Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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2244105 | CIF HKL Paper | C4 H9 N7 O6 | P 1 21/c 1 | 7.865; 9.9173; 12.2291 90; 100.836; 90 | 936.86 | Dilshad, Sumra; Çınar, Emine Berrin; Ali, Arif; Ahmed, Adeeba; Alam, Mohd Jane; Ahmad, Musheer; Ahmad, Aiman; Dege, Necmi; Saif, Eiad Crystal structure and Hirshfeld surface analysis of 2,4,6-triaminopyrimidine-1,3-diium dinitrate Acta Crystallographica Section E, 2022, 78 |
2244106 | CIF HKL Paper | C18 H16 Cl N O2 S | P 1 21/c 1 | 6.6235; 25.1848; 9.8283 90; 96.504; 90 | 1628.92 | Guseinov, Firudin I.; Kobrakov, Konstantin I.; Shuvalova, Elena V.; Tuzharov, Egor I.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of 2-(4-chlorophenyl)-4-(dimethoxymethyl)-5-phenyl-1,3-thiazole Acta Crystallographica Section E, 2022, 78 |
2244107 | CIF HKL Paper | C36 H31 N O8 | C 1 2/c 1 | 18.7222; 9.787; 16.9398 90; 113.758; 90 | 2840.9 | Magrashi, Maryam Ali; Aazam, Elham Shafik The co-crystal 4,6-diacetylresorcinol–1-aminopyrene (2/1) Acta Crystallographica Section E, 2022, 78, 679-681 |
2244108 | CIF HKL Paper | C9 H10 Cl N O2 | P 1 21/c 1 | 10.0939; 9.6423; 10.2799 90; 115.531; 90 | 902.83 | Missioui, Mohcine; Guerrab, Walid; Nchioua, Intissar; El Moutaouakil Ala Allah, Abderrazzak; Kalonji Mubengayi, Camille; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef Crystal structure and Hirshfeld surface analysis of 2-chloro-<i>N</i>-(4-methoxyphenyl)acetamide Acta Crystallographica Section E, 2022, 78 |
2244109 | CIF HKL Paper | C22 H19 N O2 | P b c n | 20.8269; 9.09843; 9.0158 90; 90; 90 | 1708.42 | Naghiyev, Farid N.; Khrustalev, Victor N.; Safronenko, Marina G.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 2,2'-(phenylazanediyl)bis(1-phenylethan-1-one) Acta Crystallographica Section E, 2022, 78 |
2244110 | CIF HKL Paper | C20 H24 Br N O2 | P 1 21/c 1 | 21.1019; 9.01359; 10.03985 90; 96.1425; 90 | 1898.65 | Khalilov, Ali N.; Khrustalev, Victor N.; Fortalnova, Elena A.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 4-bromo-2-[3-methyl-5-(2,4,6-trimethylbenzyl)oxazolidin-2-yl]phenol Acta Crystallographica Section E, 2022, 78 |
2244111 | CIF HKL Paper | C18 H14 Cl2 N2 O2 Zn | P 1 21 1 | 8.5167; 7.8697; 13.1617 90; 94.89; 90 | 878.94 | Padgett, Clifford W.; Lynch, Will E.; Groneck, Erin N.; Raymundo, Melina; Adams, Desiree Crystal structures of three zinc(II) halide coordination complexes with quinoline <i>N</i>-oxide Acta Crystallographica Section E, 2022, 78 |
2244112 | CIF HKL Paper | C18 H14 Br2 N2 O2 Zn | P 1 21/c 1 | 16.3922; 7.3527; 15.5809 90; 97.113; 90 | 1863.5 | Padgett, Clifford W.; Lynch, Will E.; Groneck, Erin N.; Raymundo, Melina; Adams, Desiree Crystal structures of three zinc(II) halide coordination complexes with quinoline <i>N</i>-oxide Acta Crystallographica Section E, 2022, 78 |
2244113 | CIF HKL Paper | C18 H14 I2 N2 O2 Zn | P 1 21/c 1 | 16.7231; 7.6155; 15.8689 90; 97.192; 90 | 2005.08 | Padgett, Clifford W.; Lynch, Will E.; Groneck, Erin N.; Raymundo, Melina; Adams, Desiree Crystal structures of three zinc(II) halide coordination complexes with quinoline <i>N</i>-oxide Acta Crystallographica Section E, 2022, 78 |
2244114 | CIF HKL Paper | C32 H41 N3 O3 S Si | P -1 | 8.6752; 8.8765; 20.2299 78.107; 87.922; 89.512 | 1523.37 | Friedrich, Erik; Heinrich, Timo; Rosenberger, Lara; Krier, Mireille; Marek, Stephanie; Reggelin, Michael Synthesis and crystal structure of <i>rac</i>-2-(1,3-dioxoisoindolin-2-yl)ethyl 4-methyl-<i>N</i>-phenyl-<i>N</i>'-(triisopropylsilyl)benzenesulfondiimidoate: the first member of a new substance class Acta Crystallographica Section E, 2022, 78 |
2244115 | CIF HKL Paper | C21 H16 N2 O5 | C 1 c 1 | 16.4968; 14.8697; 16.1836 90; 114.879; 90 | 3601.5 | Li, Chun; Weaver, Matthew J.; Campbell, Michael J.; Natale, Nicholas R. Syntheses and crystal structures of a nitro–anthracene–isoxazole and its oxidation product Acta Crystallographica Section E, 2022, 78 |
2244116 | CIF HKL Paper | C21 H17 N O5 | P 1 21/c 1 | 8.2862; 23.5895; 8.6219 90; 97.728; 90 | 1669.99 | Li, Chun; Weaver, Matthew J.; Campbell, Michael J.; Natale, Nicholas R. Syntheses and crystal structures of a nitro–anthracene–isoxazole and its oxidation product Acta Crystallographica Section E, 2022, 78 |
2244117 | CIF HKL Paper | C14 H8 Br3 N3 O2 | P n a 21 | 13.8678; 13.5442; 8.3017 90; 90; 90 | 1559.29 | Akkurt, Mehmet; Yıldırım, Sema Öztürk; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Niyazova, Ayten A.; Khrustalev, Victor N.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-(4-bromophenyl)-1-[2,2-dibromo-1-(4-nitrophenyl)ethenyl]diazene Acta Crystallographica Section E, 2022, 78 |
2244118 | CIF HKL Paper | C26 H30 N2 O4 | P b c a | 19.998; 9.7472; 23.54 90; 90; 90 | 4588.5 | Rivera, Augusto; Ríos-Motta, Jaime; Bolte, Michael Synthesis and crystal structure of 2-(2-hydroxyphenyl)-1,3-bis(4-methoxybenzyl)-1,3-diazinan-5-ol Acta Crystallographica Section E, 2022, 78 |
2244119 | CIF HKL Paper | C26 H28 Mn N6 S2 | P b c n | 17.47811; 8.9357; 17.36177 90; 90; 90 | 2711.55 | Ceglarska, Magdalena; Krebs, Christoph; Näther, Christian Syntheses, crystal structures and properties of tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)manganese(II) and tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)iron(II) Acta Crystallographica Section E, 2022, 78, 755-760 |
2244120 | CIF HKL | C26 H28 Fe N6 S2 | P b c n | 17.3733; 8.94119; 17.24862 90; 90; 90 | 2679.37 | Ceglarska, Magdalena; Krebs, Christoph; Näther, Christian Syntheses, crystal structures and properties of tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)manganese(II) and tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)iron(II) Acta Crystallographica Section E, 2022, 78, 755-760 |
2244121 | CIF HKL Paper | La2 O24 Sr9 W4 | I 41/a :2 | 11.6365; 11.6365; 16.304 90; 90; 90 | 2207.69 | Simura, Rayko; Watanabe, Tomoki; Yamane, Hisanori Sr~9~La~2~(WO~6~)~4~ containing [WO~6~] octahedra Acta Crystallographica Section E, 2022, 78 |
2244122 | CIF HKL Paper | C27 H27 N O | P 1 21/n 1 | 14.416; 5.8569; 25.354 90; 96.116; 90 | 2128.5 | Liu, Xiaozhou; Wang, Lu; Feng, Ying; Cui, Deliang; Liu, Zhi Crystal structure of 8-hexyloxy-2-[(<i>Z</i>)-2-(naphthalen-2-yl)ethenyl]quinoline Acta Crystallographica Section E, 2022, 78 |
2244123 | CIF HKL Paper | Ba3 H12 O17 Se2 Sn | P 63 | 9.255; 9.255; 11.4441 90; 90; 120 | 848.92 | Reuter, Hans; Kamaha, Shouassi Ba~3~[Sn(OH)~6~][SeO~4~]~2~·3H~2~O, a hydrated 1:2 double salt of barium hexahydroxidostannate(IV) and barium selenate(VI) Acta Crystallographica Section E, 2022, 78 |
2244124 | CIF | C18 H20 N4 O8 | P -1 | 7.3729; 8.4842; 15.5411 88.954; 81.333; 89.352 | 960.85 | Subha, Veerappan; Seethalakshmi, Thangaraj; Balakrishnan, Thangavelu; Percino, M. Judith; Venkatesan, Perumal Crystal structure of 4-(2-methoxyphenyl)piperazin-1-ium 3,5-dintrosalicylate Acta Crystallographica Section E, 2022, 78 |
2244125 | CIF HKL Paper | C26 H40 Co2 N4 O22 | P -1 | 9.2008; 9.3137; 10.647 86.551; 79.378; 72.369 | 854.61 | Velazquez-Garcia, Jose de Jesus; Techert, Simone Synthesis and structure of hexaaquacobalt bis(2-methyl-1<i>H</i>-imidazol-3-ium) tetraaquabis(benzene-1,3,5-tricarboxylato-κ<i>O</i>)cobalt Acta Crystallographica Section E, 2022, 78 |
2244126 | CIF HKL Paper | C17 H15 F O2 | P c a 21 | 7.1426; 17.0566; 11.152 90; 90; 90 | 1358.63 | Bernhard, Merle; Lutter, Jacob C.; Predecki, Allison Crystal structure of (2<i>E</i>)-1-(4-ethoxyphenyl)-3-(4-fluorophenyl)prop-2-en-1-one Acta Crystallographica Section E, 2022, 78 |
2244127 | CIF HKL Paper | C31 H35 N O4 | P 1 21/n 1 | 10.443; 18.4563; 14.2378 90; 107.93; 90 | 2610.9 | Sughanya, V.; Loganathan, B.; Praveenkumar, D.; Ayyappan, J.; Sundararajan, M. L.; Prabhakaran, A.; Dhandapani, A.; Suresh Babu, N. Crystal structure, Hirshfeld surface and frontier molecular orbital analysis of 10-benzyl-9-(4-hydroxy-3-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione Acta Crystallographica Section E, 2022, 78 |
2244128 | CIF HKL Paper | C16 H10 N4 O2 S2 Zn | C 1 2/c 1 | 20.4223; 11.326; 7.4019 90; 98.31; 90 | 1694.11 | Pirimova, Mehribon; Torambetov, Batirbay; Kadirova, Shakhnoza; Ziyaev, Abdukhakim; Gonnade, Rajesh G.; Ashurov, Jamshid Synthesis, crystal structure and Hirshfeld surface analysis of a zinc(II) coordination polymer of 5-phenyl-1,3,4-oxadiazole-2-thiolate Acta Crystallographica Section E, 2022, 78 |
2244129 | CIF HKL Paper | C27 H27 N13 O | P 1 21/c 1 | 8.9102; 13.5595; 22.052 90; 98.024; 90 | 2638.2 | Mahmudov, Ibadulla; Atioğlu, Zeliha; Akkurt, Mehmet; Abdullayev, Yusif; Sujayev, Afsun; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of 2-(4-amino-6-phenyl-1,2,5,6-tetrahydro-1,3,5-triazin-2-ylidene)malononitrile dimethylformamide hemisolvate Acta Crystallographica Section E, 2022, 78 |
2244130 | CIF HKL Paper | C14 H8 Br3 N3 O2 | P b c a | 6.6579; 15.7683; 29.0301 90; 90; 90 | 3047.69 | Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Babayeva, Gülnara V.; Khrustalev, Victor N.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of a new polymorph of (<i>E</i>)-2-(4-bromophenyl)-1-[2,2-dibromo-1-(3-nitrophenyl)ethenyl]diazene Acta Crystallographica Section E, 2022, 78 |
2244131 | CIF HKL Paper | C17 H21 N3 O5 | P -1 | 6.0768; 7.4427; 18.4737 78.894; 85.87; 83.668 | 813.77 | Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher Syntheses and crystal structures of 4-(4-nitrophenyl)piperazin-1-ium benzoate monohydrate and 4-(4-nitrophenyl)piperazin-1-ium 2-carboxy-4,6-dinitrophenolate Acta Crystallographica Section E, 2022, 78 |
2244132 | CIF HKL Paper | C17 H17 N5 O9 | P -1 | 7.9599; 8.5391; 14.2227 90.426; 105.273; 98.538 | 921.15 | Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher Syntheses and crystal structures of 4-(4-nitrophenyl)piperazin-1-ium benzoate monohydrate and 4-(4-nitrophenyl)piperazin-1-ium 2-carboxy-4,6-dinitrophenolate Acta Crystallographica Section E, 2022, 78 |
2244133 | CIF HKL Paper | C36 H30 Br2 N6 O3 | C 1 2/c 1 | 27.539; 6.343; 21.354 90; 118.17; 90 | 3288.3 | Naghiyev, Farid N.; Khrustalev, Victor N.; Venskovsky, Nikolai U.; Tereshina, Tatiana A.; Khalilov, Ali N.; Akkurt, Mehmet; Bhattarai, Ajaya; Mamedov, İbrahim G. Crystal structures and Hirshfeld surface analyses of 2-amino-4-(4-bromophenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile hemihydrate and 1,6-diamino-2-oxo-4-phenyl-1,2-dihydropyridine-3,5-dicarbonitrile Acta Crystallographica Section E, 2022, 78 |
2244134 | CIF HKL Paper | C13 H9 N5 O | P -1 | 8.6444; 8.9104; 16.0902 79.196; 86.485; 69.003 | 1136.52 | Naghiyev, Farid N.; Khrustalev, Victor N.; Venskovsky, Nikolai U.; Tereshina, Tatiana A.; Khalilov, Ali N.; Akkurt, Mehmet; Bhattarai, Ajaya; Mamedov, İbrahim G. Crystal structures and Hirshfeld surface analyses of 2-amino-4-(4-bromophenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile hemihydrate and 1,6-diamino-2-oxo-4-phenyl-1,2-dihydropyridine-3,5-dicarbonitrile Acta Crystallographica Section E, 2022, 78 |
2244135 | CIF HKL Paper | C48 H51.5 Fe2 N16 O12.75 S2 | P -1 | 9.9635; 14.4905; 20.1131 96.736; 101.49; 95.216 | 2806.5 | Petrenko, Yuliia P.; Bibik, Yurii S.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Gural'skiy, Il`ya A.; Shova, Sergiu; Lampeka, Rostyslav D.; Raspertova, Ilona V. Synthesis and crystal structure of hydrated μ-oxalato-bis{bis[3-methyl-5-(pyridin-2-yl)-1<i>H</i>-1,2,4-triazole]iron(II)} bis(toluenesulfonate) 2.75-hydrate Acta Crystallographica Section E, 2022, 78 |
2244136 | CIF HKL Paper | C30 H50 N4 O4 | P 1 21/c 1 | 14.2508; 15.3046; 15.2593 90; 113.311; 90 | 3056.43 | Stapf, Manuel; Schmidt, Ute; Seichter, Wilhelm; Mazik, Monika Synthesis and crystal structure of 1,3-bis{[<i>N</i>,<i>N</i>-bis(2-hydroxyethyl)amino]methyl}-5-{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzene Acta Crystallographica Section E, 2022, 78 |
2244137 | CIF HKL Paper | C23 H20 Cl2 N4 O3 S | P 1 21/c 1 | 14.8117; 10.7086; 15.1887 90; 112.417; 90 | 2227.1 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Alfayomy, Abdallah M.; Seri, Sahar M. Abou; Abdel-Raheem, Shaban A. A.; Ul-Malik, Mokhtar A. Abd Crystal structure and Hirshfeld surface analysis of ethyl (3<i>E</i>)-5-(4-chlorophenyl)-3-{[(4-chlorophenyl)formamido]imino}-7-methyl-2<i>H</i>,3<i>H</i>,5<i>H</i>-[1,3]thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate Acta Crystallographica Section E, 2022, 78 |
2244138 | CIF HKL Paper | C8 H7 F N4 O | P 1 21/c 1 | 10.8398; 19.0207; 9.3307 90; 112.378; 90 | 1778.93 | Missioui, Mohcine; Guerrab, Walid; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef Crystal structure and Hirshfeld surface analysis of 2-azido-<i>N</i>-(4-fluorophenyl)acetamide Acta Crystallographica Section E, 2022, 78, 855-859 |
2244139 | CIF HKL Paper | C21 H26 N2 O3 | P 1 21/c 1 | 14.5241; 10.0718; 13.271 90; 97.042; 90 | 1926.69 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Abdel-Rahman, Laila H.; Abdel-Hameed, Mohamed; Albayati, Mustafa R.; Al-Taif, Elham A. Crystal structure and Hirshfeld surface analysis of (±)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)-2-(4-isobutylphenyl)propionohydrazide Acta Crystallographica Section E, 2022, 78, 860-863 |
2244140 | CIF HKL Paper | C14 H13 N O4 | P 1 21/n 1 | 11.6407; 7.4412; 42.2828 90; 93.038; 90 | 3657.42 | Faraj, Imane; Oubella, Ali; Chkirate, Karim; Al Mamari, Khalil; Hökelek, Tuncer; Mague, Joel T.; El Ghayati, Lhoussaine; Sebbar, Nada Kheira; Essassi, El Mokhtar Crystal structure, Hirshfeld surface analysis and DFT calculations of (<i>E</i>)-3-[1-(2-hydroxyphenylanilino)ethylidene]-6-methylpyran-2,4-dione Acta Crystallographica Section E, 2022, 78, 864-870 |
2244141 | CIF HKL Paper | C24 H23.5 F N4 O4.25 S | P 1 21/c 1 | 14.4316; 10.8518; 15.594 90; 109.941; 90 | 2295.74 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Alfayomy, Abdallah M.; Ragab, Fatma A. F.; Abd ul-Malik, Mokhtar A. Crystal structure and Hirshfeld surface analysis of ethyl (3<i>E</i>)-5-(4-fluorophenyl)3-{[(4-methoxyphenyl)formamido]imino}-7-methyl-2<i>H</i>,3<i>H</i>,5<i>H</i>-[1,3]thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate 0.25-hydrate Acta Crystallographica Section E, 2022, 78 |
2244142 | CIF HKL Paper | C11 H9 Br N2 O | P 1 21/c 1 | 7.5654; 11.4972; 12.1025 90; 105.583; 90 | 1013.99 | Tojiboev, Akmaljon; Elmuradov, Burkhon; Kattaev, Nuritdin; Abdurazakov, Asqar; Nasrullayev, Azizbek; Tashkhodjaev, Bakhodir Crystal structure, Hirshfeld surface analysis and DFT calculations of 7-bromo-2,3-dihydropyrrolo[2,1-<i>b</i>]quinazolin-9(1<i>H</i>)-one Acta Crystallographica Section E, 2022, 78 |
2244143 | CIF HKL Paper | C10 H10 Cl N5 O7 | P -1 | 8.3023; 10.0792; 10.1052 116.966; 105.481; 92.871 | 711.77 | Qiu, Qi-Ming; Song, Jian-Biao; Dong, Ai-Guo; Li, Chuan-Tao; Zheng, Zhi-Yuan Crystal structure of 4,4'-(diazenediyl)dipyridinium nitrate perchlorate Acta Crystallographica Section E, 2022, 78 |
2244144 | CIF HKL Paper | C9 H11 N5 O2 | P c a 21 | 24.367; 4.3979; 10.1424 90; 90; 90 | 1086.9 | Plutenko, Maksym O.; Shishkina, Svitlana V.; Shishkin, Oleg V.; Potaskalov, Vadim A.; Kalibabchuk, Valentina A. Crystal structure, Hirshfeld surface analysis and geometry optimization of 2-hydroxyimino-<i>N</i>-[1-(pyrazin-2-yl)ethylidene]propanohydrazide Acta Crystallographica Section E, 2022, 78 |
2244145 | CIF HKL Paper | C83.5 H96 B F15 N3 O P Ti | P -1 | 13.8643; 14.3017; 20.0502 86.4852; 80.0328; 73.6493 | 3756.9 | Fitschen, Kerstin; Frerichs, Nils; Yusufzadeh, Zainab; Schmidtmann, Marc; Beckhaus, Rüdiger Crystal structures of the Lewis acid–base adducts {[(C~6~H~11~)~2~N]~3~Ti–<i>LB</i>}^+^[MeB(C~6~F~5~)~3~]^{-^}·1.5C~7~H~8~; LB = (C~6~H~5~)~3~PO (1), <i>p</i>-F—C~6~H~4~CN (2) Acta Crystallographica Section E, 2022, 78 |
2244146 | CIF HKL | C72.5 H85 B F16 N4 Ti | P -1 | 12.1151; 13.2796; 21.1662 77.916; 88.8857; 87.9827 | 3327.5 | Fitschen, Kerstin; Frerichs, Nils; Yusufzadeh, Zainab; Schmidtmann, Marc; Beckhaus, Rüdiger Crystal structures of the Lewis acid–base adducts {[(C~6~H~11~)~2~N]~3~Ti–<i>LB</i>}^+^[MeB(C~6~F~5~)~3~]^{-^}·1.5C~7~H~8~; LB = (C~6~H~5~)~3~PO (1), <i>p</i>-F—C~6~H~4~CN (2) Acta Crystallographica Section E, 2022, 78 |
2244147 | CIF HKL Paper | C21 H22 N2 O4 | P 1 21/c 1 | 13.8608; 8.8352; 15.5411 90; 98.468; 90 | 1882.46 | Nchioua, Intissar; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef Crystal structure and Hirshfeld surface analysis of <i>N</i>-(2,6-dimethylphenyl)-2-[3-hydroxy-2-oxo-3-(2-oxopropyl)indolin-1-yl]acetamide Acta Crystallographica Section E, 2022, 78 |
2244148 | CIF HKL Paper | C36 H43 N O6 | P 1 21/c 1 | 27.091; 6.2408; 18.685 90; 90.975; 90 | 3158.6 | Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean Synthesis and crystal structure of ebastinium hydrogen fumarate Acta Crystallographica Section E, 2022, 78 |
2244149 | CIF HKL Paper | C24 H19 N O | I 1 2/a 1 | 18.6588; 5.4739; 35.5689 90; 100.729; 90 | 3569.37 | Cheng, Dong; Meng, Xiang-Zhen; Tian, Fuyu; Yan, Dong; Wang, Xiaofei; Qian, Xueli; Wang, Junnan Crystal structure and Hirshfeld surface analysis of 4-(3-methoxyphenyl)-2,6-diphenylpyridine Acta Crystallographica Section E, 2022, 78 |
2244150 | CIF HKL Paper | C37 H60 Cl N3 | P 1 21/n 1 | 12.253; 22.699; 12.884 90; 104.164; 90 | 3474.5 | Muñoz Sánchez, Gaby M.; Zdilla, Michael J. Crystal structure of <i>N</i>-butyl-2,3-bis(dicyclohexylamino)cyclopropeniminium chloride benzene monosolvate Acta Crystallographica Section E, 2022, 78 |
2244151 | CIF HKL Paper | C17 H14 Br N3 O4 | P b c a | 9.388; 12.226; 28.693 90; 90; 90 | 3293.3 | Naghiyev, Farid N.; Khrustalev, Victor N.; Venskovsky, Nikolai U.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of ethyl 2'-amino-5-bromo-3'-cyano-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-5'-carboxylate Acta Crystallographica Section E, 2022, 78 |
2244152 | CIF HKL Paper | C19 H26 N2 O4 | P -1 | 7.4141; 12.3595; 19.9917 86.695; 83.654; 82.182 | 1802.1 | Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher Syntheses and crystal structures of 4-(4-methoxyphenyl)piperazin-1-ium 4-methylbenzoate monohydrate and bis[4-(4-methoxyphenyl)piperazin-1-ium] benzene-1,2-dicarboxylate Acta Crystallographica Section E, 2022, 78 |
2244153 | CIF HKL Paper | C30 H38 N4 O6 | P n a 21 | 17.8424; 8.8124; 34.9337 90; 90; 90 | 5492.8 | Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher Syntheses and crystal structures of 4-(4-methoxyphenyl)piperazin-1-ium 4-methylbenzoate monohydrate and bis[4-(4-methoxyphenyl)piperazin-1-ium] benzene-1,2-dicarboxylate Acta Crystallographica Section E, 2022, 78 |
2244154 | CIF HKL Paper | C7 H6 N4 O3 | C 1 2/c 1 | 15.3747; 4.6699; 23.0423 90; 103.122; 90 | 1611.2 | Irrou, Ezaddine; Elmachkouri, Younesse Ait; Oubella, Ali; Ouchtak, Hassan; Dalbouha, Samira; Mague, Joel T.; Hökelek, Tuncer; El Ghayati, Lhoussaine; Sebbar, Nada Kheira; Taha, Mohamed Labd Crystal structure determination, Hirshfeld surface, crystal void, intermolecular interaction energy analyses, as well as DFT and energy framework calculations of 2-(4-oxo-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-1-yl)acetic acid Acta Crystallographica Section E, 2022, 78, 953-960 |
2244155 | CIF HKL Paper | C14 H26 Ni O20 S2 | P -1 | 6.5986; 7.4183; 13.2847 74.1712; 88.6035; 77.92 | 611.41 | Bettinger, Reuben T.; Squattrito, Philip J.; Aulakh, Darpandeep; Gianopoulos, Christopher G. Crystal structures of two new divalent transition-metal salts of carboxybenzenesulfonate anions Acta Crystallographica Section E, 2022, 78, 961-965 |
2244156 | CIF HKL Paper | C14 H26 Co O18 S2 | P -1 | 6.7774; 6.9866; 13.721 91.107; 90.401; 117.583 | 575.66 | Bettinger, Reuben T.; Squattrito, Philip J.; Aulakh, Darpandeep; Gianopoulos, Christopher G. Crystal structures of two new divalent transition-metal salts of carboxybenzenesulfonate anions Acta Crystallographica Section E, 2022, 78, 961-965 |
2244157 | CIF HKL Paper | B12 H10 O26 Rb6 | P n n m | 13.395; 9.251; 12.368 90; 90; 90 | 1532.6 | Qiu, Qi-Ming; Yan, Li; Song, Jian-Biao Crystal structure of Rb~6~[B~12~O~18~(OH)~6~]·2H~2~O Acta Crystallographica Section E, 2022, 78, 971-973 |
2244158 | CIF HKL Paper | C15 H12 F3 N O4 S | P 1 21/c 1 | 13.5689; 9.2906; 13.4358 90; 118.53; 90 | 1488.1 | Schinke, Jascha; Gelbrich, Thomas; Griesser, Ulrich J. Crystal structure, PIXEL calculations of intermolecular interaction energies and solid-state characterization of the herbicide isoxaflutole Acta Crystallographica Section E, 2022, 78 |
2244159 | CIF HKL Paper | B12 H3 K Mg2 O22 | P a -3 | 12.2966; 12.2966; 12.2966 90; 90; 90 | 1859.32 | Qiu, Qi-Ming; Song, Jian-Biao Crystal structure of MgK~0.5~[B~6~O~10~](OH)~0.5~·0.5H~2~O, poly[dimagnesium potassium bis(hexaborate) hydroxide monohydrate] Acta Crystallographica Section E, 2022, 78, 1003-1005 |
2244160 | CIF HKL Paper | C35 H22 Cl N O7 | P -1 | 8.0202; 9.8474; 19.4712 95.422; 94.693; 103.857 | 1477.66 | Selvanandan, S.; Anil kumar, H.; Srinivasa, H. T.; Palakshamurthy, B. S. Crystal structure and Hirshfeld surface analysis of 3-({4-[(4-cyanophenoxy)carbonyl]phenoxy}carbonyl)phenyl 4-(benzyloxy)-3-chlorobenzoate Acta Crystallographica Section E, 2022, 78 |
2244161 | CIF HKL Paper | C12 H13 N3 O S | I 1 a 1 | 8.1644; 15.9237; 9.6936 90; 106.661; 90 | 1207.33 | Mutalliev, Lukmonjon Z.; Abdullaev, Sirojiddin; Pirnazarova, Nasiba; Obidova, Ibodat; Turgunov, Kambarali; Yakubov, Ubaydullo; Ashurov, Jamshid M.; Elmuradov, Burkhan Zh.; Mamadrakhimov, Azimjon A. Synthesis, crystal structure and Hirshfeld surface analysis of (1<i>H</i>-benzimidazol-2-yl)(morpholin-4-yl)methanethione Acta Crystallographica Section E, 2022, 78 |
2244162 | CIF HKL Paper | C8 H5 N S3 | P -1 | 5.7955; 7.3789; 10.0344 89.459; 89.719; 78.956 | 421.15 | Schriver, Melbourne J.; George, Tanner; Masuda, Jason D. Synthesis and crystal structure of 3-phenyl-1,4,2-dithiazole-5-thione Acta Crystallographica Section E, 2022, 78 |
2244163 | CIF HKL Paper | C17 H21 F N2 O3 | P -1 | 6.239; 7.496; 17.817 93.55; 92.94; 94.87 | 827.3 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244164 | CIF HKL | C17 H21 Br N2 O3 | P 1 21/c 1 | 6.183; 37.748; 7.506 90; 93.69; 90 | 1748.2 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244165 | CIF HKL | C17 H19 I N2 O2 | P 1 21/c 1 | 10.8507; 23.4045; 13.3019 90; 102.491; 90 | 3298.13 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244166 | CIF HKL | C17 H19 N3 O4 | P 1 21/c 1 | 13.0683; 15.7868; 7.9255 90; 95.137; 90 | 1628.52 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244167 | CIF HKL | C17 H18 N4 O7 | P 1 21/c 1 | 7.779; 7.411; 31.357 90; 96.82; 90 | 1794.9 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244168 | CIF HKL | C17 H18 N4 O6 | P -1 | 5.707; 12.505; 13.116 97.41; 93.28; 102.82 | 901.5 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244169 | CIF HKL | C16 H17 N5 O7 | P 1 21/c 1 | 8.517; 6.825; 30.265 90; 95.33; 90 | 1751.7 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244170 | CIF HKL | C17 H22 N2 O3 | P 1 21/c 1 | 6.202; 34.573; 7.596 90; 93.83; 90 | 1625.1 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244171 | CIF HKL | C17 H22 N2 O3 S | P 1 21 1 | 8.325; 10.949; 18.418 90; 92.67; 90 | 1677 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244172 | CIF HKL | C14 H22 N2 O7 | P 21 21 21 | 7.1185; 7.5255; 29.955 90; 90; 90 | 1604.7 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244173 | CIF HKL | C14 H18 N2 O4 | P c a 21 | 26.702; 7.9626; 6.7571 90; 90; 90 | 1436.68 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
2244174 | CIF HKL Paper | C22 H34 N2 O5 | P 1 21/c 1 | 7.9531; 13.4224; 21.2015 90; 92.484; 90 | 2261.1 | Naeem, Marilyn; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The methanol and ethanol solvates of 4-glutarato-<i>N</i>,<i>N</i>-diisopropyltryptamine Acta Crystallographica Section E, 2022, 78 |
2244175 | CIF HKL Paper | C23 H36 N2 O5 | P 1 21/c 1 | 8.0087; 13.7968; 21.878 90; 90.749; 90 | 2417.2 | Naeem, Marilyn; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The methanol and ethanol solvates of 4-glutarato-<i>N</i>,<i>N</i>-diisopropyltryptamine Acta Crystallographica Section E, 2022, 78 |
2244176 | CIF HKL Paper | C15 H14 N2 O3 | P 1 n 1 | 4.5017; 14.047; 10.567 90; 96.3; 90 | 664.2 | Vinaya; Basavaraju, Yeriyur B.; Lakshmana, Beliyaiah; Yathirajan, Hemmige S.; Parkin, Sean Syntheses and crystal structures of benzyl <i>N</i>'-[(<i>E</i>)-2-hydroxybenzylidene]hydrazinecarboxylate and benzyl <i>N</i>'-[(<i>E</i>)-5-bromo-2-hydroxybenzylidene]hydrazinecarboxylate Acta Crystallographica Section E, 2022, 78 |
2244177 | CIF HKL Paper | C15 H13 Br N2 O3 | P 1 21/c 1 | 27.904; 11.1207; 9.0648 90; 94.485; 90 | 2804.3 | Vinaya; Basavaraju, Yeriyur B.; Lakshmana, Beliyaiah; Yathirajan, Hemmige S.; Parkin, Sean Syntheses and crystal structures of benzyl <i>N</i>'-[(<i>E</i>)-2-hydroxybenzylidene]hydrazinecarboxylate and benzyl <i>N</i>'-[(<i>E</i>)-5-bromo-2-hydroxybenzylidene]hydrazinecarboxylate Acta Crystallographica Section E, 2022, 78 |
2244178 | CIF HKL Paper | C17 H17 N3 O3 | P n a 21 | 18.7779; 10.0699; 15.7288 90; 90; 90 | 2974.18 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean Synthesis and crystal structures of 1-benzoyl-4-(4-nitrophenyl)piperazine and 1-(4-bromobenzoyl)-4-phenylpiperazine at 90K Acta Crystallographica Section E, 2022, 78 |
2244179 | CIF HKL Paper | C17 H17 Br N2 O | P 1 21 1 | 7.5162; 6.1125; 15.7249 90; 98.625; 90 | 714.28 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean Synthesis and crystal structures of 1-benzoyl-4-(4-nitrophenyl)piperazine and 1-(4-bromobenzoyl)-4-phenylpiperazine at 90K Acta Crystallographica Section E, 2022, 78 |
2244180 | CIF HKL Paper | C19 H26 Cl N Si | P 1 21/n 1 | 9.732; 19.0598; 10.9186 90; 110.526; 90 | 1896.7 | Schwab, Christoph; Voss, Andreas; Strohmann, Carsten Crystal structure and Hirshfeld surface analysis of <i>N-</i>{[diphenyl(vinyl)silyl]methyl}-2-methylpropan-2-ammonium chloride Acta Crystallographica Section E, 2022, 78 |
2244181 | CIF HKL Paper | C16 H13 Au Cl P S | P 21 21 21 | 10.0322; 12.0784; 12.9412 90; 90; 90 | 1568.1 | Neils, Thomas; LaDuca, Andrew; Bender, John E.; Staples, Richard J.; Biros, Shannon M. Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κ<i>P</i>]gold(I) Acta Crystallographica Section E, 2022, 78 |
2244182 | CIF HKL Paper | C12 H13 N3 | P n a 21 | 13.4639; 7.8555; 20.1288 90; 90; 90 | 2128.94 | Collis, Gavin; Bilyk, Alex; Kazanori, Ueno; Forsyth, Craig M. Intermolecular hydrogen bonding in <i>N</i>-methyl-<i>N</i>'-(pyridin-2-yl)benzene-1,2-diamine Acta Crystallographica Section E, 2022, 78 |
2244183 | CIF HKL Paper | C36 H39 Cl3 N8 O2 | I 4/m | 17.305; 17.305; 26.04 90; 90; 90 | 7798 | van der Peet, Phillip L.; Joyce, Rohan D.; Ott, Holger; Marcuccio, Sebastian M.; White, Jonathan M.; Williams, Spencer J. Synthesis and structure of clozapine <i>N</i>-oxide hemi(hydrochloride): an infinite hydrogen-bonded poly[<i>n</i>]catenane Acta Crystallographica Section E, 2022, 78 |
2244184 | CIF HKL Paper | C13 H16 O3 | P -1 | 4.5931; 8.9134; 15.0764 74.808; 85.309; 77.43 | 581.18 | Cattey, Hélène; Boni, Gilles; Pourchet, Sylvie; Plasseraud, Laurent Crystal structure of the monoglycidyl ether of isoeugenol Acta Crystallographica Section E, 2022, 78 |
2244185 | CIF HKL Paper | C14 H14 Cl2 N2 O2 Zn | P 1 21/n 1 | 20.6241; 7.3309; 20.6485 90; 90.532; 90 | 3121.8 | Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H. Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride Acta Crystallographica Section E, 2021, 77, 880-886 |
2244186 | CIF HKL Paper | C16 H18 Cl2 N2 O2 Zn | P 1 21 1 | 7.3802; 8.2491; 14.5953 90; 97.852; 90 | 880.23 | Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H. Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride Acta Crystallographica Section E, 2021, 77, 880-886 |
2244187 | CIF HKL Paper | C16 H18 Cl2 N2 O2 Zn | C 1 2/c 1 | 13.9452; 18.9742; 7.0651 90; 108.021; 90 | 1777.7 | Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H. Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride Acta Crystallographica Section E, 2021, 77, 880-886 |
2244188 | CIF HKL Paper | C16 H18 Cl2 N2 O2 Zn | P 1 21/c 1 | 6.8376; 17.2694; 14.9856 90; 96.893; 90 | 1756.73 | Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H. Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride Acta Crystallographica Section E, 2021, 77, 880-886 |
2244189 | CIF HKL Paper | C14 H14 Cl2 N2 O4 Zn | C 1 c 1 | 7.0532; 21.3776; 11.1181 90; 106.477; 90 | 1607.5 | Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H. Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride Acta Crystallographica Section E, 2021, 77, 880-886 |
2244190 | CIF HKL Paper | C23 H25 Br2 N O2 | P 1 21/n 1 | 13.367; 19.966; 16.919 90; 106.099; 90 | 4338.4 | Stapf, Manuel; Leibiger, Betty; Schwarzer, Anke; Mazik, Monika Crystal structures of 2-[3,5-bis(bromomethyl)-2,4,6-triethylbenzyl]isoindoline-1,3-dione and 2-{5-(bromomethyl)-3-[(1,3-dioxoisoindolin-2-yl)methyl]-2,4,6-triethylbenzyl}isoindoline-1,3-dione Acta Crystallographica Section E, 2021, 77, 919-923 |
2244191 | CIF HKL Paper | C31 H29 Br N2 O4 | P 1 21/n 1 | 12.899; 12.9748; 16.763 90; 109.168; 90 | 2650 | Stapf, Manuel; Leibiger, Betty; Schwarzer, Anke; Mazik, Monika Crystal structures of 2-[3,5-bis(bromomethyl)-2,4,6-triethylbenzyl]isoindoline-1,3-dione and 2-{5-(bromomethyl)-3-[(1,3-dioxoisoindolin-2-yl)methyl]-2,4,6-triethylbenzyl}isoindoline-1,3-dione Acta Crystallographica Section E, 2021, 77, 919-923 |
2244192 | CIF HKL Paper | C22 H27 N O4 | P -1 | 7.2941; 9.6773; 14.4302 82.1992; 88.3216; 75.9397 | 978.92 | Steiger, Scott A.; Li, Chun; Oliver, Allen G.; Natale, Nicholas R. Synthesis, crystal structures, and Hirshfeld analysis of three hexahydroquinoline derivatives Acta Crystallographica Section E, 2022, 78 |
2244193 | CIF HKL Paper | C22 H27 N O4 | P 1 21/n 1 | 15.3492; 14.0314; 18.3862 90; 90.0834; 90 | 3959.8 | Steiger, Scott A.; Li, Chun; Oliver, Allen G.; Natale, Nicholas R. Synthesis, crystal structures, and Hirshfeld analysis of three hexahydroquinoline derivatives Acta Crystallographica Section E, 2022, 78 |
2244194 | CIF HKL Paper | C21 H25 N O5 | P 1 21/n 1 | 9.2745; 22.1655; 11.3475 90; 108.201; 90 | 2216.03 | Steiger, Scott A.; Li, Chun; Oliver, Allen G.; Natale, Nicholas R. Synthesis, crystal structures, and Hirshfeld analysis of three hexahydroquinoline derivatives Acta Crystallographica Section E, 2022, 78 |
2244195 | CIF HKL Paper | C16 H17 N5 Ni S2 | C 1 2/c 1 | 18.2934; 11.7472; 9.7341 90; 117.043; 90 | 1863.11 | Näther, Christian; Jess, Inke; Krebs, Christoph Synthesis, crystal structure and properties of <i>catena</i>-poly[[[bis(3-methylpyridine-κ<i>N</i>)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] Acta Crystallographica Section E, 2022, 78 |
2244196 | CIF HKL Paper | C38 H38 Fe N12 O2 | A e a 2 | 12.6854; 26.315; 10.6511 90; 90; 90 | 3555.5 | Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu; Seredyuk, Maksym Crystal structure of bis{3-(3,4-dimethylphenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-4<i>H</i>-1,2,4-triazol-4-ido}iron(II) methanol disolvate Acta Crystallographica Section E, 2022, 78 |
2244197 | CIF Paper | C5 H6 O3 | P 1 21/m 1 | 3.8283; 10.972; 6.1096 90; 93.523; 90 | 256.14 | Chandrasekaran, Chandru P.; Donahue, James P. Crystal structure of 4,5-dimethyl-1,3-dioxol-2-one Acta Crystallographica Section E, 2022, 78 |
2244198 | CIF HKL Paper | C8 H8 O2 S2 | P c a 21 | 10.7521; 5.5245; 14.48 90; 90; 90 | 860.1 | Kellou, Sabah; Brihi, Ouarda; Chetioui, Souheyla; Salah Eddine, Lemallem; Abdelali, Fiala; Boudjada, Ali Synthesis and crystal structure of 2-(1,3-dithietan-2-ylidene)cyclohexane-1,3-dione Acta Crystallographica Section E, 2022, 78 |
2244199 | CIF HKL Paper | C8 H7 Cl O2 | P 1 21/n 1 | 4.9172; 12.7016; 11.8573 90; 96.294; 90 | 736.1 | Priyanka, Prabhakar; Jayanna, Bidarur K.; Vinaya; Shankara Prasad, Holehundi J.; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean Synthesis and crystal structure of 2-chloro-1-(3-hydroxyphenyl)ethanone Acta Crystallographica Section E, 2022, 78 |
2244200 | CIF HKL Paper | C36 H32 Br2 Fe N12 O4 | P n a 21 | 27.4318; 12.6723; 10.6434 90; 90; 90 | 3699.9 | Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu; Seredyuk, Maksym Crystal structure of bis{3-(3-bromo-4-methoxyphenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-1,2,4-triazol-3-ato}iron(II) methanol disolvate Acta Crystallographica Section E, 2022, 78, 1138-1142 |
2244201 | CIF HKL Paper | C30 H42 N4 O2 | P b c a | 12.0297; 14.6357; 32.763 90; 90; 90 | 5768.4 | Pollock, Alicia A.; Huther, Holly A.; Birch, Cole M.; Reinheimer, Eric W.; Lewis, David E.; Gerlach, Deidra L. Crystal structure of 2-(2,2,6,6-tetramethylpiperidin-4-yl)-6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1<i>H</i>-benz[<i>de</i>]isoquinoline-1,3(2<i>H</i>)-dione Acta Crystallographica Section E, 2022, 78 |
2244202 | CIF HKL Paper | C12 H16 Cu N6 O12 | P 1 21/c 1 | 5.4741; 22.5679; 7.6478 90; 92.286; 90 | 944.05 | Kamolov, Sanjar; Babaev, Bakhrom; Ibragimov, Aziz; Yakubov, Yuldash; Abdullaev, Akhrorjon; Ibragimov, Bakhtiyar; Ashurov, Jamshid Synthesis, structure and Hirshfeld surface analysis of diaquadinitratobis(4-nitroaniline)copper(II) Acta Crystallographica Section E, 2022, 78 |
2244203 | CIF HKL Paper | C34 H26 Cl4 Fe N12 O2 | P n n a | 10.4669; 26.589; 12.8313 90; 90; 90 | 3571 | Znovjyak, Kateryna; Seredyuk, Maksym; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu Crystal structure of bis{3-(3,5-dichlorophenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-4<i>H</i>-1,2,4-triazol-4-ido}iron(II) methanol disolvate Acta Crystallographica Section E, 2022, 78 |
2244204 | CIF HKL Paper | C46 H42 N4 Ni O4 | P -1 | 4.6914; 13.0677; 16.9923 68.441; 83.739; 88.032 | 963.05 | Banna, Md. Hasan Al; Howlader, Md. Belayet Hossain; Miyatake, Ryuta; Sheikh, Md. Chanmiya; Zangrando, Ennio Crystal structure of bis{4-[(4-methylbenzyl)oxy]-<i>N</i>'-(4-methylbenzylidene)benzohydrazidato}nickel(II) Acta Crystallographica Section E, 2022, 78, 1081-1083 |
2244205 | CIF Paper | C12 H19 N3 O8 S | P 21 21 21 | 7.9857; 9.0145; 22.1621 90; 90; 90 | 1595.39 | Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Glidewell, Christopher; Parkin, Sean Synthesis and crystal structure of topiramate azidosulfate at 90K and 298K Acta Crystallographica Section E, 2022, 78, 984-988 |
2244206 | CIF Paper | C12 H19 N3 O8 S | P 21 21 21 | 8.0717; 9.1135; 22.506 90; 90; 90 | 1655.6 | Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Glidewell, Christopher; Parkin, Sean Synthesis and crystal structure of topiramate azidosulfate at 90K and 298K Acta Crystallographica Section E, 2022, 78, 984-988 |
2244207 | CIF HKL Paper | C30 H40 N6 Ni O2 S2 | C 1 2/c 1 | 18.5763; 11.6179; 15.8998 90; 97.448; 90 | 3402.51 | Krebs, Christoph; Jess, Inke; Näther, Christian Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis(isothiocyanato-κ<i>N</i>)tetrakis(3-methylpyridine-κ<i>N</i>)nickel(II) Acta Crystallographica Section E, 2022, 78, 993-998 |
2244208 | CIF HKL Paper | C30 H34 N8 Ni S2 | C 1 2/c 1 | 18.799; 11.3033; 15.8639 90; 96.825; 90 | 3347.04 | Krebs, Christoph; Jess, Inke; Näther, Christian Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis(isothiocyanato-κ<i>N</i>)tetrakis(3-methylpyridine-κ<i>N</i>)nickel(II) Acta Crystallographica Section E, 2022, 78, 993-998 |
2244209 | CIF HKL Paper | C30 H38 N6 Ni O S2 | P 1 21/n 1 | 10.2275; 25.0468; 12.718 90; 94.6; 90 | 3247.4 | Krebs, Christoph; Jess, Inke; Näther, Christian Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis(isothiocyanato-κ<i>N</i>)tetrakis(3-methylpyridine-κ<i>N</i>)nickel(II) Acta Crystallographica Section E, 2022, 78, 993-998 |
2244210 | CIF Paper | C7 H13 N O3 | P 1 21/n 1 | 6.0404; 8.6114; 17.611 90; 98.771; 90 | 905.35 | El Mestehdi, Aly Dawa; Abba, Moctar; El Housseine, Mohamed Lemine; Ould Hadou, Abderrahmane; Barry, Aliou Hamady; Ould Elemine, Brahim; Jelsch, Christian; Gaye, Mohamed Synthesis, crystal structure and Hirshfeld surface analysis of <i>tert</i>-butyl <i>N</i>-acetylcarbamate Acta Crystallographica Section E, 2022, 78, 1072-1076 |
2244211 | CIF HKL Paper | C17 H18 O3 | P 1 21 1 | 16.1906; 7.5752; 17.7591 90; 95.36; 90 | 2168.6 | Banna, Md. Hasan Al; Ansary, Md. Rezaul Haque; Miyatake, Ryuta; Sheikh, Md. Chanmiya; Zangrando, Ennio Crystal structure of ethyl 4-[(4-methylbenzyl)oxy]benzoate Acta Crystallographica Section E, 2022, 78, 1077-1080 |
2244212 | CIF HKL Paper | C17 H18 F N5 O2 | P -1 | 7.694; 15.013; 15.281 71.04; 77.874; 87.78 | 1631.3 | Richter, Adrian; Goddard, Richard; Schönefeld, Roy; Imming, Peter; Seidel, Rüdiger W. Structural characterization and antimycobacterial evaluation of a benzimidazole analogue of the antituberculosis clinical drug candidate TBA-7371 Acta Crystallographica Section E, 2022, 78 |
2244213 | CIF HKL Paper | C72 H112 Dy Mn4 N8 Na O28 | P 4/n :2 | 18.2654; 18.2654; 13.4219 90; 90; 90 | 4477.9 | Aziz, Ozha A.; Zeller, Matthias; Zaleski, Curtis M. Crystal structure of a heterotrimetallic 12-metallacrown-4 with 2-propylvalerate anion bridges Acta Crystallographica Section E, 2022, 78 |
2244214 | CIF HKL Paper | C28 H21 F N2 O7 S | P -1 | 8.1589; 12.2053; 12.9129 101.569; 93.086; 92.481 | 1256 | Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; Arasambattu MohanaKrishnan, K. Crystal structures of two new carbazole derivatives: ethyl 9-(benzenesulfonyl)-2-(4-fluoro-2-nitrophenyl)-6-methoxy-9<i>H</i>-carbazole-3-carboxylate and 12-(benzenesulfonyl)-12<i>H</i>-quinolino[4,3-<i>b</i>]carbazole Acta Crystallographica Section E, 2022, 78 |
2244215 | CIF HKL Paper | C25 H16 N2 O2 S | P 1 21/n 1 | 10.142; 12.097; 16.2218 90; 104.846; 90 | 1923.8 | Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; Arasambattu MohanaKrishnan, K. Crystal structures of two new carbazole derivatives: ethyl 9-(benzenesulfonyl)-2-(4-fluoro-2-nitrophenyl)-6-methoxy-9<i>H</i>-carbazole-3-carboxylate and 12-(benzenesulfonyl)-12<i>H</i>-quinolino[4,3-<i>b</i>]carbazole Acta Crystallographica Section E, 2022, 78 |
2244216 | CIF HKL Paper | C23 H92 Fe4 Li6 N23 Se8 | P -1 | 11.495; 11.665; 22.233 92.885; 92.383; 103.51 | 2890.7 | Fuss, Friederike; Thiele, Günther [Li~6~(C~2~N~2~H~8~)~11.5~][Fe~4~Se~8~]: the first lithium-containing chalcogenidotetraferrate synthesized in solution Acta Crystallographica Section E, 2022, 78 |
2244217 | CIF HKL Paper | C72 H88 Cu2 N4 O16 | P 1 21/n 1 | 15.542; 14.001; 16.3217 90; 94.791; 90 | 3539.25 | Chong, Magdalene W. S.; Ottoboni, Sara; Martin, Alan R. G.; Bowering, Deborah; Price, Chris J.; Nordon, Alison; Oswald, Iain D. H.; Ward, Martin R. Crystal structure of a copper–mefenamate complex solvated with diglyme and water Acta Crystallographica Section E, 2022, 78 |
2244218 | CIF HKL Paper | C14 H10 S2 | P b c a | 7.84; 16; 18.51 90; 90; 90 | 2322 | Brown, Loren C.; Ghiassi, Kamran B.; Fulton, Ashley C.; Thum, Matthew Crystal structure of dibenzo[<i>c</i>,<i>e</i>]thiepine-5(7<i>H</i>)-thione Acta Crystallographica Section E, 2022, 78 |
2311093 | CIF | Hf Na2 O7 Si2 | P -1 | 6.6123; 8.7948; 5.41074 92.603; 94.0843; 71.3262 | 297.249 | Massoni, Nicolas; Pierrick, Chevreux Crystal structure of Na~2~HfSi~2~O~7~ by Rietveld refinement Acta Crystallographica, Section e, 2016, 72, 1434 |
9007893 | CIF | As2 Cd O6 | P -3 1 m | 4.8269; 4.8269; 4.866 90; 90; 120 | 98.184 | Weil, M. Cadmium(II) metaarsenate(V), CdAs2O6 Acta Crystallographica, Section E, 2001, 57, i22-i23 |
9007894 | CIF | H4 Mg O5 Se | P 1 21/n 1 | 6.4818; 8.7975; 7.6367 90; 98.753; 90 | 430.401 | Johnston, M. G.; Harrison, W. T. A. Magnesium selenite dihydrate, MgSeO3*2H2O Acta Crystallographica, Section E, 2001, 57, i24-i25 |
9007895 | CIF | Fe H14 O11 S | P 1 21/c 1 | 13.9969; 6.4803; 11.0211 90; 105.596; 90 | 962.853 | Fronczek, F. R.; Collins, S. N.; Chan, J. Y. Refinement of ferrous sulfate heptahydrate (melanterite) with low-temperature CCD data Note: T = 120 K Locality: synthetic Acta Crystallographica, Section E, 2001, 57, i26-i27 |
9007897 | CIF | Ni3 O14 P4 Sr | P 1 21/c 1 | 7.4116; 7.6542; 9.4486 90; 112.194; 90 | 496.304 | Bolte, M. SrNi3(P2O7)2 Acta Crystallographica, Section E, 2001, 57, i30-i31 |
9007898 | CIF | C3 Na4 O11 U | P -3 c 1 | 9.338; 9.338; 12.817 90; 90; 120 | 967.887 | Cisarova, I.; Skala, R.; Ondrus, P.; Drabek, M. Trigonal Na4[UO2(CO3)3] Note: synthetic polymorph of cejkaite Acta Crystallographica, Section E, 2001, 57, i32-i34 |
9007902 | CIF | H10 Na2 O8 S2 | P 1 21/c 1 | 5.947; 21.574; 7.526 90; 103.82; 90 | 937.637 | Prasad S M Rani A Rerefinement of sodium thiosulfate pentahydrate Acta Crystallographica, Section E, 2001, 57, i67-i69 |
9007904 | CIF | B Ga O4 Pb | P n m a | 6.9944; 5.8925; 8.2495 90; 90; 90 | 339.999 | Park, H.; Barbier, J. PbGaBO4, an orthoborate with a new structure-type Acta Crystallographica, Section E, 2001, 57, i82-i84 |
9007905 | CIF | Mn O3 Yb | P 63 c m | 6.0584; 6.0584; 11.3561 90; 90; 120 | 360.974 | Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M. Hexagonal YbMnO3 revisited Acta Crystallographica, Section E, 2001, 57, i87-i89 |
9007906 | CIF | Fe0.05 Mn0.95 S | P 63 m c | 3.982; 3.982; 6.445 90; 90; 120 | 88.503 | Eriksson, L.; Kalinowski, M. P. Mn1-xFexS, x=0.05, an example of an anti-wurtzite structure Acta Crystallographica, Section E, 2001, 57, i92-i93 |
9007907 | CIF | C2 H6 K4 O9 | C 1 2/c 1 | 11.8175; 13.7466; 7.1093 90; 120.769; 90 | 992.34 | Skakle, J. M. S.; Wilson, M.; Feldman, J. Dipotassium carbonate sesquihydrate: rerefinement against new intensity data Acta Crystallographica, Section E, 2001, 57, i94-i97 |
9007909 | CIF | Lu Mn O3 | P 63 c m | 6.038; 6.038; 11.361 90; 90; 120 | 358.702 | Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M. Hexagonal LuMnO3 revisited Acta Crystallographica, Section E, 2001, 57, i101-i103 |
9007910 | CIF | Cu H10 O9 Se | P -1 | 6.083; 6.226; 10.867 77.14; 82.2; 72.91 | 382.43 | Kolitsch, U. Copper(II) selenate pentahydrate, CuSeO4*5H2O Acta Crystallographica, Section E, 2001, 57, i104-i105 |
9007913 | CIF | H Mn O5 Pb V | P n m a | 7.646; 6.179; 9.507 90; 90; 90 | 449.155 | Kolitsch, U. Refinement of pyrobelonite, PbMnIIVO4(OH), a member of the descloizite group Acta Crystallographica, Section E, 2001, 57, i119-i121 |
9007915 | CIF | H12 Mg O10 Se | C 1 2/c 1 | 10.224; 7.37; 24.866 90; 98.41; 90 | 1853.53 | Kolitsch, U. Magnesium selenate hexahydrate, MgSeO4*6H2O Acta Crystallographica, Section E, 2002, 58, i3-i5 |
9007916 | CIF | Mg O7 P2 Sr | P 1 21/n 1 | 5.3046; 8.3053; 12.7 90; 90.502; 90 | 559.493 | Tahiri, A. A.; Bali, B. E.; Lachkar, M.; Ouarsal, R.; Zavalij, P. Y. SrMgP2O7 Acta Crystallographica, Section E, 2002, 58, i9-i11 |
9007917 | CIF | Co2 O7 P2 | P 1 21/c 1 | 7.0022; 8.3634; 9.0114 90; 113.6; 90 | 483.59 | Bali, B. E.; Bolte, M. Rerefinement of cobalt diphosphate against new intensity data Acta Crystallographica, Section E, 2002, 58, i32-i33 |
9007921 | CIF | Mn O5 Te2 | P b c n | 7.3114; 10.9216; 6.1711 90; 90; 90 | 492.776 | Johnston, M. G.; Harrison, W. T. A. Manganese tellurite, beta-MnTe2O5 Acta Crystallographica, Section E, 2002, 58, i59-i61 |
9007923 | CIF | Cl2 Hg N4 O6 | P n m a | 15.5758; 5.4976; 11.2826 90; 90; 90 | 966.124 | Nockemann, P.; Meyer, G. Ammonium mercury(II) dichloride nitrate, (NH4)2HgCl2(NO3)2 Acta Crystallographica, Section E, 2002, 58, i68-i69 |
9007924 | CIF | O13 Si3 Sm5 | P 63/m | 9.4959; 9.4959; 7.0361 90; 90; 120 | 549.459 | Morgan, M. G.; Wang, M.; Mar, A. Samarium orthosilicate oxyapatite, Sm5(SiO4)3O Acta Crystallographica, Section E, 2002, 58, i70-i71 |
9007925 | CIF | Dy4 S12 Si3 | P 1 21/n 1 | 9.813; 10.9387; 16.36 90; 102.86; 90 | 1712.06 | Hatscher, S. T.; Urland, W. Dysprosium thiosilicate, Dy4(SiS4)3 Acta Crystallographica, Section E, 2002, 58, i74-i75 |
9007932 | CIF | Cl Cr K O3 | P 1 21/c 1 | 7.838; 7.493; 7.812 90; 91.4; 90 | 458.663 | Kolitsch, U. Redetermination of potassium chlorochromate, KCrO3Cl Acta Crystallographica, Section E, 2002, 58, i105-i107 |
9007935 | CIF | Al Cs Mo2 O8 | P -3 m 1 | 5.551; 5.551; 8.037 90; 90; 120 | 214.47 | Tomaszewski, P. E.; Pietraszko, A.; Maczka, M.; Hanuza, J. CsAl(MoO4)2 Acta Crystallographica, Section E, 2002, 58, i119-i120 |
9007937 | CIF | Al Mo2 Na O8 | C 1 2/c 1 | 9.621; 5.339; 13.146 90; 90.01; 90 | 675.264 | Kolitsch, U.; Macka, M.; Hanuza, J. NaAl(MoO4)2: a rare structure type among layered yavapaiite-related AM(XO4)2 compounds Acta Crystallographica, Section E, 2003, 59, i10-i13 |
9007938 | CIF | Al Ba Ca F7 | P 1 2/n 1 | 5.3664; 5.3846; 18.8262 90; 92.319; 90 | 543.555 | Werner, F.; Weil, M. alpha-BaCaAlF7 Acta Crystallographica, Section E, 2003, 59, i17-i19 |
9007941 | CIF | H8 Mg Na O10 P3 | P b c a | 14.806; 9.078; 14.811 90; 90; 90 | 1990.73 | Ouarsal, R.; Tahiri, A. A.; Lachkar, M.; Dusek, M.; Fejfarova, K.; El Bali, B. Sodium magnesium tris(dihydrogenphosphite) monohydrate, NaMg(H2PO3)3*H2O Acta Crystallographica, Section E, 2003, 59, i33-i35 |
9007943 | CIF | B4 Hg O7 | P b c a | 8.3994; 8.8066; 14.137 90; 90; 90 | 1045.72 | Weil, M. HgB4O7, a member of the isotypic MIIB4O7 family (MII = Mg, Mn, Zn, Cd) Acta Crystallographica, Section E, 2003, 59, i40-i42 |
9007944 | CIF | Bi3.041 Mo2 O12 Sc0.959 | C 1 2/c 1 | 16.996; 11.601; 5.319 90; 104.67; 90 | 1014.56 | Kolitsch, U.; Tillmanns, E. Bi3ScMo2O12: the difference from Bi3FeMo2O12 Acta Crystallographica, Section E, 2003, 59, i43-i46 |
9007946 | CIF | H8 K2 O16 P4 Zn | P -1 | 6.827; 7.333; 7.57 80.753; 72.547; 83.442 | 355.949 | Tahiri, A. A.; ouarsal R; Lachkar, M.; Zavalij, P. Y.; El Bali, B. Dipotassium zinc bis(dihydrogendiphosphate) dihydrate, K2Zn(H2P2O7)2*2H2O Acta Crystallographica, Section E, 2003, 59, i50-i52 |
9007947 | CIF | Li3 Mo3 O12 Sc | P n m a | 5.13; 10.56; 17.745 90; 90; 90 | 961.296 | Kolitsch, U.; Tillmanns, E. Li3Sc(MoO4)3: substitutional disorder on three (Li,Sc) sites Acta Crystallographica, Section E, 2003, 59, i55-i58 |
9007952 | CIF | Li3 O4 Ta | C 1 2/c 1 | 8.508; 8.516; 9.338 90; 116.869; 90 | 603.535 | du Boulay, D.; Sakaguchi, A.; Suda, K.; Ishizawa, N. Reinvestigation of beta-Li3TaO4 Acta Crystallographica, Section E, 2003, 59, i80-i82 |
9007953 | CIF | Se3 Yb2 | F d d d :2 | 8.0183; 11.272; 23.961 90; 90; 90 | 2165.65 | Assoud, A.; Kleinke, H. Ytterbium sesquiselenide Yb2Se3 Acta Crystallographica, Section E, 2003, 59, i103-i104 |
9007954 | CIF | Fe1.839 H Mg0.161 O5 P | P 1 21/a 1 | 12.274; 13.169; 9.754 90; 108.64; 90 | 1493.9 | Kolitsch, U. Mg-rich wolfeite, (Fe,Mg)2(PO4)(OH): structure refinement and Raman spectroscopic data Acta Crystallographica, Section E, 2003, 59, i125-i128 |
9007957 | CIF | Cr3 Cs2 O10 | P b c a | 11.887; 9.671; 19.493 90; 90; 90 | 2240.9 | Kolitsch, U. alpha-Cs2Cr3O10 Acta Crystallographica, Section E, 2003, 59, i164-i166 |
9007959 | CIF | Na3 O S3 V | C m c 21 | 9.6673; 11.9122; 5.8846 90; 90; 90 | 677.664 | Huang, F. Q.; Ibers, J. A. Na3VOS3 Acta Crystallographica, Section E, 2004, 60, i6-i7 |
9007960 | CIF | Rb2 S4 W | P n m a | 9.6254; 7.0218; 12.3761 90; 90; 90 | 836.471 | Yao, J.; Ibers, J. A. Dirubidium tetrathiotungstate, Rb2[WS4] Acta Crystallographica, Section E, 2004, 60, i10-i11 |
9007962 | CIF | Ca K O9 P3 | P -6 c 2 | 6.809; 6.809; 10.376 90; 90; 120 | 416.608 | Sandstrom, M.; Bostrom, D. Calcium potassium cyclo-triphosphate Acta Crystallographica, Section E, 2004, 60, i15-i17 |
9007965 | CIF | Cs La O12 P4 | P 1 21 1 | 7.218; 9.254; 8.864 90; 99.377; 90 | 584.163 | Sun, T.; Shen, G.; Wang, X.; Wang, R.; Wei, J.; Shen, D. CsLa(PO3)4 Acta Crystallographica, Section E, 2004, 60, i28-i30 |
9007966 | CIF | Cl2 Cu H16 O16 | P 1 21/c 1 | 6.2908; 12.4043; 9.2181 90; 106.146; 90 | 690.943 | Li, X. H.; Xia, F. Y.; Xiao, H. P.; Hu, M. L. Hexaaquacopper(II) diperchlorate dihydrate Acta Crystallographica, Section E, 2004, 60, i31-i32 |
9007972 | CIF | Br Eu I | P n m a | 8.3723; 4.7404; 9.799 90; 90; 90 | 388.903 | Liao, W.; Liu, X.; Dronskowski, R. Europium(II) bromide iodide Acta Crystallographica, Section E, 2004, 60, i69-i71 |
9007976 | CIF | Cr H28 N O20 S2 | P a -3 | 12.2491; 12.2491; 12.2491 90; 90; 90 | 1837.86 | Rempfer, N.; Lerner, H. W.; Bolte, M. The ammonium chromium(III) alum NH4Cr(SO4)2*12H2O Acta Crystallographica, Section E, 2004, 60, i80-i81 |
9007978 | CIF | Li O12 P4 Yb | C 1 2/c 1 | 16.194; 7.024; 9.498 90; 125.91; 90 | 875.031 | Zarkouna, E. B.; Driss, A. LiYb(PO3)4 Acta Crystallographica, Section E, 2004, 60, i102-i104 |
9007983 | CIF | Ca0.312 Fe2 Mg Na0.376 O12 P3 | C 1 2/c 1 | 11.852; 12.458; 6.3861 90; 113.84; 90 | 862.47 | Zid, M. F.; Driss, A.; Jouini, T. (Na0.38,Ca0.31)MgFe2P3O12 Acta Crystallographica, Section E, 2005, 61, i46-i48 |
9007984 | CIF | Cs2 O15 Si6 Th | P c a 21 | 16.292; 7.2154; 13.68 90; 90; 90 | 1608.13 | Woodward, J. D.; Almond, P. M.; Albrecht-Schmitt T E Caesium thorium silicate, Cs2ThSi6O15 Acta Crystallographica, Section E, 2005, 61, i58-i60 |
9007985 | CIF | As4 Fe3 K3 O16 | C m c e | 10.898; 21.521; 6.623 90; 90; 90 | 1553.33 | Ouerfelli, N.; Zid, M. F.; Jouini, T. Compose a charpente bidimensionnelle K3Fe3(AsO4)4 Acta Crystallographica, Section E, 2005, 61, i67-i69 |
9007986 | CIF | Ce2 O7 Si2 | P 41 | 6.7964; 6.7964; 24.7282 90; 90; 90 | 1142.22 | Deng, B.; Ibers, J. A. Dicerium disilicate, Ce2[Si2O7] Acta Crystallographica, Section E, 2005, 61, i76-i78 |
9007987 | CIF | H8 Mn2 N2 O12 S3 | P 21 3 | 10.188; 10.188; 10.188 90; 90; 90 | 1057.47 | Zhang, X. M.; Hao, Z. M.; Ng, S. W. Langbeinite-type (NH4)2Mn2(SO4)3 Acta Crystallographica, Section E, 2005, 61, i82-i83 |
9007988 | CIF | Cd O3 Si | P 1 21/c 1 | 6.9463; 7.2563; 15.0697 90; 94.791; 90 | 756.926 | Weil, M. Parawollastonite-type Cd3[Si3O9] Acta Crystallographica, Section E, 2005, 61, i102-i104 |
9007989 | CIF | Co H8 O12 P2 Zn2 | P n m a | 10.568; 18.258; 5.025 90; 90; 90 | 969.576 | Wu, W. Y.; Liang, X. Q.; Li, Y. Z. CoZn2(PO4)2*4H2O, a cobalt-doped modification of hopeite Acta Crystallographica, Section E, 2005, 61, i105-i107 |
9007990 | CIF | H8 Ni O12 P2 Zn2 | P n m a | 10.562; 18.224; 5.0133 90; 90; 90 | 964.969 | Wu, W. Y.; Liang, X. Q.; Li, Y. Z. NiZn2(PO4)2*4H2O, a nickel-doped modification of hopeite Acta Crystallographica, Section E, 2005, 61, i108-i110 |
9007991 | CIF HKL Paper | K Nb5 O13 | P b c m | 5.672; 10.737; 16.742 90; 90; 90 | 1019.6 | Kwak, J.; Yun, H.; Chae, H. K. A new potassium niobate, KNb~5~O~13~ Acta Crystallographica Section E, 2005, 61, i132-i134 |
9007994 | CIF | Ba5 Cl O12 V3 | P 63/m | 10.5565; 10.5565; 7.7584 90; 90; 120 | 748.76 | Roh, Y. H.; Hong, S. T. Apatite-type Ba5(VO4)3Cl Acta Crystallographica, Section E, 2005, 61, i140-i142 |
9007997 | CIF | As2 Ca1.5 Na Nb2 O12 | C 1 2/c 1 | 6.73; 22.302; 7.4309 90; 113.827; 90 | 1020.26 | Amor, R. B.; Zid, M. F. NaCa1.5(NbO)2O2(AsO4)2 Acta Crystallographica, Section E, 2005, 61, i228-i230 |
9007998 | CIF | Cr4 K0.31 Li4.998 Na0.69 O24 P6 | R -3 :H | 8.3; 8.3; 22.469 90; 90; 120 | 1340.51 | Kouass, S.; Boughzala, H. NASICON-type Li2.5K0.16Na0.34Cr2(PO4)3 Acta Crystallographica, Section E, 2005, 61, i231-i233 |
9007999 | CIF | Mg O5 Te2 | P b c n | 7.2391; 10.658; 5.988 90; 90; 90 | 462 | Weil, M. Redetermination of MgTe2O5 Acta Crystallographica, Section E, 2005, 61, i237-i239 |
9008000 | CIF | B8 Ca H4 O15 | P 1 21 1 | 7.481; 8.2693; 9.859 90; 108.76; 90 | 577.502 | Wiggin, S. B.; Weller, M. T. Redetermination of CaB8O11(OH)4 at low temperature Note: T = 120 K Acta Crystallographica, Section E, 2005, 61, i243-i245 |
9008001 | CIF | Ca Cl2 O2 | C c c e :1 | 5.7434; 12.6002; 5.7405 90; 90; 90 | 415.428 | Smolentsev, A. I.; Naumov, D. Y. Calcium chlorite, Ca(ClO2)2, from X-ray powder diffraction data Acta Crystallographica, Section E, 2005, 61, i246-i248 |
9008002 | CIF | Cl2 O2 Sr | C c c e :1 | 5.9799; 12.7519; 5.9787 90; 90; 90 | 455.906 | Smolentsev, A. I.; Naumov, D. Y. Strontium chlorite, Sr(ClO2)2, from X-ray powder diffraction data Acta Crystallographica, Section E, 2005, 61, i249-i250 |
9008005 | CIF | Fe2 H5 Na O11 P2 | P 1 21/n 1 | 9.766; 9.692; 9.811 90; 102.53; 90 | 906.514 | Gao, S.; Ng, S. W. Sodium diiron(III) diphosphate hydroxide dihydrate Acta Crystallographica, Section E, 2005, 61, i268-i269 |
9008008 | CIF Paper | Sc2 Te3 | F d d d :2 | 8.2223; 11.6292; 24.6085 90; 90; 90 | 2353.03 | Assoud, A.; Kleinke, H. The sesquitelluride Sc~2~Te~3~ Acta Crystallographica Section E, 2006, 62, i17-i18 |
9008009 | CIF | C4 Mg2 Na6 O16 S | F d -3 :2 | 13.9038; 13.9038; 13.9038 90; 90; 90 | 2687.82 | Schmidt, G. R.; Reynard, J.; Yang, H.; Downs, R. T. Tychite, Na6Mg2(SO4)(CO3)4: Structure analysis and Raman spectroscopic data Acta Crystallographica, Section E, 2006, 62, i207-i209 |
9011395 | CIF | As Ca Co0.95 Cu0.05 H O5 | P 21 21 21 | 7.4919; 8.9946; 5.9158 90; 90; 90 | 398.646 | Yang, H.; Costin, G.; Keogh, J.; Lu, R.; Downs, R. T. Cobaltaustinite, CaCo(AsO4)(OH) Acta Crystallographica, Section E, 2007, 63, i53-i55 |
9011397 | CIF | Fe2.75 Na O10 Si3 | P -1 | 10.3355; 10.7847; 8.9142 105.048; 96.461; 125.302 | 738.372 | Burt, J. B.; Downs, R. T.; Costin, G. Single-crystal X-ray refinement of wilkinsonite, Na2Fe2+4Fe3+2Si6O20. Acta Crystallographica, Section E, 2007, 63, i122-i124 |
9011399 | CIF | As0.916 Cu2 H O5 P0.084 | P 21/n 1 1 | 8.5844; 8.2084; 5.9258 90.13; 90; 90 | 417.556 | Li, C.; Yang, H.; Downs, R. T. Redetermination of olivenite from an untwinned single-crystal Note: RRUFF ID: R040181 Acta Crystallographica, Section E, 2008, 64, i60-i61 |
9011400 | CIF | As2 Co0.61 Fe0.17 Ni0.22 | P n n m | 5.0669; 5.8739; 3.1346 90; 90; 90 | 93.293 | Yang, H.; Downs, R. T.; Eichler, C. Safflorite, (Co,Ni,Fe)As2, isomorphous with marcasite Acta Crystallographica, Section E, 2008, 64, i62-i62 |
9011401 | CIF | As3 Ba5 Cl O12 | P 63/m | 10.557; 10.557; 7.73912 90; 90; 120 | 746.97 | Bell, A. M. T.; Henderson, C. M. B.; Wendlandt, R. F.; Harrison, W. J. Rietveld refinement of Ba5(AsO4)3Cl from high-resolution synchrotron data Acta Crystallographica, Section E, 2008, 64, i63-i64 |
9013405 | CIF | F2 Fe H4 K2 O8 P2 | P 1 21/c 1 | 4.7586; 8.253; 10.758 90; 92.845; 90 | 421.975 | Mi, J. X.; Wang, C. X.; Wei, Z. B.; Chen, F. J.; Xu, C. Y.; Mao, S. Y. K2Fe[H(HPO4)2]F2 Acta Crystallographica, Section E, 2005, 61, i143-i145 |
9014116 | CIF | Ca0.25 Ce0.348 Fe0.03 Gd0.01 La0.12 Nb1.14 Nd0.14 O6 Pr0.04 Sm0.02 Sr0.01 Th0.06 Ti0.86 Y0.02 | P n m a | 11.0563; 7.56; 5.3637 90; 90; 90 | 448.328 | Morrison, S. M.; Downs, R. T.; Domanik, K. J.; Yang, H.; Doell, D. Nioboaeschynite-(Ce), Ce(NbTi)O6 Acta Crystallographica, Section E, 2012, 68, i64-i65 |
9015960 | CIF | C3 H16 Eu0.03 Gd0.08 La0.61 Nd0.95 O17 Pr0.17 Sm0.12 Y0.04 | P c c n | 8.9391; 9.4694; 16.9374 90; 90; 90 | 1433.72 | Morrison, S. M.; Andrade, M. B.; Wenz, M. D.; Domanik, K. J.; Downs, R. T. Lanthanite-(Nd), Nd2(CO3)3*8H2O Acta Crystallographica, Section E, 2013, 69, i15-i16 |
9016656 | CIF | Ca0.18 H2 K0.208 Mg2.305 Mn2.915 Na2.344 O24 Si8 | C 1 2/m 1 | 9.9024; 18.1117; 5.2992 90; 104.034; 90 | 922.04 | Barkley, M. C.; Yang, H.; Downs, R. T. Kozulite, a Mn-rich alkali amphibole Acta Crystallographica, Section E, 2010, 66, i83-i83 |
9017348 | CIF | C2 H4 Mn O6 | C 1 2/c 1 | 11.7648; 5.644; 9.6367 90; 125.843; 90 | 518.704 | Soleimannejad, J.; Aghabozorg, H.; Hooshmand, S.; Ghadermaz, M.; Gharamaleki, J. A. The monoclinic polymorph of catena-poly [[diaquamanganese(II)]-mu-oxalato-4O1,O2:O1',O2'] Acta Crystallographica, Section E, 2007, 63, m2389-m2390 |
9017349 | CIF | Ca7 F0.4 Fe0.04 H1.4 K0.89 Li3 Na0.12 O37.4 Si12 Sn0.02 Ti1.8 Zr0.14 | C 1 2/c 1 | 16.9093; 9.7287; 20.9019 90; 112.396; 90 | 3179.12 | Andrade, M. B.; Doell, D.; Downs, R. T.; Yang, H. Redetermination of katayamalite, KLi3Ca7Ti2(SiO3)12(OH)2 Acta Crystallographica, Section E, 2013, 69, i41-i41 |
9017350 | CIF | As2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01 | P 63/m | 13.5059; 13.5059; 5.8903 90; 90; 120 | 930.497 | Morrison, S. M.; Domanik, K. J.; Origlieri, M. J.; Downs, R. T. Agardite-(Y), Cu2+6Y(AsO4)3(OH)6*3H2O Acta Crystallographica, Section E, 2013, 69, i61-i62 |
9017351 | CIF | Al0.534 Ca1.97 Fe1.465 H14 Mg0.5 O20 P3 Sr0.03 | C 1 2/c 1 | 10.1936; 24.1959; 6.3218 90; 91.161; 90 | 1558.91 | Lafuente, B.; Downs, R. T.; Yang H and Jenkins, R. A. Calcioferrite with composition (Ca3.94Sr0.06)Mg1.01(Fe2.93Al1.07)(PO4)6(OH)4*12H2O Acta Crystallographica, Section E, 2014, 70, 116-117 |
9017352 | CIF | As0.02 Fe0.09 H Mn0.82 O9 Pb2 V1.98 Zn0.09 | P 1 21/m 1 | 7.6492; 6.1262; 8.9241 90; 112.195; 90 | 387.202 | Lafuente, B.; Downs, R. T. Redetermination of brackebuschite, Pb2Mn3+(VO4)2(OH) Acta Crystallographica, Section E, 2016, 72, 293-296 |
9017353 | CIF | Al0.05 Ca1.9 Fe0.07 H8 Mg0.04 Mn1.88 O17 Si4 Sr0.06 | C 1 2 1 | 9.036; 6.1683; 11.9601 90; 91.433; 90 | 666.409 | Fendrich, K. V.; Downs, R. T.; Origlieri, M. J. Redetermination of ruizite, Ca2Mn3+2[Si4O11(OH)](OH)2*2H2O Acta Crystallographica, Section E, 2016, 72, 959-963 |
9017354 | CIF | Ca0.968 H4 O8 V1.885 | P -1 | 6.2059; 7.0635; 7.7516 93.166; 96.548; 105.883 | 323.359 | Kobsch, A.; Downs, R. T.; Domanik, K. J. Redetermination of metarossite, CaV5+2O6*2H2O Acta Crystallographica, Section E, 2016, 72, 1280-1284 |
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