; 120
2559.8Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
The unusual phases of anhydrous and hydrated pinacol
Acta Crystallographica Section B, 2005, 61, 689-699
2100345 CIF
Paper
C3 H9 Cl SiP m n 217.785; 6.43; 6.254
90; 90; 90
313.1Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak
Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs
Acta Crystallographica Section B, 2006, 62, 86-93
2100346 CIF
Paper
C3 H9 Cl SiP m n 217.768; 6.42; 6.233
90; 90; 90
310.8Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak
Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs
Acta Crystallographica Section B, 2006, 62, 86-93
2100347 CIF
Paper
C3 H9 Cl SiP m n 217.668; 6.34; 6.159
90; 90; 90
299.4Roman Gajda; Kamil F. Dziubek; Andrzej Katrusiak
Absence of halogen···halogen interactions in chlorotrimethylsilane polymorphs
Acta Crystallographica Section B, 2006, 62, 86-93
2100348 CIF
Paper
C6 H6P b c a7.287; 9.2; 6.688
90; 90; 90
448.4Budzianowski, Armand; Katrusiak, Andrzej
Pressure-frozen benzene I revisited
Acta Crystallographica Section B, 2006, 62, 94-101
2100349 CIF
Paper
C6 H6P b c a7.221; 9.05; 6.59
90; 90; 90
430.7Budzianowski, Armand; Katrusiak, Andrzej
Pressure-frozen benzene I revisited
Acta Crystallographica Section B, 2006, 62, 94-101
2100350 CIF
Paper
C6 H6P b c a7.243; 9.31; 6.756
90; 90; 90
455.6Budzianowski, Armand; Katrusiak, Andrzej
Pressure-frozen benzene I revisited
Acta Crystallographica Section B, 2006, 62, 94-101
2100351 CIF
Paper
C27 H33 N O3P 21 21 2111.757; 29.752; 6.5547
90; 90; 90
2292.8Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100352 CIF
Paper
C27 H33 N O3P 21 21 2111.7903; 29.728; 6.5519
90; 90; 90
2296.5Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100353 CIF
Paper
C27 H33 N O3P 21 21 2111.847; 29.649; 6.5443
90; 90; 90
2298.7Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100354 CIF
Paper
C27 H33 N O3P 21 21 2111.8971; 29.579; 6.535
90; 90; 90
2299.7Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100355 CIF
Paper
C27 H33 N O3P 21 21 2111.9628; 29.503; 6.5269
90; 90; 90
2303.6Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100356 CIF
Paper
C27 H33 N O3P 21 21 2112.053; 29.385; 6.5093
90; 90; 90
2305.4Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100357 CIF
Paper
C27 H33 N O3P 21 21 2112.14; 29.258; 6.4918
90; 90; 90
2305.8Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100358 CIF
Paper
C27 H33 N O3P 21 21 2112.364; 28.956; 6.4582
90; 90; 90
2312.1Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100359 CIF
Paper
C27 H33 N O3P 21 21 2112.4079; 28.861; 6.4428
90; 90; 90
2307.2Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100360 CIF
Paper
C27 H33 N O3P 21 21 2112.4288; 28.809; 6.4326
90; 90; 90
2303.3Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100361 CIF
Paper
C27 H33 N O3P 21 21 2112.4407; 28.779; 6.4272
90; 90; 90
2301.1Turowska-Tyrk, Ilona; Trzop, Elżbieta; Scheffer, John R.; Chen, Shuang
Monitoring structural transformations in crystals. 8. Monitoring molecules and a reaction center during a solid-state Yang photocyclization
Acta Crystallographica Section B, 2006, 62, 128-134
2100362 CIF
Paper
C27 H33 N O3P 21 21 2112.4509; 28.753; 6.4239
90; 90; 90
2299.8Acta Crystallographica, Section B, 2006, 62, 128-134
2100363 CIF
Paper
C27 H33 N O3P 21 21 2112.4537; 28.749; 6.424
90; 90; 90
2300Acta Crystallographica, Section B, 2006, 62, 128-134
2100364 CIF
Paper
Al0.1 Nd0.7 O3 Ti0.9C 1 2/m 17.67637; 7.64297; 7.71137
90; 90.042; 90
452.428Zhang, Zhaoming; Howard, Christopher J.; Knight, Kevin S.; Lumpkin, Gregory R.
Structures of the cation-deficient perovskite Nd~0.7~Ti~0.9~Al~0.1~O~3~ from high-resolution neutron powder diffraction in combination with group-theoretical analysis
Acta Crystallographica Section B, 2006, 62, 60-67
2100365 CIF
Paper
Al0.1 Nd0.7 O3 Ti0.9C m m m7.71021; 7.69428; 7.74755
90; 90; 90
459.62Zhang, Zhaoming; Howard, Christopher J.; Knight, Kevin S.; Lumpkin, Gregory R.
Structures of the cation-deficient perovskite Nd~0.7~Ti~0.9~Al~0.1~O~3~ from high-resolution neutron powder diffraction in combination with group-theoretical analysis
Acta Crystallographica Section B, 2006, 62, 60-67
2100366 CIF
HKL
Paper
C7 H3 Cl2 N OP -17.3325; 8.999; 12.221
78.65; 74.39; 74.23
740.7Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100367 CIF
HKL
Paper
C10 H6 Cl2 N OP -17.42; 8.386; 8.808
73.82; 66.99; 79.04
482.4Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100368 CIF
HKL
Paper
C9 H5.5 Cl2 N OP 1 21/n 14.5522; 15.067; 13.636
90; 98; 90
926.2Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100369 CIF
HKL
Paper
C7 H3 Br2 N OP -18.244; 9.12; 11.687
95.6; 108.55; 106.13
783.4Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100370 CIF
Paper
C7 H3 Br2 N OP -13.9684; 12.669; 16.047
79.68; 83.71; 83.06
784.7Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100371 CIF
Paper
C7 H3 I2 N OP -18.648; 9.393; 12.12
97.32; 109.86; 105.59
865.5Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100372 CIF
HKL
Paper
C7 H3 I2 N OP 1 21/c 115.657; 14.32; 7.724
90; 91.9; 90
1730.8Britton, Doyle
3,5-Dihalo-4-hydroxybenzonitriles: isostructures, polymorphs and solvates
Acta Crystallographica Section B, 2006, 62, 109-117
2100373 CIF
Paper
Al596 Cr156P 63/m m c32.3; 32.3; 12.4
90; 90; 120
11203.6Zhang, H.; He, Z.B.; Oleynikov, P.; Zou, X. D.; Hovmöller, S.; Kuo, K. H.
Structure model for the τ(μ) phase in Al‒Cr‒Si alloys deduced from the λ phase by the strong-reflections approach
Acta Crystallographica Section B, 2006, 62, 16-25
2100374 CIF
HKL
Paper
C10 H12 N5 O5 PP -18.9243; 10.72; 14.295
91.41; 100.75; 108.85
1266.2Ślósarek, G.; Kozak, M.; Gierszewski, J.; Pietraszko, A.
Structure of <i>N</i>^6^-furfurylaminopurine (kinetin) dihydrogenphosphate
Acta Crystallographica Section B, 2006, 62, 102-108
2100375 CIF
Paper
C10 H12 N5 O5 PP -14.4923; 10.736; 14.455
91; 100.92; 108.47
647Ślósarek, G.; Kozak, M.; Gierszewski, J.; Pietraszko, A.
Structure of <i>N</i>^6^-furfurylaminopurine (kinetin) dihydrogenphosphate
Acta Crystallographica Section B, 2006, 62, 102-108
2100376 CIF
Paper
C7 H7 Br N2 OP -17.269; 7.709; 8.403
67.01; 68.03; 72
394.61Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I.
Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP
Acta Crystallographica Section B, 2006, 62, 135-142
2100377 CIF
Paper
C15 H14 Br N3 O4P 1 21 17.359; 12.987; 8.159
90; 105.95; 90
749.7Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I.
Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP
Acta Crystallographica Section B, 2006, 62, 135-142
2100378 CIF
Paper
C15 H13 Br N2 O2P 21 21 218.851; 10.014; 15.895
90; 90; 90
1408.8Plutecka, A.; Hoffmann, M.; Rychlewska, U.; Kucybała, Z.; Pączkowski, J.; Pyszka, I.
Relationship between structure and photoinitiating abilities of selected bromide salts of 2-oxo-2,3-dihydro-1<i>H</i>-imidazo[1,2-<i>a</i>]pyridine (IMP): influence of the solvent and the substitution in benzaldehyde on the course of its reaction with IMP
Acta Crystallographica Section B, 2006, 62, 135-142
2100379 CIF
Paper
C2 H5 N3 O SP 1 21/c 17.2569; 7.4263; 9.593
90; 98.606; 90
511.2Munshi, Parthapratim; Thakur, T. S.; Guru Row, T. N.; Desiraju, G. R.
Five varieties of hydrogen bond in 1-formyl-3-thiosemicarbazide: an electron density study
Acta Crystallographica Section B, 2006, 62, 118-127
2100380 CIF
Paper
C2 H5 N3 O SP 1 21/c 17.2339; 7.3703; 9.4771
90; 98.426; 90
499.83Munshi, Parthapratim; Thakur, T. S.; Guru Row, T. N.; Desiraju, G. R.
Five varieties of hydrogen bond in 1-formyl-3-thiosemicarbazide: an electron density study
Acta Crystallographica Section B, 2006, 62, 118-127
2100381 CIF
Paper
C2 H5 N3 O SP 1 21/c 17.2359; 7.3713; 9.4768
90; 98.403; 90
500.05Munshi, Parthapratim; Thakur, T. S.; Guru Row, T. N.; Desiraju, G. R.
Five varieties of hydrogen bond in 1-formyl-3-thiosemicarbazide: an electron density study
Acta Crystallographica Section B, 2006, 62, 118-127
2100382 CIF
Paper
C6 H5 N O3P 1 21/c 16.138; 8.874; 11.702
90; 103.05; 90
620.9Wójcik, Grażyna; Mossakowska, Izabela
Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol
Acta Crystallographica Section B, 2006, 62, 143-152
2100383 CIF
Paper
C6 H5 N O3P 1 21/c 16.136; 8.8; 11.481
90; 103.4; 90
603.1Wójcik, Grażyna; Mossakowska, Izabela
Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol
Acta Crystallographica Section B, 2006, 62, 143-152
2100384 CIF
Paper
C6 H5 N O3P 1 21/c 16.146; 8.903; 11.763
90; 103.09; 90
626.9Wójcik, Grażyna; Mossakowska, Izabela
Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol
Acta Crystallographica Section B, 2006, 62, 143-152
2100385 CIF
Paper
C6 H5 N O3P 1 21/n 13.774; 11.147; 14.695
90; 92.6; 90
617.6Wójcik, Grażyna; Mossakowska, Izabela
Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol
Acta Crystallographica Section B, 2006, 62, 143-152
2100386 CIF
Paper
C6 H5 N O3P 1 21/n 13.678; 11.091; 14.627
90; 92.75; 90
596Wójcik, Grażyna; Mossakowska, Izabela
Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol
Acta Crystallographica Section B, 2006, 62, 143-152
2100387 CIF
Paper
C6 H5 N O3P 1 21/n 13.831; 11.093; 14.835
90; 93.45; 90
629.3Wójcik, Grażyna; Mossakowska, Izabela
Polymorphs of <i>p</i>-nitrophenol as studied by variable-temperature X-ray diffraction and calorimetry: comparison with <i>m</i>-nitrophenol
Acta Crystallographica Section B, 2006, 62, 143-152
2100388 CIF
Paper
Hf0.006 O1.968 Zr0.994P 42/n m c3.58651; 3.58651; 5.16658
90; 90; 90
66.458Yashima, Masatomo; Tsunekawa, Shin
Crystal structures and the oxygen deficiency of tetragonal and monoclinic zirconium oxide nanoparticles
Acta Crystallographica, Section B, 2006, 62, 161-164
2100389 CIF
Paper
?P 42/n m c :13.58651; 3.58651; 5.16658
90; 90; 90
66.46Yashima, Masatomo; Tsunekawa, Shin
Crystal structures and the oxygen deficiency of tetragonal and monoclinic zirconium oxide nanoparticles
Acta Crystallographica, Section B, 2006, 62, 161-164
2100390 CIF
Paper
C21 H9 D14 N SP 1 21 18.5992; 10.1263; 10.0412
90; 98.364; 90
865.07Hosoya, Takaaki; Uekusa, Hidehiro; Ohashi, Yuji; Ohhara, Takashi; Tanaka, Ichiro; Niimura, Nobuo
Neutron diffraction analysis of deuterium transfer in chiral β-thiolactam formation in the crystalline state
Acta Crystallographica Section B, 2006, 62, 153-160
2100391 CIF
Paper
C21 H9 D14 N SP 1 21 18.7075; 10.2068; 10.0908
90; 99.909; 90
883.45Hosoya, Takaaki; Uekusa, Hidehiro; Ohashi, Yuji; Ohhara, Takashi; Tanaka, Ichiro; Niimura, Nobuo
Neutron diffraction analysis of deuterium transfer in chiral β-thiolactam formation in the crystalline state
Acta Crystallographica Section B, 2006, 62, 153-160
2100392 CIF
Paper
C21 H9 D14 N SP 1 21 18.9117; 10.5512; 10.3463
90; 102.589; 90
949.5Hosoya, Takaaki; Uekusa, Hidehiro; Ohashi, Yuji; Ohhara, Takashi; Tanaka, Ichiro; Niimura, Nobuo
Neutron diffraction analysis of deuterium transfer in chiral β-thiolactam formation in the crystalline state
Acta Crystallographica Section B, 2006, 62, 153-160
2100393 CIF
Paper
H8.6 K2.6 Li9.4 O42.3 Si16P 1 21/m 16.56; 23.057; 6.978
90; 90.08; 90
1055.4Park, So-Hyun; Boysen, Hans; Parise, John B.
Structural disorder of a new zeolite-like lithosilicate, K~2.6~Li~5.4~[Li~4~Si~16~O~38~]·4.3H~2~O
Acta Crystallographica Section B, 2006, 62, 42-51
2100394 CIF
Paper
C48 H108 O20 P4 Re4 UI -4 2 m15.5404; 15.5404; 14.8191
90; 90; 90
3578.9M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100395 CIF
Paper
C48 H108 O20 P4 Re4 UC m c 2121.5289; 21.9148; 14.8288
90; 90; 90
6996.3M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100396 CIF
Paper
C48 H108 O20 P4 Re4 UC m c 2121.4344; 21.7929; 14.7782
90; 90; 90
6903.2M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100397 CIF
Paper
C48 H108 O20 P4 Re4 UC 1 c 121.4; 21.68; 14.78
90; 90; 90
6857M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100398 CIF
Paper
C48 H108 O20 P4 Re4 ThI -4 2 m15.5577; 15.5577; 14.873
90; 90; 90
3599.9M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100399 CIF
Paper
C48 H108 O20 P4 Re4 ThC m c 2121.721; 21.738; 14.8793
90; 90; 90
7025.6M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100400 CIF
Paper
C48 H108 O20 P4 Re4 ThC m c 2121.61; 21.623; 14.8324
90; 90; 90
6930.8M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100401 CIF
Paper
C48 H108 O20 P4 Re4 ThC m c 2121.535; 21.548; 14.795
90; 90; 90
6865.4M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100402 CIF
Paper
C48 H108 O20 P4 Tc4 ThI -4 3 m15.3423; 15.3423; 15.3423
90; 90; 90
3611.4M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100403 CIF
Paper
C48 H108 O20 P4 Tc4 ThC m c 2121.444; 21.582; 14.736
90; 90; 90
6819.9M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100404 CIF
Paper
C48 H108 O20 P4 Tc4 ThP b c 2121.417; 21.649; 14.848
90; 90; 90
6884M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100405 CIF
Paper
C48 H108 O20 P4 Tc4 ThP b c 2121.358; 21.651; 14.79
90; 90; 90
6839M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100406 CIF
Paper
C48 H108 O20 P4 Tc4 ThP b c 2121.386; 21.732; 14.82
90; 90; 90
6888M. Helliwell; D. Collison; G. H. John; I. May; M. J. Sarsfield; C. A. Sharrad; A. D. Sutton
Temperature-resolved study of three [<i>M</i>(<i>M</i>'O~4~)~4~(TBPO)~4~] complexes (<i>MM</i>' = URe, ThRe, ThTc)
Acta Crystallographica Section B, 2006, 62, 68-85
2100407 CIF
HKL
Paper
Ce4 Cl0.92 N6.92 O3.16 Si4P 21 310.347; 10.347; 10.347
90; 90; 90
1107.8Friedrich, Alexandra; Haussuehl, Eiken; Morgenroth, Wolfgang; Lieb, Alexandra; Winkler, Björn; Knorr, Karsten; Schnick, Wolfgang
Crystal structure of the high-pressure phase of the oxonitridosilicate chloride Ce~4~[Si~4~O~3+<i>x~</i>N~7{-~<i>x</i>}]Cl~1{-~<i>x</i>}O~<i>x~</i>, <i>x</i> ≃0.2
Acta Crystallographica Section B, 2006, 62, 205-211
2100408 CIF
HKL
Paper
Ce4 Cl0.93 N6.93 O3.14 Si4P 21 310.223; 10.223; 10.223
90; 90; 90
1068.4Friedrich, Alexandra; Haussuehl, Eiken; Morgenroth, Wolfgang; Lieb, Alexandra; Winkler, Björn; Knorr, Karsten; Schnick, Wolfgang
Crystal structure of the high-pressure phase of the oxonitridosilicate chloride Ce~4~[Si~4~O~3+<i>x~</i>N~7{-~<i>x</i>}]Cl~1{-~<i>x</i>}O~<i>x~</i>, <i>x</i> ≃0.2
Acta Crystallographica Section B, 2006, 62, 205-211
2100409 CIF
HKL
Paper
Ce4 Cl0.93 N6.93 O3.14 Si4P 21 21 2110.824; 10.479; 8.967
90; 90; 90
1017.1Friedrich, Alexandra; Haussuehl, Eiken; Morgenroth, Wolfgang; Lieb, Alexandra; Winkler, Björn; Knorr, Karsten; Schnick, Wolfgang
Crystal structure of the high-pressure phase of the oxonitridosilicate chloride Ce~4~[Si~4~O~3+<i>x~</i>N~7{-~<i>x</i>}]Cl~1{-~<i>x</i>}O~<i>x~</i>, <i>x</i> ≃0.2
Acta Crystallographica Section B, 2006, 62, 205-211
2100410 CIF
Paper
C42 H28C m c a26.789; 7.17; 14.211
90; 90; 90
2729.6Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100411 CIF
Paper
C42 H28C m c a26.789; 7.173; 14.246
90; 90; 90
2737.5Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100412 CIF
Paper
C42 H28C m c a26.775; 7.168; 14.258
90; 90; 90
2736.4Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100413 CIF
Paper
C42 H28C m c a26.828; 7.181; 14.306
90; 90; 90
2756.1Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100414 CIF
Paper
C42 H28C m c a26.838; 7.181; 14.332
90; 90; 90
2762.1Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100415 CIF
Paper
C42 H28C m c a26.818; 7.174; 14.348
90; 90; 90
2760.4Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100416 CIF
Paper
C42 H28C m c a26.938; 7.211; 14.461
90; 90; 90
2809Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100417 CIF
Paper
C42 H28C m c a26.86; 7.193; 14.433
90; 90; 90
2788.5Jurchescu, Oana D.; Meetsma, Auke; Palstra, Thomas T.M.
Low-temperature structure of rubrene single crystals grown by vapor transport
Acta Crystallographica Section B, 2006, 62, 330-334
2100418 CIF
Paper
C18 H18 Cl2 N2 O4 SnP -17.1204; 12.5017; 12.578
114.424; 92.562; 104.354
973.78Somphon, Weenawan; Haller, Kenneth J.; Ng, Seik Weng; Rae, A. David
Packing and polytypism in 1,10-phenanthrolin-1-ium (2-carboxyethyl)(2-carboxylatoethyl)dichlorostannate(IV)
Acta Crystallographica Section B, 2006, 62, 255-261
2100419 CIF
Paper
C3 H7 N O2 SP 21 21 218.1109; 12.1621; 5.421
90; 90; 90
534.76Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay
High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV
Acta Crystallographica Section B, 2006, 62, 296-309
2100420 CIF
Paper
C3 H7 N O2 SP 21 21 217.4146; 12; 5.3318
90; 90; 90
474.4Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay
High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV
Acta Crystallographica Section B, 2006, 62, 296-309
2100421 CIF
Paper
C3 H7 N O2 SP 21 21 218.0558; 10.4883; 5.3471
90; 90; 90
451.79Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay
High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV
Acta Crystallographica Section B, 2006, 62, 296-309
2100422 CIF
Paper
C3 H7 N O2 SP 21 21 217.9981; 10.2976; 5.284
90; 90; 90
435.2Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay
High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV
Acta Crystallographica Section B, 2006, 62, 296-309
2100423 CIF
Paper
C3 H7 N O2 SP 1 21 18.105; 5.442; 10.916
90; 94.897; 90
479.7Moggach, Stephen A.; Allan, David R.; Clark, Stewart J.; Gutmann, Matthias J.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay
High-pressure polymorphism in <small>L</small>-cysteine: the crystal structures of <small>L</small>-cysteine-III and <small>L</small>-cysteine-IV
Acta Crystallographica Section B, 2006, 62, 296-309
2100424 CIF
Paper
C21 H45 F6 N4 Ni O6 PP 21 314.008; 14.008; 14.008
90; 90; 90
2748.7Farrugia, L. J.; Frampton, C. S.; Howard, J. A. K.; Mallinson, P. R.; Peacock, R. D.; Smith, G. T.; Stewart, B.
Experimental charge-density study on the nickel(II) coordination complex [Ni(H~3~<i>L</i>)][NO~3~][PF~6~] [H~3~<i>L</i> = <i>N</i>,<i>N</i>',<i>N</i>''-tris(2-hydroxy-3-methylbutyl)-1,4,7-triazacyclononane]: a reappraisal
Acta Crystallographica Section B, 2006, 62, 236-244
2100425 CIF
Paper
C16 H26 O6P 3118.685; 18.685; 12.2539
90; 90; 120
3705.03A. David Rae; Anthony C. Willis; David T. Loong; Martin G. Banwell
(<i>Z</i>,2<i>R</i>,3<i>R</i>,4a<i>R</i>,7<i>R</i>,12a<i>S</i>)-2,3,7,8,12,12a-Hexahydro-2,3-dimethoxy-2,3,7-trimethyl-4a<i>H</i>-[1,4]dioxino[2,3-<i>c</i>]oxecin-5(11<i>H</i>)-one: a commensurate occupationally modulated structure revealing a condition for diffraction symmetry enhancement for non-parent reflections
Acta Crystallographica Section B, 2006, 62, 262-267
2100426 CIF
Paper
Ba1.117 Ni0.117 O3 Rh0.883R-3m(00\g)0s10.0576; 10.0576; 2.5862
90; 90; 120
226.56Schönleber, Andreas; Zúñiga, F. Javier; Perez-Mato, J. Manuel; Darriet, Jacques; zur Loye, Hans-Conrad
Description of Ba~1+<i>x~</i>Ni~<i>x~</i>Rh~1{-~<i>x</i>}O~3~ with <i>x</i> = 0.1170(5) in superspace: modulated composite <i>versus</i> modulated-layer structure
Acta Crystallographica Section B, 2006, 62, 197-204
2100427 CIF
Paper
Ba Ni0.105 O2.686 Rh0.791X-3c1(00\g)00010.0576; 10.0576; 4.6306
90; 90; 120
405.65Schönleber, Andreas; Zúñiga, F. Javier; Perez-Mato, J. Manuel; Darriet, Jacques; zur Loye, Hans-Conrad
Description of Ba~1+<i>x~</i>Ni~<i>x~</i>Rh~1{-~<i>x</i>}O~3~ with <i>x</i> = 0.1170(5) in superspace: modulated composite <i>versus</i> modulated-layer structure
Acta Crystallographica Section B, 2006, 62, 197-204

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