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 |
| 4000274 | CIF | C12 H16 F12 N2 O6 Ru | P b c n | 17.4585; 9.9702; 12.2534 90; 90; 90 | 2132.88 | Chemistry of Materials, 2003 |
| 4000313 | CIF | C56 H84 Co Li2 O6 | P b c n | 17.1013; 16.7999; 19.3768 90; 90; 90 | 5567 | Chemistry of Materials, 2003 |
| 4000335 | CIF | C20 H44 As2 F12 Li2 O10 | P b c n | 12.3788; 22.512; 12.3431 90; 90; 90 | 3439.6 | Chemistry of Materials, 2003 |
| 4000670 | CIF | Ba3 Dy2 P4 S16 | P b c n | 19.112; 10.2646; 12.602 90; 90; 90 | 2472.2 | Yvonne Klawitter; Wolfgang Bensch; Claudia Wickleder Synthesis, Crystal Structure, and Vibrational and Optical Spectroscopy of the First Quaternary Alkaline-Earth Rare Earth Thiophosphates Ba3Ln2[P4S16] (Ln = Gd-Er) Chem. Mater., 2006, 18, 187-197 |
| 4000671 | CIF | Ba3 Er2 P4 S16 | P b c n | 19.078; 10.2413; 12.5682 90; 90; 90 | 2455.6 | Yvonne Klawitter; Wolfgang Bensch; Claudia Wickleder Synthesis, Crystal Structure, and Vibrational and Optical Spectroscopy of the First Quaternary Alkaline-Earth Rare Earth Thiophosphates Ba3Ln2[P4S16] (Ln = Gd-Er) Chem. Mater., 2006, 18, 187-197 |
| 4000672 | CIF | Ba3 Gd2 P4 S16 | P b c n | 19.127; 10.2795; 12.648 90; 90; 90 | 2486.8 | Yvonne Klawitter; Wolfgang Bensch; Claudia Wickleder Synthesis, Crystal Structure, and Vibrational and Optical Spectroscopy of the First Quaternary Alkaline-Earth Rare Earth Thiophosphates Ba3Ln2[P4S16] (Ln = Gd-Er) Chem. Mater., 2006, 18, 187-197 |
| 4000673 | CIF | Ba3 Ho2 P4 S16 | P b c n | 19.088; 10.2481; 12.565 90; 90; 90 | 2457.9 | Yvonne Klawitter; Wolfgang Bensch; Claudia Wickleder Synthesis, Crystal Structure, and Vibrational and Optical Spectroscopy of the First Quaternary Alkaline-Earth Rare Earth Thiophosphates Ba3Ln2[P4S16] (Ln = Gd-Er) Chem. Mater., 2006, 18, 187-197 |
| 4000674 | CIF | Ba3 P4 S16 Tb2 | P b c n | 19.113; 10.261; 12.616 90; 90; 90 | 2474.2 | Yvonne Klawitter; Wolfgang Bensch; Claudia Wickleder Synthesis, Crystal Structure, and Vibrational and Optical Spectroscopy of the First Quaternary Alkaline-Earth Rare Earth Thiophosphates Ba3Ln2[P4S16] (Ln = Gd-Er) Chem. Mater., 2006, 18, 187-197 |
| 4000759 | CIF | C16 H25 Ag F7 O2 P | P b c n | 15.573; 16.835; 16.276 90; 90; 90 | 4267.1 | Kariniemi, Maarit; Niinistö, Jaakko; Hatanpää, Timo; Kemell, Marianna; Sajavaara, Timo; Ritala, Mikko; Leskelä, Markku Plasma-Enhanced Atomic Layer Deposition of Silver Thin Films Chemistry of Materials, 2011, 23, 2901 |
| 4000867 | CIF | C17.88 H15.76 F6 O4 P S8 | P b c n | 29.459; 12.607; 6.947 90; 90; 90 | 2580 | Murata, Tsuyoshi; Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Uruichi, Mikio; Yakushi, Kyuya; Saito, Gunzi; Tanaka, Koichiro Tuning of Multi-Instabilities in Organic Alloy, [(EDO-TTF)1−x(MeEDO-TTF)x]2PF6 Chemistry of Materials, 2010, 22, 3121 |
| 4000868 | CIF | C17.88 H15.76 F6 O4 P S8 | P b c n | 29.396; 12.564; 6.906 90; 90; 90 | 2550.6 | Murata, Tsuyoshi; Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Uruichi, Mikio; Yakushi, Kyuya; Saito, Gunzi; Tanaka, Koichiro Tuning of Multi-Instabilities in Organic Alloy, [(EDO-TTF)1−x(MeEDO-TTF)x]2PF6 Chemistry of Materials, 2010, 22, 3121 |
| 4000869 | CIF | C17.88 H15.76 F6 O4 P S8 | P b c n | 29.313; 12.572; 6.818 90; 90; 90 | 2512.6 | Murata, Tsuyoshi; Shao, Xiangfeng; Nakano, Yoshiaki; Yamochi, Hideki; Uruichi, Mikio; Yakushi, Kyuya; Saito, Gunzi; Tanaka, Koichiro Tuning of Multi-Instabilities in Organic Alloy, [(EDO-TTF)1−x(MeEDO-TTF)x]2PF6 Chemistry of Materials, 2010, 22, 3121 |
| 4001371 | CIF | C6 H18 N2 O21 P6 Pr2 | P b c n | 27.5001; 11.99777; 7.25373 90; 90; 90 | 2393.29 | Cunha-Silva, Luís; Mafra, Luís; Ananias, Duarte; Carlos, Luís D.; Rocha, João; Almeida Paz, Filipe A. Photoluminescent Lanthanide−Organic 2D Networks: A Combined Synchrotron Powder X-ray Diffraction and Solid-State NMR Study Chemistry of Materials, 2007, 19, 3527 |
| 4002232 | CIF | Mo2 O14 P2 Rb2 Te | P b c n | 12.544; 8.934; 11.3222 90; 90; 90 | 1268.86 | Guesdon, A.; Raveau, B. A series of Mo(VI) monophosphates involving the lone pair cation Te(IV): A2 Te Mo2 O6 (P O4)2 (A = K, Rb, Tl, Cs) Chemistry of Materials (1,1989-), 2000, 12, 2239-2243 |
| 4002234 | CIF | Mo2 O14 P2 Te Tl2 | P b c n | 12.503; 8.912; 11.3 90; 90; 90 | 1259.12 | Guesdon, A.; Raveau, B. A series of Mo(VI) monophosphates involving the lone pair cation Te(IV): A2 Te Mo2 O6 (P O4)2 (A = K, Rb, Tl, Cs) Chemistry of Materials (1,1989-), 2000, 12, 2239-2243 |
| 4002235 | CIF | Cs2 Mo2 O14 P2 Te | P b c n | 12.367; 9.4907; 11.515 90; 90; 90 | 1351.53 | Guesdon, A.; Raveau, B. A series of Mo(VI) monophosphates involving the lone pair cation Te(IV): A2 Te Mo2 O6 (P O4)2 (A = K, Rb, Tl, Cs) D Chemistry of Materials (1,1989-), 2000, 12, 2239-2243 |
| 4002307 | CIF | H2 I2 O9 U | P b c n | 8.452; 7.707; 12.271 90; 90; 90 | 799.328 | Bean, A.C.; Peper, S.M.; Albrecht-Schmitt, T.E. Structural relationships, interconversion, and optical properties of the uranyl iodates, U O2 (I O3)2 and U O2 (I O3)2 (H2 O): a comparison of reactions under mild and supercritical conditions Chemistry of Materials (1,1989-), 2001, 13, 1266-1272 |
| 4003008 | CIF | C89.5 H86.9 Ag29 Cs3 N5.75 O7 S24 | P b c n | 35.1264; 27.9091; 29.5657 90; 90; 90 | 28984.6 | Wei, Xiao; Kang, Xi; Yuan, Qianqin; Qin, Chenwanli; Jin, Shan; Wang, Shuxin; Zhu, Manzhou Capture of Cesium Ions with Nanoclusters: Effects on Inter- and Intramolecular Assembly Chemistry of Materials, 2019, 31, 4945 |
| 4003319 | CIF | C27 H21 Br Cd Cl N3 O10 | P b c n | 28.9782; 17.9781; 12.4794 90; 90; 90 | 6501.4 | An, Wen; Aulakh, Darpandeep; Zhang, Xuan; Verdegaal, Wolfgang; Dunbar, Kim R.; Wriedt, Mario Switching of Adsorption Properties in a Zwitterionic Metal‒Organic Framework Triggered by Photogenerated Radical Triplets Chemistry of Materials, 2016, 28, 7825 |
| 4003400 | CIF | C15 H26 I7 N3 Pb2 | P b c n | 41.4633; 9.0279; 8.7717 90; 90; 90 | 3283.48 | Oswald, Iain W. H.; Koegel, Alexandra A.; Neilson, James R. General Synthesis Principles for Ruddlesden‒Popper Hybrid Perovskite Halides from a Dynamic Equilibrium Chemistry of Materials, 2018, 30, 8606 |
| 4003516 | CIF | H2 Lu N O7 Se | P b c n | 16.151; 11.854; 6.795 90; 90; 90 | 1300.9 | Wu, Chao; Li, Longhua; Lin, Lin; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi Enhancement of Second-Order Optical Nonlinearity in a Lutetium Selenite by Monodentate Anion Partial Substitution Chemistry of Materials, 2020 |
| 4004007 | CIF | C18 Bi2 Br9 N3 | P b c n | 22.4702; 18.4743; 19.2456 90; 90; 90 | 7989.3 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004009 | CIF | C18 H48 Bi2 Br9 N3 | P b c n | 23.0597; 18.4426; 18.2352 90; 90; 90 | 7755.1 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4020635 | CIF | C15 H15 F2 N3 O2 S | P b c n | 21.3729; 9.7107; 14.4801 90; 90; 90 | 3005.3 | Aurelie Baron; Graham Sandford; Rachel Slater; Dmitry S. Yufit; Judith A. K. Howard; Antonio Vong Polyfunctional Tetrahydropyrido[2,3-b]pyrazine Scaffolds from 4-Phenylsulfonyl Tetrafluoropyridine Journal of Organic Chemistry, 2005, 70, 9377-9381 |
| 4020700 | CIF | C22.5 H25 Cl N2 O3 | P b c n | 32.3497; 9.9117; 12.2514 90; 90; 90 | 3928.3 | Birte Basler; Oliver Schuster; Thorsten Bach Conformationally Constrained β-Amino Acid Derivatives by Intramolecular [2 + 2]-Photocycloaddition of a Tetronic Acid Amide and Subsequent Lactone Ring Opening Journal of Organic Chemistry, 2005, 70, 9798-9808 |
| 4020885 | CIF | C11 H16 O | P b c n | 21.31; 9.721; 8.755 89; 89; 90 | 1813.4 | Naoki Kise Theoretical Study of Electroreductive Intramolecular Coupling of Nonconjugated Olefinic and Aromatic Ketones Journal of Organic Chemistry, 2004, 69, 2147-2152 |
| 4020914 | CIF | C30 H24 Br2 N4 O3 S | P b c n | 22.3292; 15.1543; 8.8149 90; 90; 90 | 2982.8 | Md. Akhtaruzzaman; Masaaki Tomura; Jun-ichi Nishida; Yoshiro Yamashita Synthesis and Characterization of Novel Dipyridylbenzothiadiazole and Bisbenzothiadiazole Derivatives Journal of Organic Chemistry, 2004, 69, 2953-2958 |
| 4021133 | CIF | C22 H26 S | P b c n | 17.9083; 12.7853; 7.5734 90; 90; 90 | 1734.03 | Antonella Converso; Pierre-Loïc Saaidi; K. Barry Sharpless; M. G. Finn Nucleophilic Substitution by Grignard Reagents on Sulfur Mustards Journal of Organic Chemistry, 2004, 69, 7336-7339 |
| 4021356 | CIF | C11 H15 N2 O2 S2 | P b c n | 21.577; 7.3939; 15.952 90; 90; 90 | 2545 | Akiyuki Hamasaki; Richard Ducray; Dale L. Boger Two Novel 1,2,4,5-Tetrazines that Participate in Inverse Electron Demand Diels-Alder Reactions with an Unexpected Regioselectivity Journal of Organic Chemistry, 2006, 71, 185-193 |
| 4021380 | CIF | C21 H26 | P b c n | 15.4353; 10.5395; 21.014 90; 90; 90 | 3418.6 | V. Zaitsev; S. V. Rosokha; M. Head-Gordon; J. K. Kochi Steric Modulations in the Reversible Dimerizations of Phenalenyl Radicals via Unusually Weak Carbon-Centered π- and σ-Bonds Journal of Organic Chemistry, 2006, 71, 520-526 |
| 4021553 | CIF | C30 H32 O10 | P b c n | 38.507; 11.0686; 13.5293 90; 90; 90 | 5766.5 | Vijay Nair; Ani Deepthi; Manojkumar Poonoth; Bindu Santhamma; Sreekumar Vellalath; Beneesh Pattoorpady Babu; Resmi Mohan; Eringathodi Suresh Reaction of Dimethoxycarbene-DMAD Zwitterion with 1,2-Diones and Anhydrides: A Novel Synthesis of Highly Substituted Dihydrofurans and Spirodihydrofurans Journal of Organic Chemistry, 2006, 71, 2313-2319 |
| 4021558 | CIF | C21 H29 B F2 N2 O2 | P b c n | 18.193; 11.808; 9.98 90; 90; 90 | 2143.9 | Chikoto Fujimoto; Yukio Kusunose; Hiromitsu Maeda CH···Anion Interaction in BF~2~ Complexes of C~3~-Bridged Oligopyrroles Journal of Organic Chemistry, 2006, 71, 2389-2394 |
| 4021721 | CIF | C10 H22 N2 O2 Os | P b c n | 6.1505; 12.5027; 16.6071 90; 90; 90 | 1277.05 | Timothy J. Donohoe; Robert M. Harris; Sam Butterworth; Jeremy N. Burrows; Andrew Cowley; Jeremy S. Parker New Osmium-Based Reagent for the Dihydroxylation of Alkenes Journal of Organic Chemistry, 2006, 71, 4481-4489 |
| 4021741 | CIF | C73 H98 Li2 N4 O4 | P b c n | 17.47; 28.695; 27.5 90; 90; 90 | 13786 | Maurice Frederic Pilz; Christian Limberg; Burkhard Ziemer Xanthene-Based Ligand with Two Adjacent β-Diiminato Binding Sites Journal of Organic Chemistry, 2006, 71, 4559-4564 |
| 4021805 | CIF | C26 H34 Cl2 N5 O1.5 Pd | P b c n | 22.812; 15.838; 14.956 90; 90; 90 | 5403.8 | Fanlong Zeng; Zhengkun Yu Pyridyl-Supported Pyrazolyl-N-Heterocyclic Carbene Ligands and the Catalytic Activity of Their Palladium Complexes in Suzuki-Miyaura Reactions Journal of Organic Chemistry, 2006, 71, 5274-5281 |
| 4021843 | CIF | C13 H12 O2 | P b c n | 11.1852; 12.1545; 14.9021 90; 90; 90 | 2025.95 | Emma L. Pearson; Laurence C. H. Kwan; Craig I. Turner; Garth A. Jones; Anthony C. Willis; Michael N. Paddon-Row; Michael S. Sherburn Intramolecular Diels-Alder Reactions of Ester Linked 1,3,9-Decatrienes: Cis/Trans Selectivity in Thermal and Lewis Acid Promoted Reactions of Ethylene-Tethered and Benzo-Tethered Systems Journal of Organic Chemistry, 2006, 71, 6099-6109 |
| 4021992 | CIF | C13 H10 N2 O | P b c n | 23.155; 11.9939; 7.0969 90; 90; 90 | 1970.9 | Maike V. Peters; Ragnar S. Stoll; Richard Goddard; Gernot Buth; Stefan Hecht On the Illusive Nature of o-Formylazobenzenes: Exploiting the Nucleophilicity of the Azo Group for Cyclization to Indazole Derivatives Journal of Organic Chemistry, 2006, 71, 7840-7845 |
| 4022150 | CIF | C18 H24 | P b c n | 11.155; 7.505; 16.57 90; 90; 90 | 1387 | Sergiy V. Rosokha; Jay K. Kochi The Question of Aromaticity in Open-Shell Cations and Anions as Ion-Radical Offsprings of Polycyclic Aromatic and Antiaromatic Hydrocarbons Journal of Organic Chemistry, 2006, 71, 9357-9365 |
| 4022291 | CIF | C83 H132 N32 O16 | P b c n | 23.6973; 19.9952; 20.2313 90; 90; 90 | 9586 | Hélène Sauriat-Dorizon; Thierry Maris; James D. Wuest; Gary D. Enright Molecular Tectonics. Construction of Porous Hydrogen-Bonded Networks from Bisketals of Pentaerythritol Journal of Organic Chemistry, 2003, 68, 240-246 |
| 4022358 | CIF | C24 H10 N O2 | P b c n | 12.2443; 12.454; 11.9541 90; 90; 90 | 1822.9 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
| 4022374 | CIF | C24 H22 Co2 O7 | P b c n | 32.378; 15.971; 9.371 90; 90; 90 | 4846 | David R. Carbery; Serge Reignier; Neil D. Miller; Harry Adams; Joseph P. A. Harrity Investigation of a Stereoselective Co-Mediated Rearrangement Reaction Journal of Organic Chemistry, 2003, 68, 4392-4399 |
| 4022452 | CIF | C9 H8 N6 S5 | P b c n | 6.2662; 13.0714; 17.4538 90; 90; 90 | 1429.61 | Franciszek Sączewski; Jarosław Sączewski; Maria Gdaniec Synthesis, Molecular Structure, and Applications of 2-Hydroxylamino-4,5-dihydroimidazolium-O-sulfonate to the Synthesis of Novel Heterocyclic Ring Systems Journal of Organic Chemistry, 2003, 68, 4791-4796 |
| 4022618 | CIF | C26 H38 Cl2 N10 O10 | P b c n | 29.633; 17.158; 12.5526 90; 90; 90 | 6382.3 | Ali Asadi; Brian O. Patrick; David M. Perrin Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures Journal of Organic Chemistry, 2007, 72, 466-475 |
| 4023337 | CIF | C60 H42 | P b c n | 18.431; 11.8956; 19.474 90; 90; 90 | 4269.7 | Sethuraman Sankararaman; Gandikota Venkataramana; Babu Varghese Conformational Isomers from Rotation of Diacetylenic Bond in an Ethynylpyrene-Substituted Molecular Hinge Journal of Organic Chemistry, 2008, 73, 2404-2407 |
| 4023390 | CIF | C21 H33 N O5 | P b c n | 29.491; 10.35; 13.652 90; 90; 90 | 4167.1 | Christopher E. Katz; Timothy Ribelin; Donna Withrow; Yashar Basseri; Anna K. Manukyan; Amy Bermudez; Christian G Nuera; Victor W. Day; Douglas R. Powell; Jennifer L. Poutsma; Jeffrey Aubé Nonbonded, Attractive Cation-π Interactions in Azide-Mediated Asymmetric Ring Expansion Reactions Journal of Organic Chemistry, 2008, 73, 3318-3327 |
| 4024296 | CIF | C17 H22 O6 | P b c n | 22.5294; 13.8214; 10.741 90; 90; 90 | 3344.6 | Eric Fillion; Ashraf Wilsily; Dan Fishlock Probing Persistent Intramolecular C-H...X (X = O, S, Br, Cl, and F) Bonding in Solution Using Benzyl Meldrum's Acid Derivatives Journal of Organic Chemistry, 2009, 74, 1259-1267 |
| 4024833 | CIF | C104 H28 F30 O2 | P b c n | 17.8857; 25.3005; 31.4601 90; 90; 90 | 14236.2 | Yuta Takano; M. Ángeles Herranz; Ivan E. Kareev; Steven H. Strauss; Olga V. Boltalina; Takeshi Akasaka; Nazario Martín Efficient Regioselective [4+2] Cycloaddition of o-Quinodimethane to C70(CF3)10 Journal of Organic Chemistry, 2009, 74, 6902-6905 |
| 4024951 | CIF | C17.5 H31 N4 O4.5 Pd | P b c n | 12.1919; 13.4354; 25.0193 90; 90; 90 | 4098.2 | Suzanne R. Golisz; Nilay Hazari; Jay A. Labinger; John E. Bercaw Activation of the C-N Bond in Nitromethane by Palladium α-Diimine Complexes Journal of Organic Chemistry, 2009, 74, 8441-8443 |
| 4025253 | CIF | C16 H17 Br O3 | P b c n | 21.609; 8.9577; 15.245 90; 90; 90 | 2950.9 | Arata Takahashi; Hikaru Yanai; Min Zhang; Takaaki Sonoda; Masaaki Mishima; Takeo Taguchi Highly Effective Vinylogous Mukaiyama-Michael Reaction Catalyzed by Silyl Methide Species Generated from 1,1,3,3-Tetrakis(trifluoromethanesulfonyl)propane Journal of Organic Chemistry, 2010, 75, 1259-1265 |
| 4025863 | CIF | C15 H19 N5 O4 S | P b c n | 18.5439; 8.3721; 21.282 90; 90; 90 | 3304.1 | Larissa B. Krasnova; Jason E. Hein; Valery V. Fokin Synthesis of 7-Aza-5-deazapurine Analogues via Copper(I)-Catalyzed Hydroamination of Alkynes and 1-Iodoalkynes Journal of Organic Chemistry, 2010, 75, 8662-8665 |
| 4025925 | CIF | C27 H22 | P b c n | 15.8798; 15.026; 8.5564 90; 90; 90 | 2041.6 | Curtis J. Rieder; Karl J. Winberg; F. G. West Olefination of α,α'-Divinyl Ketones through Catalytic Meyer-Schuster Rearrangement Journal of Organic Chemistry, 2011, 76, 50-56 |
| 4026031 | CIF | C18 H30 O6 P2 | P b c n | 16.291; 12.324; 10.331 90; 90; 90 | 2074.2 | K. V. Sajna; Ramesh Kotikalapudi; Manab Chakravarty; N. N. Bhuvan Kumar; K. C. Kumara Swamy Cycloaddition Reactions of Allenylphosphonates and Related Allenes with Dialkyl Acetylenedicarboxylates, 1,3-Diphenylisobenzofuran, and Anthracene Journal of Organic Chemistry, 2011, 76, 920-938 |
| 4026237 | CIF | C31 H25 O2 | P b c n | 16.648; 9.1111; 29.258 90; 90; 90 | 4437.9 | Wanchai Pluempanupat; Michael Abraham; Lothar Brecker; Peter Wolschann; Alfred Karpfen; Vladimir B. Arion; Michael Widhalm Synthesis and Conformation of Chiral Biheteroaryls Journal of Organic Chemistry, 2011, 76, 3222-3230 |
| 4026485 | CIF | C8 H7 Br N2 O3 | P b c n | 6.874; 15.5103; 17.3312 90; 90; 90 | 1847.81 | Emmanuelle Dubost; Christine Fossey; Thomas Cailly; Sylvain Rault; Frederic Fabis Selective ortho-Bromination of Substituted Benzaldoximes Using Pd-Catalyzed C-H Activation: Application to the Synthesis of Substituted 2-Bromobenzaldehydes Journal of Organic Chemistry, 2011, 76, 6414-6420 |
| 4026816 | CIF | F5 Fe H8 N2 | P b c n | 7.6223; 13.4408; 10.4167 90; 90; 90 | 1067.19 | Fourquet, J L; Le Bail, A; Duroy, H; Moron, M C (NH4)2FeF5 : crystal structures of its alpha and beta forms European Journal of Solid State and Inorganic Chemistry, 1989, 26, 435-443 |
| 4027177 | CIF | C17 H16 N O3 | P b c n | 20.608; 9.544; 15.325 90; 90; 90 | 3014.2 | Kyle M. Schmid; Lasse Jensen; Scott T. Phillips A Self-Immolative Spacer That Enables Tunable Controlled Release of Phenols under Neutral Conditions Journal of Organic Chemistry, 2012, 77, 4363-4374 |
| 4027617 | CIF | C22 H12 N2 | P b c n | 13.333; 8.0402; 14.989 90; 90; 90 | 1606.8 | Peng-Fei Li; Chuan-Feng Chen Synthesis, Structures, and Solid State Self-Assemblies of Formyl and Acetyl Substituted Triptycenes and Their Derivatives Journal of Organic Chemistry, 2012, 77, 9250-9259 |
| 4027945 | CIF | C32 H32 N2 O6 S2 | P b c n | 12.228; 11.2609; 20.2299 90; 90; 90 | 2785.6 | Jan Vávra; Lukáš Severa; Ivana Císařová; Blanka Klepetářová; David Šaman; Dušan Koval; Václav Kašička; Filip Teplý Search for Conglomerate in Set of [7]Helquat Salts: Multigram Resolution of Helicene-Viologen Hybrid by Preferential Crystallization Journal of Organic Chemistry, 2013, 78, 1329-1342 |
| 4028284 | CIF | C36 H27 N O | P b c n | 11.9773; 33.8488; 26.8616 90; 90; 90 | 10890.2 | Yushang Shao; Kai Zhu; Zhengchen Qin; Ende Li; Yanzhong Li Lewis Acid-Catalyzed Cyclization of Enaminones with Propargylic Alcohols: Regioselective Synthesis of Multisubstituted 1,2-Dihydropyridines Journal of Organic Chemistry, 2013, 78, 5731-5736 |
| 4028331 | CIF | C75 H53 B2 Cl3 F4 N10 O6 | P b c n | 16.8116; 10.7857; 35.2377 90; 90; 90 | 6389.5 | Hemanta Kalita; Way-Zen Lee; Mangalampalli Ravikanth Synthesis and Functionalization of BF2-Complexes of meso-Free 25-Oxasmaragdyrin Journal of Organic Chemistry, 2013, 78, 6285-6290 |
| 4028444 | CIF | C86 H12 Br2 S4 | P b c n | 50.558; 10.0753; 20.1387 90; 90; 90 | 10258.4 | Shu-Hui Li; Zong-Jun Li; Wei-Wei Yang; Xiang Gao Reactions of C70(2-) with Organic Halides Revisited: Unusual Magnetic Equivalence for the Diastereotopic Methylene Protons in 2,5-(PhCH2)2C70 Journal of Organic Chemistry, 2013, 78, 7208-7215 |
| 4028552 | CIF | C18 H11 N5 | P b c n | 23.5138; 13.2286; 9.4729 90; 90; 90 | 2946.59 | Styliana I. Mirallai; Maria Manoli; Panayiotis A. Koutentis Reactions of Tetracyanoethylene with N'-Arylbenzamidines: A Route to 2-Phenyl-3H-imidazo[4,5-b]quinoline-9-carbonitriles Journal of Organic Chemistry, 2013, 78, 8655-8668 |
| 4029140 | CIF | C15 H24 N4 O3 | P b c n | 13.0853; 11.4562; 20.7283 90; 90; 90 | 3107.3 | Camus, Nathalie; Halime, Zakaria; Le Bris, Nathalie; Bernard, Hélène; Platas-Iglesias, Carlos; Tripier, Raphaël Full Control of the Regiospecific N-Functionalization of C-Functionalized Cyclam Bisaminal Derivatives and Application to the Synthesis of their TETA, TE2A, and CB-TE2A Analogues. The Journal of organic chemistry, 2014, 79, 1885-1899 |
| 4029252 | CIF | C30 H35 N O2 | P b c n | 34.511; 8.6859; 18.3438 90; 90; 90 | 5498.7 | Koshima, Hideko; Fukano, Michitaro; Ojima, Naoko; Johmoto, Kohei; Uekusa, Hidehiro; Shiro, Motoo Absolute asymmetric photocyclization of triisopropylbenzophenone derivatives in crystals and their morphological changes. The Journal of organic chemistry, 2014, 79, 3088-3093 |
| 4029694 | CIF | C21 H27 Cl N2 O2 | P b c n | 18.293; 22.343; 9.9739 90; 90; 90 | 4076.5 | Lefranc, Julien; Minassi, Alberto; Clayden, Jonathan Carbolithiation of N-alkenyl ureas and N-alkenyl carbamates. Beilstein journal of organic chemistry, 2013, 9, 628-632 |
| 4029952 | CIF | C24 H28 N2 S2 | P b c n | 11.6513; 12.2564; 15.2898 90; 90; 90 | 2183.43 | Boice, Geneviève; Patrick, Brian O.; McDonald, Robert; Bohne, Cornelia; Hicks, Robin Synthesis and photophysics of thioindigo diimines and related compounds. The Journal of organic chemistry, 2014, 79, 9196-9205 |
| 4030282 | CIF | C10 H22 Ce2 O23 | P b c n | 23.825; 14.044; 6.673 90; 90; 90 | 2232.8 | Trombe, J.-C.; Petit, J.-F.; Gleizes, A. Lanthanide oxalato-squarates : preparation and crystal structures of [Ce2(H2O)8(C4O4)2(C2O4)].3H2O and Eu2(H2O)4(C4O4)2(C2O4) European Journal of Solid State and Inorganic Chemistry, 1991, 28, 669-681 |
| 4030508 | CIF | Nb1.5 O12 P3 Sb0.5 | P b c n | 12.0769; 8.6732; 8.7293 90; 90; 90 | 914.354 | Jouanneaux, A.; Fitch, A. N.; Oyetola, S.; Verbaere, A.; Guyomard, D.; Piffard, Y. The (MIII1/2M'V3/3)(PO4)3 compounds, M = Sb, Nd, Eu, Bi; M' = Sb, Nb, Ta. Preparation and structure European Journal of Solid State and Inorganic Chemistry, 1993, 30, 125-137 |
| 4030537 | CIF | C21 H34 O5 | P b c n | 23.5047; 13.3187; 13.1615 90; 90; 90 | 4120.2 | Yang, Wei; Cao, Jingming; Zhang, Mengxun; Lan, Rongfeng; Zhu, Lizhi; Du, Guangyan; He, Shuzhong; Lee, Chi-Sing Systemic Study on the Biogenic Pathways of Yezo'otogirins: Total Synthesis and Antitumor Activities of (±)-Yezo'otogirin C and Its Structural Analogues. The Journal of organic chemistry, 2014, 80, 836 |
| 4030907 | CIF | Bi2 O7 Te2 | P b c n | 22.794; 5.526; 22.065 90; 90; 90 | 2779.3 | Mercurio, D.; Champarnaud-Mesjard, J. C.; Gouby, I.; Frit, B. On the crystal structure of Bi~2~Te~2~O~7~ European Journal of Solid State and Inorganic Chemistry, 1998, 35, 49-65 |
| 4031010 | CIF | C30 H20 Br4 Cu S8 | P b c n | 21.0945; 13.8077; 12.4172 90; 90; 90 | 3616.7 | Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties. Beilstein journal of organic chemistry, 2015, 11, 850-859 |
| 4031170 | CIF | C13 H14 O2 S | P b c n | 19.5452; 6.7915; 17.2517 90; 90; 90 | 2290.01 | Higashimae, Shinya; Tamai, Taichi; Nomoto, Akihiro; Ogawa, Akiya Selective Thiolative Lactonization of Internal Alkynes Bearing a Hydroxyl Group with Carbon Monoxide and Organic Disulfides Catalyzed by Transition-Metal Complexes. The Journal of organic chemistry, 2015, 80, 7126-7133 |
| 4031377 | CIF | H6 S Si2 | P b c n | 8.14; 14.76; 8.68 90; 90; 90 | 1042.87 | Barrow, M.J.; Ebsworth, E.A.V. Crystal and molecular structures of disilyl sulphide (at 120 K) and of disilyl selenide (at 125 K) and comparison with crystalline disilyl oxide Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1982, 1982, 211-216 |
| 4031522 | CIF | Cs4 O17 U5 | P b c n | 18.776; 7.07; 14.958 90; 90; 90 | 1985.62 | van Egmond, A.B. Investigations on Cesium Uranates - V. The Crystal Structures of (Cs2 U O4), (Cs4 U5 O17), (Cs2 U7 O22) and (Cs2 U15 O46) Journal of Inorganic and Nuclear Chemistry, 1976, 38, 1649-1651 |
| 4031913 | CIF | C17 H28 S4 | P b c n | 5.9887; 10.5588; 28.4505 90; 90; 90 | 1799.02 | Wessig, P.; Gerngroß, M; Freyse, D.; Bruhns, P.; Przezdziak, M.; Schilde, U.; Kelling, A. Molecular Rods Based on Oligo-spiro-thioketals. The Journal of organic chemistry, 2016, 81, 1125-1136 |
| 4032025 | CIF | C12 H16 O2 | P b c n | 15.72; 10.2218; 12.7916 90; 90; 90 | 2055.44 | Berry, Ellen; Gomes, Gabriel Dos Passos; MacLean, Alex; Martin, Justin R.; Wiget, Paul A. Discovery of a Long-Range Perlin Effect in a Conformationally Constrained Oxocane. The Journal of organic chemistry, 2016, 81, 5740-5744 |
| 4032452 | CIF | C50 H28 F6 O2 | P b c n | 27.9369; 20.0666; 20.6827 90; 90; 90 | 11594.7 | Tseng, Ting; Lu, Hsiu-Feng; Kao, Chen-Yi; Chiu, Chun-Wei; Chao, Ito; Prabhakar, Chetti; Yang, Jye-Shane Redox-Gated Tristable Molecular Brakes of Geared Rotation. The Journal of organic chemistry, 2017, 82, 5354-5366 |
| 4032587 | CIF | C18 H18 O2 | P b c n | 20.772; 7.4286; 18.5851 90; 90; 90 | 2867.8 | Chan, Chieh-Kai; Hsueh, Nai-Chen; Tsai, Yu-Lin; Chang, Meng-Yang Bi(OTf)3-Mediated Intramolecular Olefinic Cyclization: Synthesis of Substituted Aryl-Dihydronaphthalenes and Indenes. The Journal of organic chemistry, 2017, 82, 7077-7084 |
| 4032684 | CIF | C17 H15 N O3 | P b c n | 16.81; 10.863; 15.317 90; 90; 90 | 2797 | Li, Yazhou; Li, Jian; Wu, Xiaowei; Zhou, Yu; Liu, Hong Rh(III)-Catalyzed C-H Cyclization of Arylnitrones with Diazo Compounds: Access to 3-Carboxylate Substituted N-Hydroxyindoles. The Journal of organic chemistry, 2017, 82, 8984-8994 |
| 4032726 | CIF | C8 H9 N2 O2 | P b c n | 16.9866; 7.995; 11.8016 90; 90; 90 | 1602.8 | Otevrel, Jan; Bobal, Pavel Diamine-Tethered Bis(thiourea) Organocatalyst for Asymmetric Henry Reaction. The Journal of organic chemistry, 2017, 82, 8342-8358 |
| 4033619 | CIF | C23 H16 Cl3 I2 In N O2 | P b c n | 29.4767; 7.5456; 21.702 90; 90; 90 | 4826.9 | Yata, Tetsuji; Kita, Yuji; Nishimoto, Yoshihiro; Yasuda, Makoto Regioselective Synthesis of 5-Metalated 2-Pyrones by Intramolecular Oxymetalation of Carbonyl-ene-yne Compounds Using Indium Trihalide. The Journal of organic chemistry, 2019, 84, 14330-14341 |
| 4033660 | CIF | C14 H16 Cl N O4 | P b c n | 7.4216; 21.0246; 18.741 90; 90; 90 | 2924.3 | Crumbie, Robyn L.; Chalmers, Gareth; Bhadbhade, Mohan; Griffith, Renate Exploration of the Differences Between Amine and Thiolate Addition to Acetylenedicarboxylates. The Journal of organic chemistry, 2019 |
| 4033796 | CIF | C42 H38 N4 O6 | P b c n | 13.9994; 15.5034; 15.4665 90; 90; 90 | 3356.8 | Guy, Laure; Mosser, Maëlle; Pitrat, Delphine; Mulatier, Jean-Christophe; Kukułka, Mercedes; Srebro-Hooper, Monika; Jeanneau, Erwann; Bensalah-Ledoux, Amina; Baguenard, Bruno; Guy, Stéphan Modulation of Chiroptical Properties in a Series of Helicene-like Compounds. The Journal of organic chemistry, 2019, 84, 10870-10876 |
| 4033817 | CIF | C12 H11 F3 N2 O | P b c n | 15.6241; 17.7725; 8.396 90; 90; 90 | 2331.4 | Rocha, Mariana; Gil, Diego M.; Echeverría, Gustavo A; Piro, Oscar E.; Jios, Jorge L.; Ulic, Sonia E. Enol-imino-Keto-enamine Tautomerism in a Diazepine Derivative: How Decisive Are the Intermolecular Interactions in the Equilibrium? The Journal of organic chemistry, 2019, 84, 11042-11053 |
| 4033878 | CIF | C28 H14 O4 | P b c n | 14.3827; 9.2545; 13.9386 90; 90; 90 | 1855.3 | Mukhopadhyay, Arindam; Jana, Kanyashree; Hossen, Tousif; Sahu, Kalyanasis; Moorthy, Jarugu Narasimha Coumarin-Annelated Regioisomeric Heptahelicenes: Influence of Helicity on Excited-State Properties and Chiroptical Properties. The Journal of organic chemistry, 2019, 84, 10658-10668 |
| 4034185 | CIF | C52 H37 N5 | P b c n | 20.9298; 19.076; 9.3341 90; 90; 90 | 3726.7 | Pérez-Caaveiro, Cristina; Oliva, María Moreno; López Navarrete, Juan T; Pérez Sestelo, José; Martínez, M Montserrat; Sarandeses, Luis A. Synthesis of D-A-A and D-A-D Pyrimidine π-Systems Using Triorganoindium Reagents: Optical, Vibrational, and Electrochemical Studies. The Journal of organic chemistry, 2019, 84, 8870-8885 |
| 4034503 | CIF | C13 H10 N2 S | P b c n | 27.438; 8.466; 9.7512 90; 90; 90 | 2265.1 | Liu, Xing; Dong, Zhi-Bing Chemoselective Chan-Lam Coupling Reactions between Benzimidazoline-2-thiones and Arylboronic Acids. The Journal of organic chemistry, 2019, 84, 11524-11532 |
| 4034576 | CIF | C16 H15 Cl O3 | P b c n | 8.345; 11.25; 30.833 90; 90; 90 | 2894.6 | Al-Smadi, Derar; Enugala, Thilak Reddy; Kessler, Vadim; Mhashal, Anil Ranu; Lynn Kamerlin, Shina Caroline; Kihlberg, Jan; Norberg, Thomas; Widersten, Mikael Chemical and Biochemical Approaches for the Synthesis of Substituted Dihydroxybutanones and Di- and Tri-Hydroxypentanones. The Journal of organic chemistry, 2019, 84, 6982-6991 |
| 4034805 | CIF | C17 H14 N2 O | P b c n | 23.7477; 7.4516; 7.8082 90; 90; 90 | 1381.73 | Espinoza-Hicks, Carlos; Montoya, Pablo; Bautista, Rafael; Jiménez-Vázquez, Hugo A; Rodríguez-Valdez, Luz M; Camacho-Dávila, Alejandro A; Cossío, Fernando P; Delgado, Francisco; Tamariz, Joaquín Synthesis of exo-Imidazolidin-2-one Dienes, Their Isomerization, and Selectivity in Diels-Alder Cycloadditions. The Journal of organic chemistry, 2018, 83, 5347-5364 |
| 4035084 | CIF | C17 H34 N2 S4 | P b c n | 26.509; 10.6554; 14.59 90; 90; 90 | 4121.1 | Walker, Tia L.; Taschner, Ian S.; Chandra M, Sharath; Taschner, Michael J.; Engle, James T.; Schrage, Briana R.; Ziegler, Christopher J.; Gao, Xinfeng; Wheeler, Steven E. Lone-Pair-Induced Topicity Observed in Macrobicyclic Tetra-thia Lactams and Cryptands: Synthesis, Spectral Identification, and Computational Assessment. The Journal of organic chemistry, 2018, 83, 10025-10036 |
| 4035272 | CIF | C29 H27 N O3 | P b c n | 20.435; 9.87597; 22.7727 90; 90; 90 | 4595.88 | Takeda, Takuya; Harada, Shinji; Okabe, Akito; Nishida, Atsushi Cyclohepta[ b]indole Synthesis through [5 + 2] Cycloaddition: Bifunctional Indium(III)-Catalyzed Stereoselective Construction of 7-Membered Ring Fused Indoles. The Journal of organic chemistry, 2018, 83, 11541-11551 |
| 4035345 | CIF | C46 H40 Cl2 Co N8 | P b c n | 25.349; 16.304; 24.858 90; 90; 90 | 10274 | Wu, Jing; Zeng, Haisu; Cheng, Jessica; Zheng, Shengping; Golen, James A.; Manke, David R.; Zhang, Guoqi Cobalt(II) Coordination Polymer as a Precatalyst for Selective Hydroboration of Aldehydes, Ketones, and Imines. The Journal of organic chemistry, 2018, 83, 9442-9448 |
| 4035350 | CIF | C38.5 H41 Cl O5 | P b c n | 32.1927; 18.4712; 11.935 90; 90; 90 | 7097 | Sharma, Brijesh M.; Rathod, Jayant; Gonnade, Rajesh G.; Kumar, Pradeep Harnessing Nucleophilicity of Allenol Ester with p-Quinone Methides via Gold Catalysis: Application to the Synthesis of Diarylmethine-Substituted Enones. The Journal of organic chemistry, 2018, 83, 9353-9363 |
| 4035427 | CIF | C39 H30 Cl2 N4 O4 | P b c n | 17.2491; 20.1577; 21.143 90; 90; 90 | 7351.5 | Liang, Jin-Yan; Shen, Shou-Jie; Chai, Xiao-Qian; Lv, Ting Lewis-Base-Catalyzed [1 + 2 + 2] Annulation Reaction of Morita-Baylis-Hillman Carbonates with Unsaturated Pyrazolones: Construction of All-Stereogenic Carbon Cyclopentane-Fused Dispiropyrazolones. The Journal of organic chemistry, 2018, 83, 12744-12752 |
| 4035503 | CIF | C22 H21.25 N O5.25 | P b c n | 16.2526; 16.9979; 14.2159 90; 90; 90 | 3927.3 | Annamalai, Pratheepkumar; Hsu, Kou-Chi; Raju, Selvam; Hsiao, Huan-Chang; Chou, Chih-Wei; Lin, Gu-Ying; Hsieh, Cheng-Ming; Chen, Pei-Ling; Liu, Yi-Hung; Chuang, Shih-Ching Palladium(II)-Catalyzed Mono- and Bis-alkenylation of N-Acetyl-2-aminobiaryls through Regioselective C-H Bond Activation. The Journal of organic chemistry, 2018, 83, 3840-3856 |
| 4035861 | CIF | C28 H36 I3 N16 Na3 O6 | P b c n | 16.1345; 17.9552; 13.8025 90; 90; 90 | 3998.6 | Bookser, Brett C.; Weinhouse, Michael I.; Burns, Aaron C.; Valiere, Andrew N.; Valdez, Lino J.; Stanczak, Pawel; Na, Jim; Rheingold, Arnold L.; Moore, Curtis E.; Dyck, Brian Solvent-Controlled, Site-Selective N-Alkylation Reactions of Azolo-Fused Ring Heterocycles at N1-, N2-, and N3-Positions, Including Pyrazolo[3,4- d]pyrimidines, Purines, [1,2,3]Triazolo[4,5]pyridines, and Related Deaza-Compounds. The Journal of organic chemistry, 2018, 83, 6334-6353 |
| 4036443 | CIF | C15 H16 O | P b c n | 9.676; 13.6599; 16.9725 90; 90; 90 | 2243.31 | Apeland, Ingrid Malene; Rosenberg, Murray G.; Arion, Vladimir B.; Kählig, Hanspeter; Brinker, Udo H. Intermolecular Reactions of a Foiled Carbene with Carbonyl Compounds: The Effects of Trishomocyclopropyl Stabilization. The Journal of organic chemistry, 2015, 80, 11877-11887 |
| 4036884 | CIF | C12 H20 O5 | P b c n | 16.80683; 14.18677; 10.38483 90; 90; 90 | 2476.1 | Wang, Jian; Tong, Rongbiao Total Synthesis of Purported Cephalosporolides H and I, Penisporolide B, and Their Stereoisomers. The Journal of organic chemistry, 2016, 81, 4325-4339 |
| 4036904 | CIF | C19 H20 Br N O | P b c n | 15.6449; 9.02047; 23.2833 90; 90; 90 | 3285.84 | Clark, Andrew J.; Curran, Dennis P.; Fox, David J.; Ghelfi, Franco; Guy, Collette S.; Hay, Benjamin; James, Natalie; Phillips, Jessica M.; Roncaglia, Fabrizio; Sellars, Philip B.; Wilson, Paul; Zhang, Hanmo Axially Chiral Enamides: Substituent Effects, Rotation Barriers, and Implications for their Cyclization Reactions. The Journal of organic chemistry, 2016, 81, 5547-5565 |
| 4037108 | CIF | C14 H20 S3 Si2 | P b c n | 32.516; 10.235; 11.456 90; 90; 90 | 3812.6 | Liu, Qiuxin; Gao, Xiuxiu; Zhong, Hao; Song, Jinsheng; Wang, Hua Planar Heptathienoacenes Based on Unsymmetric Dithieno[3,2-b:3',4'-d]thiophene: Synthesis and Photophysical Properties. The Journal of organic chemistry, 2016, 81, 8612-8616 |
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