Crystallography Open Database
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Searching space group like 'P b c n'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2236671 | CIF HKL Paper | C12 H12 N3 O9 Re2 | P b c n | 24.066; 10.0715; 14.5969 90; 90; 90 | 3538 | Schutte, M.; Visser, H. G.; Roodt, A. (μ~1~-Methanolato-κ^1^<i>O</i>)-μ~1~-methoxo-κ^1^<i>O</i>-(μ~2~-2-amino-1-methyl-5<i>H</i>-imidazol-4-one-κ^2^<i>N</i>:<i>N</i>')-hexacarbonyldirhenium(I) Acta Crystallographica Section E, 2012, 68, m1359-m1360 |
| 2236755 | CIF HKL Paper | C19 H19 Cl O5 | P b c n | 14.2134; 10.2802; 24.2786 90; 90; 90 | 3547.51 | Patel, U. H.; Gandhi, S. A.; Barot, V. M.; Patel, M. C. 3-(2-Chloro-3-hydroxy-4-methoxyphenyl)-1-(4,5-dimethoxy-2-methylphenyl)prop-2-en-1-one Acta Crystallographica Section E, 2012, 68, o2926-o2927 |
| 2236787 | CIF HKL Paper | C6 H4 N4 S | P b c n | 3.9231; 13.8213; 12.6465 90; 90; 90 | 685.72 | Ziegler, Christopher J.; Nemykin, Victor N. 2,5-Diaminothiophene-3,4-dicarbonitrile Acta Crystallographica Section E, 2012, 68, o2693 |
| 2237043 | CIF HKL Paper | C8 H11 O2 P | P b c n | 13.5314; 8.0328; 15.922 90; 90; 90 | 1730.6 | Burrow, Robert A.; da Silva, Rubia M. Siqueira <i>rac</i>-Ethyl(phenyl)phosphinic acid Acta Crystallographica Section E, 2012, 68, o3488 |
| 2237171 | CIF HKL Paper | C22 H38 Fe Si2 | P b c n | 7.1282; 12.1466; 26.363 90; 90; 90 | 2282.6 | Abri, Abdolreza; Soltani, Behzad; Ziegler, Christopher J.; Engle, James T.; Kia, Reza 1,1'-Bis(<i>tert</i>-butyldimethylsilyl)ferrocene Acta Crystallographica Section E, 2013, 69, m46 |
| 2237381 | CIF HKL Paper | C26 H18 | P b c n | 25.9304; 8.93; 14.9377 90; 90; 90 | 3458.95 | Wolfenden, Mark L.; Dhar, Raj K.; Fronczek, Frank R.; Watkins, Steven F. 2-[3-(Naphthalen-2-yl)phenyl]naphthalene Acta Crystallographica Section E, 2013, 69, o308 |
| 2237441 | CIF HKL Paper | C22 H18 N12 Zn | P b c n | 16.1206; 9.372; 14.6367 90; 90; 90 | 2211.3 | Song, Zhe Poly[bis(μ~2~-5-{4-[(1<i>H</i>-imidazol-1-yl)methyl]phenyl}tetrazolato)zinc] Acta Crystallographica Section E, 2013, 69, m85 |
| 2237451 | CIF HKL Paper | C26 H22 N2 O4 | P b c n | 27.2997; 9.7923; 15.8557 90; 90; 90 | 4238.7 | Ganesh, Gnanavelu; Yuvaraj, PanneerSelvam; Kannan, Piskala Subburaman; Reddy, Boreddy Siva Rami; SubbiahPandi, Arunachalathevar A diastereomer of methyl (1<i>R</i>,3'<i>S</i>)-1',1''-dimethyl-2,2''-dioxo-2<i>H</i>-dispiro[acenaphthylene-1,2'-pyrrolidine-3',3''-indoline]-4'-carboxylate Acta Crystallographica Section E, 2013, 69, o441 |
| 2237474 | CIF HKL Paper | C16 H16 F2 N6 O5 | P b c n | 14.7196; 8.4891; 28.1096 90; 90; 90 | 3512.47 | Kastelic, Jože; Kikelj, Danijel; Leban, Ivan; Lah, Nina Fluconazole–malonic acid (1/1) Acta Crystallographica Section E, 2013, 69, o378-o379 |
| 2237509 | CIF HKL Paper | C14 H10 Cl N O S | P b c n | 29.0274; 14.5512; 5.8686 90; 90; 90 | 2478.8 | Yousuf, Sammer; Shah, Shazia; Ambreen, Nida; Khan, Khalid M.; Ahmad, Shakil 5-Chloro-2-(4-methoxyphenyl)-1,3-benzothiazole Acta Crystallographica Section E, 2013, 69, o360 |
| 2237608 | CIF HKL Paper | C12 H18 N4 O8 S3 | P b c n | 9.6543; 9.7591; 18.579 90; 90; 90 | 1750.5 | Ravikumar, B.; Pandiarajan, S.; Athimoolam, S. Bis(4-sulfamoylanilinium) sulfate Acta Crystallographica Section E, 2013, 69, o596 |
| 2237642 | CIF HKL Paper | C13 H21 N9 Ni O5 | P b c n | 13.484; 8.8741; 29.959 90; 90; 90 | 3584.8 | Baisya, Siddhartha S.; Roy, Parag S. (2-Amino-7-methyl-4-oxidopteridine-6-carboxylato-κ^3^<i>O</i>^4^,<i>N</i>^5^,<i>O</i>^6^)(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dihydrate Acta Crystallographica Section E, 2013, 69, m193-m194 |
| 2237672 | CIF HKL Paper | C22 H40 Cl2 Cu N4 S2 | P b c n | 14.0663; 13.1359; 14.9278 90; 90; 90 | 2758.3 | Flörke, Ulrich; Ahmida, Aziza; Schröder, Jörg; Egold, Hans; Henkel, Gerald Dichloridobis(1,3-diisopropyl-4,5-dimethyl-1<i>H</i>-imidazol-3-ium-2-thiolate-κ<i>S</i>)copper(II) Acta Crystallographica Section E, 2013, 69, m211 |
| 2237799 | CIF HKL Paper | C28 H24 N2 O2 S2 | P b c n | 10.2657; 13.0675; 18.3415 90; 90; 90 | 2460.5 | Xin, Wei 1,2-Bis{2-[(4-methoxybenzylidene)amino]phenyl}disulfane Acta Crystallographica Section E, 2013, 69, o896 |
| 2237976 | CIF HKL Paper | C24 H33 O8 Rh S2 | P b c n | 23.55; 18.814; 12.114 90; 90; 90 | 5367 | Roy, Christopher P.; Boyer, Pauline M.; Merola, Joseph S. Aquabis(4-methylbenzenesulfonato-κ<i>O</i>)(η^5^-pentamethylcyclopentadienyl)rhodium(III) monohydrate Acta Crystallographica Section E, 2013, 69, m259-m260 |
| 2238032 | CIF HKL Paper | C15 H14 Br N | P b c n | 14.868; 6.161; 28.609 90; 90; 90 | 2621 | Sun, Li-Xia; Zhu, Ling-Zhi; Wang, Jun-Kai <i>N</i>-[(<i>E</i>)-4-Bromobenzylidene]-3,4-dimethylaniline Acta Crystallographica Section E, 2013, 69, o631 |
| 2238038 | CIF HKL Paper | C16 H10 N2 O2 | P b c n | 14.429; 10.162; 8.3313 90; 90; 90 | 1221.6 | Srinivasan, Thothadri; Kalpana, Venkatesan; Rajakumar, Perumal; Velmurugan, Devadasan 8,15-Dioxa-10,13-diazatetracyclo[14.4.0.0^2,7^.0^9,14^]icosa-1(16),2,4,6,9(14),10,12,17,19-nonaene Acta Crystallographica Section E, 2013, 69, o813-o814 |
| 2238054 | CIF HKL Paper | C18 H17 N O3 S | P b c n | 19.966; 10.355; 15.536 90; 90; 90 | 3212 | Selvakumar, R.; Bakthadoss, M.; Vijayakumar, S.; Murugavel, S. (<i>Z</i>)-3-(3,4-Dimethoxybenzyl)-1,5-benzothiazepin-4(5<i>H</i>)-one Acta Crystallographica Section E, 2013, 69, o708 |
| 2238164 | CIF HKL Paper | C18 H13 Br O2 | P b c n | 40.5848; 5.32093; 13.071 90; 90; 90 | 2822.67 | Bugenhagen, Bernhard; Al Jasem, Yosef; al Hindawi, Bassam; Al Rawashdeh, Nathir; Thiemann, Thies (<i>E</i>)-Methyl 3-(10-bromoanthracen-9-yl)acrylate Acta Crystallographica Section E, 2013, 69, o1138-o1139 |
| 2238419 | CIF HKL Paper | C7 H20 Bi Cl5 N2 | P b c n | 12.2451; 16.5509; 15.8934 90; 90; 90 | 3221.1 | Ouasri, Ali; Rhandour, Ali; Saadi, Mohamed; El Ammari, Lahcen <i>catena</i>-Poly[heptylenediammonium [[tetrachloridobismuthate(III)]-μ-chlorido]] Acta Crystallographica Section E, 2013, 69, m437 |
| 2238452 | CIF HKL Paper | C14 H22 Cl2 Co N2 O4 | P b c n | 12.8911; 8.0049; 16.8757 90; 90; 90 | 1741.44 | Zeghouan, Ouahida; Guenifa, Fatiha; Hadjadj, Nasreddine; Bendjeddou, Lamia; Merazig, Hocine Diaquabis[2-(2-hydroxyethyl)pyridine-κ^2^<i>N</i>,<i>O</i>]cobalt(II) dichloride Acta Crystallographica Section E, 2013, 69, m439-m440 |
| 2238491 | CIF HKL Paper | C16 H17 N O3 S2 | P b c n | 16.3379; 9.6445; 20.5078 90; 90; 90 | 3231.43 | Meenakshi, T. G.; Devarajegowda, H. C.; Kumar, K. Mahesh; Kotresh, O.; Devaru, Venkatesh B. 2-Oxo-2-(2-oxo-2<i>H</i>-chromen-3-yl)ethyl diethyldithiocarbamate Acta Crystallographica Section E, 2013, 69, o1454 |
| 2238701 | CIF Paper | C22 H12 N4 O2 | P b c n | 7.0994; 25.014; 9.4083 90; 90; 90 | 1670.8 | Dong, Wen-xian; Tong, Rong-rong; Zheng, Chang-ge 2,3-Bis(furan-2-yl)pyrazino[2,3-<i>f</i>][1,10]phenanthroline Acta Crystallographica Section E, 2013, 69, o1613 |
| 2238795 | CIF Paper | C30 H40 N10 O4 S2 | P b c n | 26.488; 9.7886; 12.2163 90; 90; 90 | 3167.4 | Arman, Hadi D.; Kaulgud, Trupta; Tiekink, Edward R. T. 4-Amino-<i>N</i>-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide‒1,4-diazabicyclo[2.2.2]octane (2/1) Acta Crystallographica Section E, 2013, 69, o1615 |
| 2238814 | CIF Paper | C22 H22 Mn N2 O4 | P b c n | 15.8353; 10.226; 12.6532 90; 90; 90 | 2048.96 | Suckert, Stefan; Jess, Inke; Näther, Christian Redetermination of bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) Acta Crystallographica Section E, 2013, 69, m620 |
| 2239079 | CIF HKL | C14 H12 F N3 O | P b c n | 18.926; 8.0486; 16.337 90; 90; 90 | 2488.6 | Sreeja, P. B.; Sithambaresan, M.; Aiswarya, N.; Kurup, M. R. Prathapachandra <i>N</i>'-[(1<i>E</i>)-1-(2-Fluorophenyl)ethylidene]pyridine-3-carbohydrazide Acta Crystallographica Section E, 2014, 70, o115 |
| 2239327 | CIF HKL | C20 H22 O6 | P b c n | 21.805; 9.871; 8.8646 90; 90; 90 | 1908 | Shi, Huaduan; Qin, Haisha; Ma, Zhen Diethyl 2,2'-(ethane-1,2-diyldioxy)dibenzoate Acta Crystallographica Section E, 2014, 70, o552 |
| 2239418 | CIF HKL | C20 H21 N3 O S | P b c n | 10.7369; 9.177; 35.6567 90; 90; 90 | 3513.3 | Schollmeyer, Dieter; Detert, Heiner 3-(4-Hexyloxyphenyl)-1,2,4-triazolo[3,4-<i>b</i>]benzothiazole Acta Crystallographica Section E, 2014, 70, o247 |
| 2239458 | CIF HKL | C16 H12 Cl N O | P b c n | 31.247; 9.1889; 9.3719 90; 90; 90 | 2690.9 | Ma, Ben; Zhou, Hongyan; Yang, Jingya 2-(4-Chlorophenyl)-4-oxo-4-phenylbutanenitrile Acta Crystallographica Section E, 2014, 70, o259 |
| 2239619 | CIF HKL Paper | C17 H16 O S2 | P b c n | 16.383; 11.6119; 7.8213 90; 90; 90 | 1487.9 | Nithya, C.; Sithambaresan, M.; Prathapan, S.; Kurup, M. R. Prathapachandra (2<i>E</i>,7<i>E</i>)-2,7-Bis[(thiophen-2-yl)methylidene]cycloheptanone Acta Crystallographica Section E, 2014, 70, o722 |
| 2239921 | CIF HKL Paper | C17 H16 Cl N3 O2 S | P b c n | 8.1736; 22.504; 19.279 90; 90; 90 | 3546.2 | Chicha, Hakima; Rakib, El Mostapha; Chigr, Mohamed; Saadi, Mohamed; El Ammari, Lahcen Crystal structure of <i>N</i>-(1-allyl-3-chloro-1<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide Acta Crystallographica Section E, 2014, 70, o1041-o1042 |
| 2239922 | CIF HKL Paper | C8 H8 N4 S | P b c n | 18.537; 5.1997; 19.059 90; 90; 90 | 1837 | El Fal, Mohammed; Ramli, Youssef; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen Crystal structure of 4-allylsulfanyl-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine Acta Crystallographica Section E, 2014, 70, o1038 |
| 2240331 | CIF HKL Paper | C28 H28 N2 O2 | P b c n | 23.722; 8.8117; 10.3903 90; 90; 90 | 2171.9 | Ouari, Kamel; Bendia, Sabrina; Merzougui, Moufida; Bailly, Corinne 1,1'-{(Hexane-1,6-diyl)bis[(azaniumylylidene)methanylylidene]}bis(naphthalen-2-olate) Acta Crystallographica Section E, 2015, 71, o51-o52 |
| 2240408 | CIF HKL Paper | C34 H38 O8 | P b c n | 19.7086; 20.3099; 8.8443 90; 90; 90 | 3540.2 | Honkeldieva, Muhabbat; Talipov, Samat; Mardanov, Rustam; Ibragimov, Bakhtiyar Molecular and crystal structure of gossypol tetramethyl ether with an unknown solvate Acta Crystallographica Section E, 2015, 71, 184-187 |
| 2240446 | CIF HKL Paper | C16 H13 N5 | P b c n | 12.6931; 10.9284; 18.8915 90; 90; 90 | 2620.5 | Price, Ivy K.; Rougeot, Celine; Hein, Jason E. Crystal structure of 5,7-diphenyl-4,7-dihydrotetrazolo[1,5-<i>a</i>]pyrimidine Acta Crystallographica Section E, 2015, 71, o192 |
| 2240594 | CIF HKL | C17 H16 O6 | P b c n | 5.4307; 8.131; 36.149 90; 90; 90 | 1596.2 | Devarajegowda, H. C.; Suchetan, P. A.; Sreenivasa, S.; Srinivasa, H. T.; Palakshamurthy, B. S. Crystal structure of bis(4-methoxyphenyl) malonate Acta Crystallographica Section E, 2015, 71, o330-o331 |
| 2240607 | CIF HKL Paper | C10 H18 Ca O8 | P b c n | 17.644; 9.9627; 7.816 90; 90; 90 | 1373.9 | Amarasekara, Ananda S.; Sterling-Wells, Dominique T.; Ordonez, Carlos; Ohoueu, Marie-Josiane; Fonari, Marina S. Crystal structure of a polymeric calcium levulinate dihydrate: <i>catena</i>-poly[[diaquacalcium]-bis(μ~2~-4-oxobutanoato)] Acta Crystallographica Section E, 2015, 71, 494-497 |
| 2240747 | CIF HKL Paper | C25 H22 Cl N O2 | P b c n | 10.1558; 12.1446; 33.605 90; 90; 90 | 4144.8 | Kerr, Jamie R.; Trembleau, Laurent; Storey, John M. D.; Wardell, James L.; Harrison, William T. A. Crystal structures of four indole derivatives as possible cannabinoid allosteric antagonists Acta Crystallographica Section E, 2015, 71, 654-659 |
| 2240872 | CIF HKL Paper | C17 H19 Cl6 Cu N3 O4 | P b c n | 17.4845; 10.6593; 25.103 90; 90; 90 | 4678.5 | Bussey, Katherine A.; Cavalier, Annie R.; Connell, Jennifer R.; Mraz, Margaret E.; Oshin, Kayode D.; Pintauer, Tomislav; Gray, Danielle L.; Parkin, Sean Crystal structure of orthorhombic {bis[(pyridin-2-yl)methyl](3,5,5,5-tetrachloropentyl)amine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}chloridocopper(II) perchlorate Acta Crystallographica Section E, 2015, 71, 847-851 |
| 2240889 | CIF HKL Paper | C4 H16 Br2 N2 O7 Sr | P b c n | 16.4198; 9.5438; 8.2402 90; 90; 90 | 1291.3 | Revathi, Palanisamy; Balakrishnan, Thangavelu; Ramamurthi, Kandasamy; Thamotharan, Subbiah Crystal structure of <i>catena</i>-poly[[[triaquastrontium]-di-μ~2~-glycinato] dibromide] Acta Crystallographica Section E, 2015, 71, 875-878 |
| 2240999 | CIF HKL Paper | C16 H18 Cd N12 O2 | P b c n | 9.8438; 9.1897; 22.8948 90; 90; 90 | 2071.1 | Zhu, Jin-Li; Jiang, Guo -Qing; Guo, Xiao-Qing; Tang, Yan-Feng; Wang, Miao Crystal structure of poly[bis(μ-2-amino-4,5-dicyanoimidazolato-κ^2^<i>N</i>^1^:<i>N</i>^3^)-<i>trans</i>-bis(<i>N</i>,<i>N</i>'-dimethylformamide-κ<i>O</i>)cadmium] Acta Crystallographica Section E, 2015, 71, 1022-1025 |
| 2241021 | CIF HKL Paper | C26 H22 Ag N7 O3 | P b c n | 11.9903; 10.1377; 20.1115 90; 90; 90 | 2444.63 | Kim, Youngtae; Kang, Sung Kwon Crystal structure of bis[2-(1<i>H</i>-benzimidazol-2-yl)aniline]silver(I) nitrate Acta Crystallographica Section E, 2015, 71, 1058-1060 |
| 2241215 | CIF HKL | C22 H18 Cl2 N6 Zn | P b c n | 13.796; 10.1905; 16.1305 90; 90; 90 | 2267.76 | Vittaya, Luksamee; Leesakul, Nararak; Saithong, Saowanit; Chainok, Kittipong Crystal structure of dichloridobis[2-(phenyldiazenyl)pyridine-κ<i>N</i>^1^]zinc Acta Crystallographica Section E, 2015, 71, m201-m202 |
| 2241626 | CIF HKL Paper | C44 H64 Cu4 N4 O14 | P b c n | 31.2431; 10.7872; 15.2556 90; 90; 90 | 5141.53 | Huang, Guohui; Liu, Xiaoxuan Crystal structure of a tetranuclear Cu^II^ complex with an <i>O</i>,<i>N</i>,<i>N</i>'-donor Schiff base ligand: hexa-μ~2~-acetato-bis(2-{[(2,2,6,6-tetramethylpiperidin-4-yl)imino]methyl}phenolato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>')tetracopper(II) Acta Crystallographica Section E, 2016, 72, 597-599 |
| 2241885 | CIF HKL Paper | C32 H32 N4 O8 S2 Zn | P b c n | 15.6244; 10.8803; 17.9446 90; 90; 90 | 3050.55 | Harvey, Miguel Angel; Suarez, Sebastián; Baggio, Ricardo Three phenanthroline–metal complexes with topologically similar but geometrically different conformations Acta Crystallographica Section E, 2016, 72, 1581-1586 |
| 2241947 | CIF HKL Paper | C7 H11 F N O4 P | P b c n | 7.163; 9.1309; 29.694 90; 90; 90 | 1942.1 | Rayes, Ali; Dadi, Ahlem; Mahbouli Rhouma, Najla; Mezzadri, Francesco; Calestani, Gianluca Synthesis and crystal structure of 4-fluorobenzylammonium dihydrogen phosphate, [FC~6~H~4~CH~2~NH~3~]H~2~PO~4~ Acta Crystallographica Section E, 2016, 72, 1812-1815 |
| 2242000 | CIF HKL Paper | C32 H53 Br2 Li2 N3 O2 | P b c n | 11.8301; 22.3946; 13.4254 90; 90; 90 | 3556.8 | Pedziwiatr, Jakub; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Crystal structures of a novel NNN pincer ligand and its dinuclear titanium(IV) alkoxide pincer complex Acta Crystallographica Section E, 2017, 73, 122-126 |
| 2242031 | CIF HKL Paper | C14 H16 Cu2 O10 | P b c n | 19.5028; 5.0553; 15.7573 90; 90; 90 | 1553.6 | van der Horn, Jitschaq A.; Lutz, Martin Crystal structure of <i>catena</i>-poly[[copper(II)-μ~2~-salicylato-[diaquacopper(II)]-μ~2~-salicylato] dihydrate] Acta Crystallographica Section E, 2017, 73, 235-238 |
| 2242063 | CIF HKL Paper | C29 H24 Cl10 Cu6 N18 O2 | P b c n | 16.565; 18.474; 14.606 90; 90; 90 | 4469.8 | Shi, Kaige; Mathivathanan, Logesh; Raptis, Raphael G. Crystal structure of μ~6~-chlorido-nonakis(μ-4-chloropyrazolato)bis-μ~3~-methoxo-hexacopper(II) Acta Crystallographica Section E, 2017, 73, 266-269 |
| 2242065 | CIF HKL | C32 H16 N2 O8 Re2 S2 | P b c n | 16.148; 11.6519; 15.6329 90; 90; 90 | 2941.4 | Priyatharsini, Maruthupandiyan; Shankar, Bhaskaran; Sathiyendiran, Malaichamy; Srinivasan, Navaneethakrishnan; Krishnakumar, Rajaputi Venkatraman Crystal structure of the <i>cis</i> and <i>trans</i> polymorphs of bis[μ-2-(1,3-benzothiazol-2-yl)phenolato]-κ^3^<i>N</i>,<i>O</i>:<i>O</i>;κ^3^<i>O</i>:<i>N</i>,<i>O</i>-bis[<i>fac</i>-tricarbonylrhenium(I)] Acta Crystallographica Section E, 2017, 73, 310-313 |
| 2242166 | CIF HKL Paper | Ba Fe Mn2 O12 P3 | P b c n | 6.5899; 17.6467; 8.5106 90; 90; 90 | 989.7 | Alhakmi, Ghaleb; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structures of two alkaline earth (<i>M</i> = Ba and Sr) dimanganese(II) iron(III) tris(orthophosphates) Acta Crystallographica Section E, 2017, 73, 767-770 |
| 2242167 | CIF HKL Paper | Fe Mn2 O12 P3 Sr | P b c n | 6.4304; 17.8462; 8.4906 90; 90; 90 | 974.37 | Alhakmi, Ghaleb; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structures of two alkaline earth (<i>M</i> = Ba and Sr) dimanganese(II) iron(III) tris(orthophosphates) Acta Crystallographica Section E, 2017, 73, 767-770 |
| 2242326 | CIF HKL Paper | C30 H24 N6 | P b c n | 11.6178; 15.7762; 12.8621 90; 90; 90 | 2357.4 | Fangmann, Pia; Schmidtmann, Marc; Beckhaus, Rüdiger Crystal structures of 2,3,8,9,14,15-hexamethyl-5,6,11,12,17,18-hexaazatrinaphthylene and 2,3,8,9,14,15-hexaphenyl-5,6,11,12,17,18-hexazatrinaphthylene dichloromethane disolvate Acta Crystallographica Section E, 2018, 74, 167-171 |
| 2242566 | CIF HKL Paper | C57 H54 Br4 Cl2 N8 Ni2 O13 | P b c n | 19.103; 17.414; 19.053 90; 90; 90 | 6338 | Okeke, Ugochukwu; Otchere, Raymond; Gultneh, Yilma; Butcher, Ray J. The crystal structure of bis[(<i>E</i>)-4-bromo-2-({[2-(pyridin-2-yl)ethyl]imino}methyl)phenol]nickel(II) bis[(<i>E</i>)-4-bromo-2-({[2-(pyridin-2-yl)ethyl]imino}methyl)phenolato]nickel(II) bis(perchlorate) methanol monosolvate, a structure containing strong inter-species hydrogen bonds Acta Crystallographica Section E, 2018, 74, 1121-1125 |
| 2242584 | CIF HKL Paper | C22 H33 F6 Fe Ni O P S4 | P b c n | 15.4081; 18.3762; 19.2154 90; 90; 90 | 5440.69 | Harrison, Daniel J.; Lough, Alan J.; Fekl, Ulrich A new structural model for NiFe hydrogenases: an unsaturated analogue of a classic hydrogenase model leads to more enzyme-like Ni—Fe distance and interplanar fold Acta Crystallographica Section E, 2018, 74, 1222-1226 |
| 2242871 | CIF HKL | C15 H10 Cl N | P b c n | 13.3417; 7.103; 25.1418 90; 90; 90 | 2382.6 | Udayakumar, Mani; Cerón, Margarita; Ceballos, Paulina; Percino, Judith; Thamotharan, Subbiah Quantitative analysis of weak non-covalent interactions in (<i>Z</i>)-3-(4-chlorophenyl)-2-phenylacrylonitrile: insights from <i>PIXEL</i> and Hirshfeld surface analysis Acta Crystallographica Section E, 2019, 75, 499-505 |
| 2243006 | CIF HKL Paper | C22 H8 F8 N2 O2 | P b c n | 18.8516; 10.6512; 9.2196 90; 90; 90 | 1851.22 | Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T. Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines Acta Crystallographica Section E, 2019, 75, 1102-1107 |
| 2243186 | CIF HKL Paper | C16 H11 Cl N2 O5 | P b c n | 12.6336; 7.0701; 33.5956 90; 90; 90 | 3000.8 | Gotoh, Kazuma; Ishida, Hiroyuki Crystal structure of 4-chloro-2-nitrobenzoic acid with 4-hydroxyquinoline: a disordered structure over two states of 4-chloro-2-nitrobenzoic acid‒quinolin-4(1<i>H</i>)-one (1/1) and 4-hydroxyquinolinium 4-chloro-2-nitrobenzoate Acta Crystallographica Section E, 2019, 75, 1853-1856 |
| 2243265 | CIF HKL Paper | C44.836 H83.674 Ba7 O33.892 | P b c n | 15.7831; 14.0136; 30.5583 90; 90; 90 | 6758.83 | Samolová, Erika; Fábry, Jan Poly[[tetradecakis(μ-propionato)heptabarium] propionic acid monosolvate tetrahydrate] Acta Crystallographica Section E, 2020, 76, 264-269 |
| 2243435 | CIF | C12 H14 O3 | P b c n | 13.0747; 10.9656; 7.5822 90; 90; 90 | 1087.07 | Fortes, A. Dominic Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction, Hirshfeld surface analysis and characterization of the thermal expansion Acta Crystallographica Section E, 2020, 76, 1062-1069 |
| 2243436 | CIF | C12 H14 O3 | P b c n | 13.1334; 10.6781; 7.6125 90; 90; 90 | 1067.57 | Fortes, A. Dominic Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction, Hirshfeld surface analysis and characterization of the thermal expansion Acta Crystallographica Section E, 2020, 76, 1062-1069 |
| 2243437 | CIF | C12 H14 O3 | P b c n | 12.9747; 10.5449; 7.48 90; 90; 90 | 1023.39 | Fortes, A. Dominic Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction, Hirshfeld surface analysis and characterization of the thermal expansion Acta Crystallographica Section E, 2020, 76, 1062-1069 |
| 2243449 | CIF HKL Paper | C15 H8 N2 S5 | P b c n | 3.9458; 11.434; 33.366 90; 90; 90 | 1505.3 | Kafuta, Kevin; Golz, Christopher; Alcarazo, Manuel Polymorphism of bis(1,3-benzothiazol-2-yl) trithiocarbonate Acta Crystallographica Section E, 2020, 76, 1126-1130 |
| 2243482 | CIF HKL Paper | C32 H30 N4 O2 S4 | P b c n | 15.4653; 7.9639; 24.8116 90; 90; 90 | 3055.9 | Paulus, Georgiana; Kwong, Huey Chong; Crouse, Karen A.; Tiekink, Edward R. T. 2-[(1<i>E</i>)-[(<i>Z</i>)-2-({[(1<i>Z</i>)-[(<i>E</i>)-2-[(2-Hydroxyphenyl)methylidene]hydrazin-1-ylidene]({[(4-methylphenyl)methyl]sulfanyl})methyl]disulfanyl}({[(4-methylphenyl)methyl]sulfanyl})methylidene)hydrazin-1-ylidene]methyl]phenol: crystal structure, Hirshfeld surface analysis and computational study Acta Crystallographica Section E, 2020, 76, 1245-1250 |
| 2243504 | CIF HKL Paper | C5 H7 Cu I N O S | P b c n | 26.982; 8.195; 7.351 90; 90; 90 | 1625.4 | Wheaton, Amelia M.; Guzei, Ilia A.; Berry, John F. Structural diversity in copper(I) iodide complexes with 6-thioxopiperidin-2-one, piperidine-2,6-dithione and isoindoline-1,3-dithione ligands Acta Crystallographica Section E, 2020, 76, 1336-1344 |
| 2243686 | CIF HKL Paper | K Mo2 O8 Tb | P b c n | 5.0826; 18.1273; 7.9875 90; 90; 90 | 735.92 | Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J. Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu) Acta Crystallographica Section E, 2020, 76, 1871-1875 |
| 2243687 | CIF HKL Paper | Dy K Mo2 O8 | P b c n | 5.0776; 18.1214; 7.9428 90; 90; 90 | 730.84 | Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J. Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu) Acta Crystallographica Section E, 2020, 76, 1871-1875 |
| 2243688 | CIF HKL Paper | Ho K Mo2 O8 | P b c n | 5.077; 18.161; 7.934 90; 90; 90 | 731.5 | Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J. Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu) Acta Crystallographica Section E, 2020, 76, 1871-1875 |
| 2243689 | CIF HKL Paper | Er K Mo2 O8 | P b c n | 5.0602; 18.1965; 7.892 90; 90; 90 | 726.68 | Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J. Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu) Acta Crystallographica Section E, 2020, 76, 1871-1875 |
| 2243690 | CIF HKL Paper | K Mo2 O8 Yb | P b c n | 5.0417; 18.3039; 7.8693 90; 90; 90 | 726.2 | Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J. Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu) Acta Crystallographica Section E, 2020, 76, 1871-1875 |
| 2243691 | CIF HKL Paper | K Lu Mo2 O8 | P b c n | 5.0292; 18.2519; 7.8174 90; 90; 90 | 717.58 | Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J. Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu) Acta Crystallographica Section E, 2020, 76, 1871-1875 |
| 2243716 | CIF HKL | C12 H14 Cl2 N2 O2 Sn | P b c n | 19.9848; 10.3723; 14.4644 90; 90; 90 | 2998.3 | Henkel, Felix; Reuter, Hans Two coordination compounds of SnCl~2~ with 4-methylpyridine <i>N</i>-oxide Acta Crystallographica Section E, 2021, 77, 91-95 |
| 2243849 | CIF HKL Paper | C14 H6 F4 O2 | P b c n | 7.0588; 7.4008; 21.5265 90; 90; 90 | 1124.56 | Brown, Loren C.; Balaich, Gary J. Crystal structure of 1,2-bis(3,5-difluorophenyl)ethane-1,2-dione Acta Crystallographica Section E, 2021, 77, 700-702 |
| 2243943 | CIF HKL Paper | C12 H26 Hg N2 O2 S4 | P b c n | 12.235; 8.017; 21.251 90; 90; 90 | 2084 | Qadir, Adnan M.; Kansiz, Sevgi; Dege, Necmi; Saif, Eiad Crystal structure and Hirshfeld surface analysis of bis[(ethoxymethanethioyl)sulfanido](<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethane-1,2-diamine)mercury(II) Acta Crystallographica Section E, 2021, 77 |
| 2244057 | CIF HKL Paper | C14 H8 Br2 F N3 O2 | P b c n | 14.87; 15.2915; 13.103 90; 90; 90 | 2979.42 | Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Suleymanova, Gulnar T.; Khrustalev, Victor N.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene 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 |
| 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 |
| 2300186 | CIF HKL Paper | C26 H16 Fe N6 S2 | P b c n | 13.1928; 9.9503; 17.1498 90; 90; 90 | 2251.29 | Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude On the precision and accuracy of structural analysis of light-induced metastable states Journal of Applied Crystallography, 2007, 40, 1076-1088 |
| 2300187 | CIF HKL | C26 H16 Fe N6 S2 | P b c n | 13.185; 9.948; 17.135 90; 90; 90 | 2247.5 | Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude On the precision and accuracy of structural analysis of light-induced metastable states Journal of Applied Crystallography, 2007, 40, 1076-1088 |
| 2300188 | CIF HKL | C26 H16 Fe N6 S2 | P b c n | 12.762; 10.024; 17.09 90; 90; 90 | 2186.3 | Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude On the precision and accuracy of structural analysis of light-induced metastable states Journal of Applied Crystallography, 2007, 40, 1076-1088 |
| 2300754 | CIF | C8 H10 Ni O7 | P b c n | 20.31; 22.85; 6.226 90; 90; 90 | 2889 | Biehler, Erik; Pagola, Silvina; Stam, Daniel; Merkelbach, Johannes; Jandl, Christian; Abdel-Fattah, Tarek M A comparison of microcrystal electron diffraction and X-ray powder diffraction for the structural analysis of metal-organic frameworks. Journal of applied crystallography, 2025, 58, 398-411 |
| 2310464 | CIF | Fe2 O6 W | P b c n | 4.576; 16.766; 4.967 90; 90; 90 | 381.074 | Pinto, H.; Shaked, H.; Melamud, M. Magnetic structure of Fe2 W O6, a neutron diffraction study Acta Crystallographica A (24,1968-38,1982), 1977, 33, 663-667 |
| 2310486 | CIF | O2 Ti | P b c n | 4.515; 5.497; 4.939 90; 90; 90 | 122.581 | Simons, P.Y.; Dachille, F. The structure of Ti O2 II, a high-pressure phase of Ti O2 Acta Crystallographica (1,1948-23,1967), 1967, 23, 334-336 |
| 2310562 | CIF | P4 S6.78 | P b c n | 8.14; 11.43; 11.39 90; 90; 90 | 1059.73 | Dixon, D.T.; Einstein, F.W.B.; Penfold, B.R. The molecular and crystal structure of sulfur-deficient tetraphosphorus heptasulfide (P4 S7 - beta) Acta Crystallographica (1,1948-23,1967), 1965, 18, 221-225 |
| 2310966 | CIF | Mg O3 Si | P b c n | 9.25; 8.74; 5.32 90; 90; 90 | 430.095 | Smith, J.V. The crystal structure of proto-enstatite, Mg Si O3 Acta Crystallographica (1,1948-23,1967), 1959, 12, 515-519 |
| 2311347 | CIF Paper | C28 H30 Cd I2 N6 O6 | P b c n | 8.0245; 13.2482; 30.454 90; 90; 90 | 3237.6 | Afkhami, Farhad Akbari; Krautscheid, Harald; Atioğlu, Zeliha; Akkurt, Mehmet Crystal structure of bis-{<i>N</i>'-[(<i>E</i>)-4-hy-droxy-benzyl-idene]pyridine-4-carbohydrazide-κ<i>N</i><sup>1</sup>}di-iodidocadmium methanol disolvate. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 28-30 |
| 2311405 | CIF Paper | C32 H36 N4 O7 Zn | P b c n | 23.4004; 15.1685; 9.2353 90; 90; 90 | 3278.06 | Hökelek, Tuncer; Aşkın, Gülçin Şefiye; Özkaya, Safiye; Necefoğlu, Hacali Crystal structure and Hirshfeld surface analysis of aqua-bis-(nicotinamide-κ<i>N</i><sup>1</sup>)bis-(2,4,6-tri-methyl-benzoato-κ<i>O</i>)zinc. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1348-1352 |
| 2311433 | CIF Paper | C9 H6 O S2 | P b c n | 3.9464; 11.5015; 19.297 90; 90; 90 | 875.88 | Hübscher, Jörg; Augustin, André U; Seichter, Wilhelm; Weber, Edwin Crystal structure of a new polymorph of di(thio-phen-3-yl) ketone. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1560-1562 |
| 2312040 | CIF HKL Paper | C29 H18 F4 N4 O4 | P b c n | 13.131; 14.423; 26.523 90; 90; 90 | 5023 | Bosch, Eric; Moreno, Bryce S.; Bowling, Nathan P. π-Complexation and C-H hydrogen bonding in the formation of colored cocrystals. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 149-157 |
| 2312388 | CIF HKL Paper | C40 H40 Cl6 Fe N12 O6 | P b c n | 12.7195; 10.281; 36.735 90; 90; 90 | 4803.8 | 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-di-meth-oxy-phen-yl)-5-[6-(pyrazol-1-yl)pyridin-2-yl]-1,2,4-triazol-3-ato}iron(II)-methanol-chloro-form (1/2/2). Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 962-966 |
| 2312707 | CIF HKL | C40 H32.8 Cu4 Mo4 N8 O15.4 | P b c n | 11.694; 9.0285; 21.3258 90; 90; 90 | 2251.56 | Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 782-792 |
| 2312712 | CIF HKL Paper | C22 H42 N2 O10 | P b c n | 25.1134; 8.387; 11.857 90; 90; 90 | 2497.39 | Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 751-759 |
| 2312713 | CIF HKL Paper | C22 H40 N2 O10 | P b c n | 24.8529; 8.3869; 11.939 90; 90; 90 | 2488.55 | Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 751-759 |
| 2312752 | CIF | Fe0.08 Li0.08 Mg0.84 O3 Si | P b c n | 9.2232; 8.704; 5.3107 90; 90; 90 | 426.336 | Ballirano, Paolo; Celata, Beatrice; Pacella, Alessandro; Bloise, Andrea; Bosi, Ferdinando Crystal structure and doping in synthetic enstatite: an analysis of Li/Fe<sup>3+</sup>-doped single-crystal samples. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81 |
| 2312753 | CIF | Fe0.08 Li0.08 Mg0.84 O3 Si | P b c n | 9.2255; 8.7052; 5.3106 90; 90; 90 | 426.493 | Ballirano, Paolo; Celata, Beatrice; Pacella, Alessandro; Bloise, Andrea; Bosi, Ferdinando Crystal structure and doping in synthetic enstatite: an analysis of Li/Fe<sup>3+</sup>-doped single-crystal samples. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81 |
| 2312770 | CIF Paper | C22 H16 N6 O10 | P b c n | 14.9666; 7.0415; 21.835 90; 90; 90 | 2301.1 | Chalupná, Simona; Hušák, Michal; Čejka, Jan; Fňukal, František; Klimeš, Jiří Computation screening for incorrectly determined cocrystal structures. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 208-216 |
| 3000441 | CIF | C12 H10 N2 O S | P b c n | 10.815; 12.611; 16.549 90; 90; 90 | 2257.08 | Gogoi, Diptajyoti; Sasaki, Toshiyuki; Nakane, Takanori; Kawamoto, Akihiro; Hojo, Hironobu; Kurisu, Genji; Thakuria, Ranjit Structure Elucidation of Olanzapine Molecular Salts by Combining Mechanochemistry and Micro-Electron Diffraction Crystal Growth & Design, 2023, 23, 5821-5826 |
| 3000477 | On hold until 2024-06-19 | C6 Al Li3 O16 | P b c n | 17.65084; 11.22737; 7.62231 90; 90; 90 | 1510.53 | Alexander Missyul ? To be published in Solids |
| 4000008 | CIF | C2 H10 F Mn N2 O9 V3 | P b c n | 14.805; 7.485; 21.038 90; 90; 90 | 2331.3 | Law, Teresa S-C.; Williams, Ian D. Organo-Directed Synthesis of Manganese Vanadates with Variable Stoichiometry and Dimensionality: 1-D [(Hen)~2~Mn(VO~3~)~4~], 2-D [H~2~en]~2~[Mn(VO~3~)~6~], and 3-D [H~2~en][MnF(VO~3~)~3~] Chemistry of Materials, 2000, 12, 2070-2072 |
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