Crystallography Open Database

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2244131 CIF
HKL
Paper
C17 H21 N3 O5P -16.0768; 7.4427; 18.4737
78.894; 85.87; 83.668
813.77Shankara 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 O9P -17.9599; 8.5391; 14.2227
90.426; 105.273; 98.538
921.15Shankara 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 O3C 1 2/c 127.539; 6.343; 21.354
90; 118.17; 90
3288.3Naghiyev, 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 OP -18.6444; 8.9104; 16.0902
79.196; 86.485; 69.003
1136.52Naghiyev, 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 S2P -19.9635; 14.4905; 20.1131
96.736; 101.49; 95.216
2806.5Petrenko, 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 O4P 1 21/c 114.2508; 15.3046; 15.2593
90; 113.311; 90
3056.43Stapf, 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 SP 1 21/c 114.8117; 10.7086; 15.1887
90; 112.417; 90
2227.1Mohamed, 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 OP 1 21/c 110.8398; 19.0207; 9.3307
90; 112.378; 90
1778.93Missioui, 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 O3P 1 21/c 114.5241; 10.0718; 13.271
90; 97.042; 90
1926.69Mohamed, 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 O4P 1 21/n 111.6407; 7.4412; 42.2828
90; 93.038; 90
3657.42Faraj, 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 SP 1 21/c 114.4316; 10.8518; 15.594
90; 109.941; 90
2295.74Mohamed, 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 OP 1 21/c 17.5654; 11.4972; 12.1025
90; 105.583; 90
1013.99Tojiboev, 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 O7P -18.3023; 10.0792; 10.1052
116.966; 105.481; 92.871
711.77Qiu, 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 O2P c a 2124.367; 4.3979; 10.1424
90; 90; 90
1086.9Plutenko, 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 TiP -113.8643; 14.3017; 20.0502
86.4852; 80.0328; 73.6493
3756.9Fitschen, 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 TiP -112.1151; 13.2796; 21.1662
77.916; 88.8857; 87.9827
3327.5Fitschen, 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 O4P 1 21/c 113.8608; 8.8352; 15.5411
90; 98.468; 90
1882.46Nchioua, 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 O6P 1 21/c 127.091; 6.2408; 18.685
90; 90.975; 90
3158.6Priyanka, 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 OI 1 2/a 118.6588; 5.4739; 35.5689
90; 100.729; 90
3569.37Cheng, 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 N3P 1 21/n 112.253; 22.699; 12.884
90; 104.164; 90
3474.5Muñoz 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 O4P b c a9.388; 12.226; 28.693
90; 90; 90
3293.3Naghiyev, 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 O4P -17.4141; 12.3595; 19.9917
86.695; 83.654; 82.182
1802.1Shankara 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 O6P n a 2117.8424; 8.8124; 34.9337
90; 90; 90
5492.8Shankara 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 O3C 1 2/c 115.3747; 4.6699; 23.0423
90; 103.122; 90
1611.2Irrou, 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 S2P -16.5986; 7.4183; 13.2847
74.1712; 88.6035; 77.92
611.41Bettinger, 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 S2P -16.7774; 6.9866; 13.721
91.107; 90.401; 117.583
575.66Bettinger, 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 Rb6P n n m13.395; 9.251; 12.368
90; 90; 90
1532.6Qiu, 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 SP 1 21/c 113.5689; 9.2906; 13.4358
90; 118.53; 90
1488.1Schinke, 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 O22P a -312.2966; 12.2966; 12.2966
90; 90; 90
1859.32Qiu, 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 O7P -18.0202; 9.8474; 19.4712
95.422; 94.693; 103.857
1477.66Selvanandan, 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 SI 1 a 18.1644; 15.9237; 9.6936
90; 106.661; 90
1207.33Mutalliev, 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 S3P -15.7955; 7.3789; 10.0344
89.459; 89.719; 78.956
421.15Schriver, 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 O3P -16.239; 7.496; 17.817
93.55; 92.94; 94.87
827.3Archana, 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 O3P 1 21/c 16.183; 37.748; 7.506
90; 93.69; 90
1748.2Archana, 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 O2P 1 21/c 110.8507; 23.4045; 13.3019
90; 102.491; 90
3298.13Archana, 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 O4P 1 21/c 113.0683; 15.7868; 7.9255
90; 95.137; 90
1628.52Archana, 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 O7P 1 21/c 17.779; 7.411; 31.357
90; 96.82; 90
1794.9Archana, 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 O6P -15.707; 12.505; 13.116
97.41; 93.28; 102.82
901.5Archana, 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 O7P 1 21/c 18.517; 6.825; 30.265
90; 95.33; 90
1751.7Archana, 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 O3P 1 21/c 16.202; 34.573; 7.596
90; 93.83; 90
1625.1Archana, 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 SP 1 21 18.325; 10.949; 18.418
90; 92.67; 90
1677Archana, 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 O7P 21 21 217.1185; 7.5255; 29.955
90; 90; 90
1604.7Archana, 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 O4P c a 2126.702; 7.9626; 6.7571
90; 90; 90
1436.68Archana, 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 O5P 1 21/c 17.9531; 13.4224; 21.2015
90; 92.484; 90
2261.1Naeem, 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 O5P 1 21/c 18.0087; 13.7968; 21.878
90; 90.749; 90
2417.2Naeem, 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 O3P 1 n 14.5017; 14.047; 10.567
90; 96.3; 90
664.2Vinaya; 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 O3P 1 21/c 127.904; 11.1207; 9.0648
90; 94.485; 90
2804.3Vinaya; 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 O3P n a 2118.7779; 10.0699; 15.7288
90; 90; 90
2974.18Archana, 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 OP 1 21 17.5162; 6.1125; 15.7249
90; 98.625; 90
714.28Archana, 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 SiP 1 21/n 19.732; 19.0598; 10.9186
90; 110.526; 90
1896.7Schwab, 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 SP 21 21 2110.0322; 12.0784; 12.9412
90; 90; 90
1568.1Neils, 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 N3P n a 2113.4639; 7.8555; 20.1288
90; 90; 90
2128.94Collis, 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 O2I 4/m17.305; 17.305; 26.04
90; 90; 90
7798van 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 O3P -14.5931; 8.9134; 15.0764
74.808; 85.309; 77.43
581.18Cattey, 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 ZnP 1 21/n 120.6241; 7.3309; 20.6485
90; 90.532; 90
3121.8Tinapple, 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 ZnP 1 21 17.3802; 8.2491; 14.5953
90; 97.852; 90
880.23Tinapple, 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 ZnC 1 2/c 113.9452; 18.9742; 7.0651
90; 108.021; 90
1777.7Tinapple, 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 ZnP 1 21/c 16.8376; 17.2694; 14.9856
90; 96.893; 90
1756.73Tinapple, 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 ZnC 1 c 17.0532; 21.3776; 11.1181
90; 106.477; 90
1607.5Tinapple, 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 O2P 1 21/n 113.367; 19.966; 16.919
90; 106.099; 90
4338.4Stapf, 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 O4P 1 21/n 112.899; 12.9748; 16.763
90; 109.168; 90
2650Stapf, 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 O4P -17.2941; 9.6773; 14.4302
82.1992; 88.3216; 75.9397
978.92Steiger, 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 O4P 1 21/n 115.3492; 14.0314; 18.3862
90; 90.0834; 90
3959.8Steiger, 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 O5P 1 21/n 19.2745; 22.1655; 11.3475
90; 108.201; 90
2216.03Steiger, 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 S2C 1 2/c 118.2934; 11.7472; 9.7341
90; 117.043; 90
1863.11Näther, 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 O2A e a 212.6854; 26.315; 10.6511
90; 90; 90
3555.5Znovjyak, 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 O3P 1 21/m 13.8283; 10.972; 6.1096
90; 93.523; 90
256.14Chandrasekaran, 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 S2P c a 2110.7521; 5.5245; 14.48
90; 90; 90
860.1Kellou, 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 O2P 1 21/n 14.9172; 12.7016; 11.8573
90; 96.294; 90
736.1Priyanka, 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 O4P n a 2127.4318; 12.6723; 10.6434
90; 90; 90
3699.9Znovjyak, 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 O2P b c a12.0297; 14.6357; 32.763
90; 90; 90
5768.4Pollock, 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 O12P 1 21/c 15.4741; 22.5679; 7.6478
90; 92.286; 90
944.05Kamolov, 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 O2P n n a10.4669; 26.589; 12.8313
90; 90; 90
3571Znovjyak, 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 O4P -14.6914; 13.0677; 16.9923
68.441; 83.739; 88.032
963.05Banna, 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 SP 21 21 217.9857; 9.0145; 22.1621
90; 90; 90
1595.39Priyanka, 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 SP 21 21 218.0717; 9.1135; 22.506
90; 90; 90
1655.6Priyanka, 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 S2C 1 2/c 118.5763; 11.6179; 15.8998
90; 97.448; 90
3402.51Krebs, 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 S2C 1 2/c 118.799; 11.3033; 15.8639
90; 96.825; 90
3347.04Krebs, 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 S2P 1 21/n 110.2275; 25.0468; 12.718
90; 94.6; 90
3247.4Krebs, 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 O3P 1 21/n 16.0404; 8.6114; 17.611
90; 98.771; 90
905.35El 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 O3P 1 21 116.1906; 7.5752; 17.7591
90; 95.36; 90
2168.6Banna, 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 O2P -17.694; 15.013; 15.281
71.04; 77.874; 87.78
1631.3Richter, 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 O28P 4/n :218.2654; 18.2654; 13.4219
90; 90; 90
4477.9Aziz, 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 SP -18.1589; 12.2053; 12.9129
101.569; 93.086; 92.481
1256Madhan, 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 SP 1 21/n 110.142; 12.097; 16.2218
90; 104.846; 90
1923.8Madhan, 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 Se8P -111.495; 11.665; 22.233
92.885; 92.383; 103.51
2890.7Fuss, 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 O16P 1 21/n 115.542; 14.001; 16.3217
90; 94.791; 90
3539.25Chong, 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 S2P b c a7.84; 16; 18.51
90; 90; 90
2322Brown, 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 CIFHf Na2 O7 Si2P -16.6123; 8.7948; 5.41074
92.603; 94.0843; 71.3262
297.249Massoni, Nicolas; Pierrick, Chevreux
Crystal structure of Na~2~HfSi~2~O~7~ by Rietveld refinement
Acta Crystallographica, Section e, 2016, 72, 1434
9007893 CIFAs2 Cd O6P -3 1 m4.8269; 4.8269; 4.866
90; 90; 120
98.184Weil, M.
Cadmium(II) metaarsenate(V), CdAs2O6
Acta Crystallographica, Section E, 2001, 57, i22-i23
9007894 CIFH4 Mg O5 SeP 1 21/n 16.4818; 8.7975; 7.6367
90; 98.753; 90
430.401Johnston, M. G.; Harrison, W. T. A.
Magnesium selenite dihydrate, MgSeO3*2H2O
Acta Crystallographica, Section E, 2001, 57, i24-i25
9007895 CIFFe H14 O11 SP 1 21/c 113.9969; 6.4803; 11.0211
90; 105.596; 90
962.853Fronczek, 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 CIFNi3 O14 P4 SrP 1 21/c 17.4116; 7.6542; 9.4486
90; 112.194; 90
496.304Bolte, M.
SrNi3(P2O7)2
Acta Crystallographica, Section E, 2001, 57, i30-i31
9007898 CIFC3 Na4 O11 UP -3 c 19.338; 9.338; 12.817
90; 90; 120
967.887Cisarova, 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 CIFH10 Na2 O8 S2P 1 21/c 15.947; 21.574; 7.526
90; 103.82; 90
937.637Prasad S M Rani A
Rerefinement of sodium thiosulfate pentahydrate
Acta Crystallographica, Section E, 2001, 57, i67-i69
9007904 CIFB Ga O4 PbP n m a6.9944; 5.8925; 8.2495
90; 90; 90
339.999Park, H.; Barbier, J.
PbGaBO4, an orthoborate with a new structure-type
Acta Crystallographica, Section E, 2001, 57, i82-i84
9007905 CIFMn O3 YbP 63 c m6.0584; 6.0584; 11.3561
90; 90; 120
360.974Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.
Hexagonal YbMnO3 revisited
Acta Crystallographica, Section E, 2001, 57, i87-i89
9007906 CIFFe0.05 Mn0.95 SP 63 m c3.982; 3.982; 6.445
90; 90; 120
88.503Eriksson, 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 CIFC2 H6 K4 O9C 1 2/c 111.8175; 13.7466; 7.1093
90; 120.769; 90
992.34Skakle, J. M. S.; Wilson, M.; Feldman, J.
Dipotassium carbonate sesquihydrate: rerefinement against new intensity data
Acta Crystallographica, Section E, 2001, 57, i94-i97
9007909 CIFLu Mn O3P 63 c m6.038; 6.038; 11.361
90; 90; 120
358.702Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.
Hexagonal LuMnO3 revisited
Acta Crystallographica, Section E, 2001, 57, i101-i103
9007910 CIFCu H10 O9 SeP -16.083; 6.226; 10.867
77.14; 82.2; 72.91
382.43Kolitsch, U.
Copper(II) selenate pentahydrate, CuSeO4*5H2O
Acta Crystallographica, Section E, 2001, 57, i104-i105
9007913 CIFH Mn O5 Pb VP n m a7.646; 6.179; 9.507
90; 90; 90
449.155Kolitsch, U.
Refinement of pyrobelonite, PbMnIIVO4(OH), a member of the descloizite group
Acta Crystallographica, Section E, 2001, 57, i119-i121
9007915 CIFH12 Mg O10 SeC 1 2/c 110.224; 7.37; 24.866
90; 98.41; 90
1853.53Kolitsch, U.
Magnesium selenate hexahydrate, MgSeO4*6H2O
Acta Crystallographica, Section E, 2002, 58, i3-i5
9007916 CIFMg O7 P2 SrP 1 21/n 15.3046; 8.3053; 12.7
90; 90.502; 90
559.493Tahiri, A. A.; Bali, B. E.; Lachkar, M.; Ouarsal, R.; Zavalij, P. Y.
SrMgP2O7
Acta Crystallographica, Section E, 2002, 58, i9-i11
9007917 CIFCo2 O7 P2P 1 21/c 17.0022; 8.3634; 9.0114
90; 113.6; 90
483.59Bali, B. E.; Bolte, M.
Rerefinement of cobalt diphosphate against new intensity data
Acta Crystallographica, Section E, 2002, 58, i32-i33
9007921 CIFMn O5 Te2P b c n7.3114; 10.9216; 6.1711
90; 90; 90
492.776Johnston, M. G.; Harrison, W. T. A.
Manganese tellurite, beta-MnTe2O5
Acta Crystallographica, Section E, 2002, 58, i59-i61
9007923 CIFCl2 Hg N4 O6P n m a15.5758; 5.4976; 11.2826
90; 90; 90
966.124Nockemann, P.; Meyer, G.
Ammonium mercury(II) dichloride nitrate, (NH4)2HgCl2(NO3)2
Acta Crystallographica, Section E, 2002, 58, i68-i69
9007924 CIFO13 Si3 Sm5P 63/m9.4959; 9.4959; 7.0361
90; 90; 120
549.459Morgan, M. G.; Wang, M.; Mar, A.
Samarium orthosilicate oxyapatite, Sm5(SiO4)3O
Acta Crystallographica, Section E, 2002, 58, i70-i71
9007925 CIFDy4 S12 Si3P 1 21/n 19.813; 10.9387; 16.36
90; 102.86; 90
1712.06Hatscher, S. T.; Urland, W.
Dysprosium thiosilicate, Dy4(SiS4)3
Acta Crystallographica, Section E, 2002, 58, i74-i75
9007932 CIFCl Cr K O3P 1 21/c 17.838; 7.493; 7.812
90; 91.4; 90
458.663Kolitsch, U.
Redetermination of potassium chlorochromate, KCrO3Cl
Acta Crystallographica, Section E, 2002, 58, i105-i107
9007935 CIFAl Cs Mo2 O8P -3 m 15.551; 5.551; 8.037
90; 90; 120
214.47Tomaszewski, P. E.; Pietraszko, A.; Maczka, M.; Hanuza, J.
CsAl(MoO4)2
Acta Crystallographica, Section E, 2002, 58, i119-i120
9007937 CIFAl Mo2 Na O8C 1 2/c 19.621; 5.339; 13.146
90; 90.01; 90
675.264Kolitsch, 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 CIFAl Ba Ca F7P 1 2/n 15.3664; 5.3846; 18.8262
90; 92.319; 90
543.555Werner, F.; Weil, M.
alpha-BaCaAlF7
Acta Crystallographica, Section E, 2003, 59, i17-i19
9007941 CIFH8 Mg Na O10 P3P b c a14.806; 9.078; 14.811
90; 90; 90
1990.73Ouarsal, 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 CIFB4 Hg O7P b c a8.3994; 8.8066; 14.137
90; 90; 90
1045.72Weil, M.
HgB4O7, a member of the isotypic MIIB4O7 family (MII = Mg, Mn, Zn, Cd)
Acta Crystallographica, Section E, 2003, 59, i40-i42
9007944 CIFBi3.041 Mo2 O12 Sc0.959C 1 2/c 116.996; 11.601; 5.319
90; 104.67; 90
1014.56Kolitsch, U.; Tillmanns, E.
Bi3ScMo2O12: the difference from Bi3FeMo2O12
Acta Crystallographica, Section E, 2003, 59, i43-i46
9007946 CIFH8 K2 O16 P4 ZnP -16.827; 7.333; 7.57
80.753; 72.547; 83.442
355.949Tahiri, 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 CIFLi3 Mo3 O12 ScP n m a5.13; 10.56; 17.745
90; 90; 90
961.296Kolitsch, U.; Tillmanns, E.
Li3Sc(MoO4)3: substitutional disorder on three (Li,Sc) sites
Acta Crystallographica, Section E, 2003, 59, i55-i58
9007952 CIFLi3 O4 TaC 1 2/c 18.508; 8.516; 9.338
90; 116.869; 90
603.535du Boulay, D.; Sakaguchi, A.; Suda, K.; Ishizawa, N.
Reinvestigation of beta-Li3TaO4
Acta Crystallographica, Section E, 2003, 59, i80-i82
9007953 CIFSe3 Yb2F d d d :28.0183; 11.272; 23.961
90; 90; 90
2165.65Assoud, A.; Kleinke, H.
Ytterbium sesquiselenide Yb2Se3
Acta Crystallographica, Section E, 2003, 59, i103-i104
9007954 CIFFe1.839 H Mg0.161 O5 PP 1 21/a 112.274; 13.169; 9.754
90; 108.64; 90
1493.9Kolitsch, U.
Mg-rich wolfeite, (Fe,Mg)2(PO4)(OH): structure refinement and Raman spectroscopic data
Acta Crystallographica, Section E, 2003, 59, i125-i128
9007957 CIFCr3 Cs2 O10P b c a11.887; 9.671; 19.493
90; 90; 90
2240.9Kolitsch, U.
alpha-Cs2Cr3O10
Acta Crystallographica, Section E, 2003, 59, i164-i166
9007959 CIFNa3 O S3 VC m c 219.6673; 11.9122; 5.8846
90; 90; 90
677.664Huang, F. Q.; Ibers, J. A.
Na3VOS3
Acta Crystallographica, Section E, 2004, 60, i6-i7
9007960 CIFRb2 S4 WP n m a9.6254; 7.0218; 12.3761
90; 90; 90
836.471Yao, J.; Ibers, J. A.
Dirubidium tetrathiotungstate, Rb2[WS4]
Acta Crystallographica, Section E, 2004, 60, i10-i11
9007962 CIFCa K O9 P3P -6 c 26.809; 6.809; 10.376
90; 90; 120
416.608Sandstrom, M.; Bostrom, D.
Calcium potassium cyclo-triphosphate
Acta Crystallographica, Section E, 2004, 60, i15-i17
9007965 CIFCs La O12 P4P 1 21 17.218; 9.254; 8.864
90; 99.377; 90
584.163Sun, T.; Shen, G.; Wang, X.; Wang, R.; Wei, J.; Shen, D.
CsLa(PO3)4
Acta Crystallographica, Section E, 2004, 60, i28-i30
9007966 CIFCl2 Cu H16 O16P 1 21/c 16.2908; 12.4043; 9.2181
90; 106.146; 90
690.943Li, X. H.; Xia, F. Y.; Xiao, H. P.; Hu, M. L.
Hexaaquacopper(II) diperchlorate dihydrate
Acta Crystallographica, Section E, 2004, 60, i31-i32
9007972 CIFBr Eu IP n m a8.3723; 4.7404; 9.799
90; 90; 90
388.903Liao, W.; Liu, X.; Dronskowski, R.
Europium(II) bromide iodide
Acta Crystallographica, Section E, 2004, 60, i69-i71
9007976 CIFCr H28 N O20 S2P a -312.2491; 12.2491; 12.2491
90; 90; 90
1837.86Rempfer, N.; Lerner, H. W.; Bolte, M.
The ammonium chromium(III) alum NH4Cr(SO4)2*12H2O
Acta Crystallographica, Section E, 2004, 60, i80-i81
9007978 CIFLi O12 P4 YbC 1 2/c 116.194; 7.024; 9.498
90; 125.91; 90
875.031Zarkouna, E. B.; Driss, A.
LiYb(PO3)4
Acta Crystallographica, Section E, 2004, 60, i102-i104
9007983 CIFCa0.312 Fe2 Mg Na0.376 O12 P3C 1 2/c 111.852; 12.458; 6.3861
90; 113.84; 90
862.47Zid, M. F.; Driss, A.; Jouini, T.
(Na0.38,Ca0.31)MgFe2P3O12
Acta Crystallographica, Section E, 2005, 61, i46-i48
9007984 CIFCs2 O15 Si6 ThP c a 2116.292; 7.2154; 13.68
90; 90; 90
1608.13Woodward, J. D.; Almond, P. M.; Albrecht-Schmitt T E
Caesium thorium silicate, Cs2ThSi6O15
Acta Crystallographica, Section E, 2005, 61, i58-i60
9007985 CIFAs4 Fe3 K3 O16C m c e10.898; 21.521; 6.623
90; 90; 90
1553.33Ouerfelli, N.; Zid, M. F.; Jouini, T.
Compose a charpente bidimensionnelle K3Fe3(AsO4)4
Acta Crystallographica, Section E, 2005, 61, i67-i69
9007986 CIFCe2 O7 Si2P 416.7964; 6.7964; 24.7282
90; 90; 90
1142.22Deng, B.; Ibers, J. A.
Dicerium disilicate, Ce2[Si2O7]
Acta Crystallographica, Section E, 2005, 61, i76-i78
9007987 CIFH8 Mn2 N2 O12 S3P 21 310.188; 10.188; 10.188
90; 90; 90
1057.47Zhang, X. M.; Hao, Z. M.; Ng, S. W.
Langbeinite-type (NH4)2Mn2(SO4)3
Acta Crystallographica, Section E, 2005, 61, i82-i83
9007988 CIFCd O3 SiP 1 21/c 16.9463; 7.2563; 15.0697
90; 94.791; 90
756.926Weil, M.
Parawollastonite-type Cd3[Si3O9]
Acta Crystallographica, Section E, 2005, 61, i102-i104
9007989 CIFCo H8 O12 P2 Zn2P n m a10.568; 18.258; 5.025
90; 90; 90
969.576Wu, 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 CIFH8 Ni O12 P2 Zn2P n m a10.562; 18.224; 5.0133
90; 90; 90
964.969Wu, 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 O13P b c m5.672; 10.737; 16.742
90; 90; 90
1019.6Kwak, J.; Yun, H.; Chae, H. K.
A new potassium niobate, KNb~5~O~13~
Acta Crystallographica Section E, 2005, 61, i132-i134
9007994 CIFBa5 Cl O12 V3P 63/m10.5565; 10.5565; 7.7584
90; 90; 120
748.76Roh, Y. H.; Hong, S. T.
Apatite-type Ba5(VO4)3Cl
Acta Crystallographica, Section E, 2005, 61, i140-i142
9007997 CIFAs2 Ca1.5 Na Nb2 O12C 1 2/c 16.73; 22.302; 7.4309
90; 113.827; 90
1020.26Amor, R. B.; Zid, M. F.
NaCa1.5(NbO)2O2(AsO4)2
Acta Crystallographica, Section E, 2005, 61, i228-i230
9007998 CIFCr4 K0.31 Li4.998 Na0.69 O24 P6R -3 :H8.3; 8.3; 22.469
90; 90; 120
1340.51Kouass, S.; Boughzala, H.
NASICON-type Li2.5K0.16Na0.34Cr2(PO4)3
Acta Crystallographica, Section E, 2005, 61, i231-i233
9007999 CIFMg O5 Te2P b c n7.2391; 10.658; 5.988
90; 90; 90
462Weil, M.
Redetermination of MgTe2O5
Acta Crystallographica, Section E, 2005, 61, i237-i239
9008000 CIFB8 Ca H4 O15P 1 21 17.481; 8.2693; 9.859
90; 108.76; 90
577.502Wiggin, 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 CIFCa Cl2 O2C c c e :15.7434; 12.6002; 5.7405
90; 90; 90
415.428Smolentsev, 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 CIFCl2 O2 SrC c c e :15.9799; 12.7519; 5.9787
90; 90; 90
455.906Smolentsev, 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 CIFFe2 H5 Na O11 P2P 1 21/n 19.766; 9.692; 9.811
90; 102.53; 90
906.514Gao, S.; Ng, S. W.
Sodium diiron(III) diphosphate hydroxide dihydrate
Acta Crystallographica, Section E, 2005, 61, i268-i269
9008008 CIF
Paper
Sc2 Te3F d d d :28.2223; 11.6292; 24.6085
90; 90; 90
2353.03Assoud, A.; Kleinke, H.
The sesquitelluride Sc~2~Te~3~
Acta Crystallographica Section E, 2006, 62, i17-i18
9008009 CIFC4 Mg2 Na6 O16 SF d -3 :213.9038; 13.9038; 13.9038
90; 90; 90
2687.82Schmidt, 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 CIFAs Ca Co0.95 Cu0.05 H O5P 21 21 217.4919; 8.9946; 5.9158
90; 90; 90
398.646Yang, H.; Costin, G.; Keogh, J.; Lu, R.; Downs, R. T.
Cobaltaustinite, CaCo(AsO4)(OH)
Acta Crystallographica, Section E, 2007, 63, i53-i55
9011397 CIFFe2.75 Na O10 Si3P -110.3355; 10.7847; 8.9142
105.048; 96.461; 125.302
738.372Burt, 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 CIFAs0.916 Cu2 H O5 P0.084P 21/n 1 18.5844; 8.2084; 5.9258
90.13; 90; 90
417.556Li, 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 CIFAs2 Co0.61 Fe0.17 Ni0.22P n n m5.0669; 5.8739; 3.1346
90; 90; 90
93.293Yang, H.; Downs, R. T.; Eichler, C.
Safflorite, (Co,Ni,Fe)As2, isomorphous with marcasite
Acta Crystallographica, Section E, 2008, 64, i62-i62
9011401 CIFAs3 Ba5 Cl O12P 63/m10.557; 10.557; 7.73912
90; 90; 120
746.97Bell, 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 CIFF2 Fe H4 K2 O8 P2P 1 21/c 14.7586; 8.253; 10.758
90; 92.845; 90
421.975Mi, 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 CIFCa0.25 Ce0.348 Fe0.03 Gd0.01 La0.12 Nb1.14 Nd0.14 O6 Pr0.04 Sm0.02 Sr0.01 Th0.06 Ti0.86 Y0.02P n m a11.0563; 7.56; 5.3637
90; 90; 90
448.328Morrison, 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 CIFC3 H16 Eu0.03 Gd0.08 La0.61 Nd0.95 O17 Pr0.17 Sm0.12 Y0.04P c c n8.9391; 9.4694; 16.9374
90; 90; 90
1433.72Morrison, 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 CIFCa0.18 H2 K0.208 Mg2.305 Mn2.915 Na2.344 O24 Si8C 1 2/m 19.9024; 18.1117; 5.2992
90; 104.034; 90
922.04Barkley, M. C.; Yang, H.; Downs, R. T.
Kozulite, a Mn-rich alkali amphibole
Acta Crystallographica, Section E, 2010, 66, i83-i83
9017348 CIFC2 H4 Mn O6C 1 2/c 111.7648; 5.644; 9.6367
90; 125.843; 90
518.704Soleimannejad, 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 CIFCa7 F0.4 Fe0.04 H1.4 K0.89 Li3 Na0.12 O37.4 Si12 Sn0.02 Ti1.8 Zr0.14C 1 2/c 116.9093; 9.7287; 20.9019
90; 112.396; 90
3179.12Andrade, 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 CIFAs2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01P 63/m13.5059; 13.5059; 5.8903
90; 90; 120
930.497Morrison, 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 CIFAl0.534 Ca1.97 Fe1.465 H14 Mg0.5 O20 P3 Sr0.03C 1 2/c 110.1936; 24.1959; 6.3218
90; 91.161; 90
1558.91Lafuente, 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 CIFAs0.02 Fe0.09 H Mn0.82 O9 Pb2 V1.98 Zn0.09P 1 21/m 17.6492; 6.1262; 8.9241
90; 112.195; 90
387.202Lafuente, B.; Downs, R. T.
Redetermination of brackebuschite, Pb2Mn3+(VO4)2(OH)
Acta Crystallographica, Section E, 2016, 72, 293-296
9017353 CIFAl0.05 Ca1.9 Fe0.07 H8 Mg0.04 Mn1.88 O17 Si4 Sr0.06C 1 2 19.036; 6.1683; 11.9601
90; 91.433; 90
666.409Fendrich, 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 CIFCa0.968 H4 O8 V1.885P -16.2059; 7.0635; 7.7516
93.166; 96.548; 105.883
323.359Kobsch, 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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