Crystallography Open Database
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Searching space group like 'I 41/a'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1513098 | CIF | C54 H107 Cl2 N35 O40 | I 41/a | 35.5457; 35.5457; 29.5785 90; 90; 90 | 37372.3 | Ma, Wen-Juan; Chen, Jia-Mei; Jiang, Long; Yao, Jia; Lu, Tong-Bu The Delivery of Triamterene by Cucurbit[7]uril: Synthesis, Structures and Pharmacokinetics Study. Molecular pharmaceutics, 2013, 10, 4698-4705 |
1513100 | CIF | C54 H113 Cl2 N35 O43 | I 41/a | 40.8323; 40.8323; 23.3137 90; 90; 90 | 38870.4 | Ma, Wen-Juan; Chen, Jia-Mei; Jiang, Long; Yao, Jia; Lu, Tong-Bu The Delivery of Triamterene by Cucurbit[7]uril: Synthesis, Structures and Pharmacokinetics Study. Molecular pharmaceutics, 2013, 10, 4698-4705 |
1518213 | CIF | C28 H20 Au N S2 | I 41/a | 35.5669; 35.5669; 7.2973 90; 90; 90 | 9231.1 | Maity, Ayan; Sulicz, Amanda N.; Deligonul, Nihal; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G. Suzuki‒Miyaura coupling of arylboronic acids to gold(iii) Chem. Sci., 2015, 6, 981 |
1518453 | CIF | C32 H31 F3 N4 O6 | I 41/a | 28.1062; 28.1062; 14.709 90; 90; 90 | 11619.5 | Jiao, Wei-Hua; Chen, Guo-Dong; Gao, Hao; Li, Jing; Gu, Bin-Bin; Xu, Ting-Ting; Yu, Hao-Bing; Shi, Guo-Hua; Yang, Fan; Yao, Xin-Sheng; Lin, Hou-Wen (±)-Quassidines I and J, Two Pairs of Cytotoxic Bis-β-carboline Alkaloid Enantiomers from Picrasma quassioides. Journal of natural products, 2015, 78, 125-130 |
1520712 | CIF | C80 H52 N24 O20 S4 Zn4 | I 41/a | 16.4641; 16.4641; 53.397 90; 90; 90 | 14474.1 | Giri, Chandan; Topić, Filip; Cametti, Massimo; Rissanen, Kari Mixed valence mono- and hetero-metallic grid catenanes Chem. Sci., 2015, 6, 5712 |
1533373 | CIF | C28 H42 Au Cl3 N4 O | I 41/a | 37.1846; 37.1846; 9.743 90; 90; 90 | 13471.6 | Ramsay, William J.; Foster, Jonathan A.; Moore, Katharine L.; Ronson, Tanya K.; Mirgalet, Raphaël J.; Jefferson, David A.; Nitschke, Jonathan R. AuICl-bound N-heterocyclic carbene ligands form MII4(LAuCl)6integrally gilded cages Chem. Sci., 2015, 6, 7326 |
1534395 | CIF | C99 H88 F6 N5 O7 P | I 41/a | 33.379; 33.379; 40.257 90; 90; 90 | 44853 | Wang, Han-Xiao; Meng, Zheng; Xiang, Jun-Feng; Xia, Yu-Xiang; Sun, Yihua; Hu, Shu-Zhen; Chen, Hui; Yao, Jiannian; Chen, Chuan-Feng Guest-dependent directional complexation based on triptycene derived oxacalixarene: formation of oriented rotaxanes Chem. Sci., 2016, 7, 469 |
1540715 | CIF | C44 H44 N4 O23 Sr2 | I 41/a | 28.4784; 28.4784; 13.6334 90; 90; 90 | 11057 | Garai, Bikash; Mallick, Arijit; Banerjee, Rahul Photochromic metal‒organic frameworks for inkless and erasable printing Chem. Sci., 2016, 7, 2195 |
1543328 | CIF | C40 H46 N2 S4 | I 41/a | 17.5664; 17.5664; 44.8654 90; 90; 90 | 13844.5 | Caffy, F.; Delbosc, N.; Chávez, P.; Lévêque, P.; Faure-Vincent, J.; Travers, J.-P.; Djurado, D.; Pécaut, J.; Grévin, B.; Lemaitre, N.; Leclerc, N.; Demadrille, R. Synthesis, optoelectronic properties and photovoltaic performances of wide band-gap copolymers based on dibenzosilole and quinoxaline units, rivals to P3HT Polym. Chem., 2016, 7, 4160 |
1543760 | CIF | C87 H101 Cl10 N5 Ni O Sb | I 41/a | 57.941; 57.941; 10.6631 90; 90; 90 | 35798 | Fukui, Norihito; Cha, Wonhee; Shimizu, Daiki; Oh, Juwon; Furukawa, Ko; Yorimitsu, Hideki; Kim, Dongho; Osuka, Atsuhiro Highly planar diarylamine-fused porphyrins and their remarkably stable radical cations. Chemical science, 2017, 8, 189-199 |
1544162 | CIF | C29 H34 N2 O6 S | I 41/a | 29.2891; 29.2891; 18.1917 90; 90; 90 | 15605.8 | Kong, A.; Mancheno, D. E.; Boudet, N.; Delgado, R.; Andreansky, E. S.; Blakey, S. B. Total synthesis of malagashanine: a chloroquine potentiating indole alkaloid with unusual stereochemistry. Chemical science, 2017, 8, 697-700 |
1544461 | CIF | Ce Li O8 W2 | I 41/a | 5.294; 5.294; 11.498 90; 90; 90 | 322.2 | Shimemura, T.; Sawaguchi, N.; Sasaki, M. Synthesis and emission properties of scheelite-type LiCe(WO4)2 Journal of the Ceramic Society of Japan, 2016, 124, 938-942 |
1544511 | CIF | C16 H20 Cl2 Ir N2 O2 | I 41/a | 16.9129; 16.9129; 25.3688 90; 90; 90 | 7256.6 | Shopov, Dimitar Y.; Rudshteyn, Benjamin; Campos, Jesús; Vinyard, David J.; Batista, Victor S.; Brudvig, Gary W.; Crabtree, Robert H. A full set of iridium(iv) pyridine-alkoxide stereoisomers: highly geometry-dependent redox properties. Chemical science, 2017, 8, 1642-1652 |
1546291 | CIF | Al0.024 Na0.015 O4 Si1.978 | I 41/a | 13.7002; 13.7002; 19.4438 90; 90; 90 | 3649.51 | Momma, K.; Ikeda, T.; Nishikubo, K.; Takahashi, N.; Honma, C.; Takada, M.; Furukawa, Y.; Nagase, T.; Kudoh, Y. New silica clathrate minerals that are isostructural with natural gas hydrates Nature Communications, 2011, 2, 1-7 |
1546350 | CIF | C43 H3 F20 N4 Ni O2 | I 41/a | 15.3093; 15.3093; 15.8346 90; 90; 90 | 3711.23 | Wu, Zhuo-Yan; Wang, Teng; Meng, Yin-Shan; Rao, Yu; Gao, Song; Zheng, Jie; Wang, Bing-Wu; Zhang, Jun-Long Enhancing the Reactivity of Nickel(II) in Hydrogen Evolution Reactions (HER) by β-Hydrogenation of Porphyrinoid Ligands Chem. Sci., 2017 |
1546388 | CIF | C14 H6 B2 F3 K2 N7 O | I 41/a | 25.5118; 25.5118; 12.1914 90; 90; 90 | 7934.8 | Landmann, Johannes; Hennig, Philipp T.; Ignat'ev, Nikolai; Finze, Maik Borylation of Fluorinated Arenes with the Boron-centred Nucleophile B(CN)32− ‒ a Unique Entry to Aryltricyanoborates Chem. Sci., 2017 |
1547691 | CIF | C41 O14 P4 | I 41/a | 24.905; 24.905; 7.5896 90; 90; 90 | 4707.5 | Tao Zheng; Zaixing Yang; Daxiang Gui; Zhiyong Liu; Xiangxiang Wang; Xing Dai; Shengtang Liu; Linjuan Zhang; Yang Gao; Lanhua Chen; Daopeng Sheng; Yanlong Wang; Juan Diwu; Jianqiang Wang; Ruhong Zhou; Zhifang Chai; Thomas E. Albrecht-Schmitt; Shuao Wanga Overcoming the crystallization and designability issues in the ultrastable zirconium phosphonate framework system Nature Communications, 2017, 8, 15369 |
1549090 | CIF | O4 Si Zr | I 41/a | 4.734; 4.734; 10.51 90; 90; 90 | 235.537 | Kusaba, K.; Yagi, T.; Kikuchi, M.; Syono, Y. Structural considerations on the mechanism of the shock-induced zircon-scheelite transition in ZrSiO4 Journal of Physics and Chemistry of Solids, 1986, 47, 675-679 |
1549091 | CIF | O4 Si Zr | I 41/a | 4.776; 4.776; 10.62 90; 90; 90 | 242.244 | Smirnov, M.B.; Sukhomlinov, S.V.; Smirnov, S. Vibrational specturm of reidite ZrSiO4 from first principles Physical Review B, 2010, 82, 094307-- |
1550132 | CIF | C11 H16 O | I 41/a | 22.7253; 22.7253; 7.5782 90; 90; 90 | 3913.68 | Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science, 2019 |
1550845 | CIF HKL Paper | C20 H34 N6 S2 | I 41/a | 16.8114; 16.8114; 17.8288 90; 90; 90 | 5038.8 | Gasque, Laura; Zermeño, Edgar; Bernès, Sylvain 2,8-Dimethyl-5,11-bis[3-(methylsulfanyl)propyl]-1<i>H</i>,7<i>H</i>-diimidazo[<i>c</i>,<i>h</i>][1,6]diazecine IUCrData, 2019, 4, x190441 |
1551102 | CIF | C85 H126 N17 O17 P | I 41/a | 35.9168; 35.9168; 32.8056 90; 90; 90 | 42320 | Fan, Xiaoxia; Zhang, Dan; Jiang, Shiyu; Wang, Heng; Lin, Lin-Ting; Zheng, Bo; Xu, Wen-Hua; Zhao, Yanxia; Hay, Benjamin P.; Chan, Yi-Tsu; Yang, Xiao-Juan; Li, Xiaopeng; Wu, Biao Construction and interconversion of anion-coordination-based (‘aniono’) grids and double helicates modulated by counter-cations Chemical Science, 2019 |
2000801 | CIF Paper | As Ca2 O12 W2 Y | I 41/a | 5.135; 5.135; 33.882 90; 90; 90 | 893.4 | Demartin, F.; Gramaccioli, C. M.; Pilati, T. Structure of a new natural tungstate arsenate, [Ca~2~Y(AsO~4~)(WO~4~)~2~], structurally related to scheelite Acta Crystallographica Section C, 1992, 48, 1357-1359 |
2000906 | CIF Paper | C20 H16 Br2 N2 | I 41/a | 14.696; 14.696; 15.853 90; 90; 90 | 3423.8 | Mori, Y.; Matsuyama, Y.; Yamada, S.; Maeda, K. Structures of 2,2'-polymethylene-1,1'-biisoquinolinium dibromides Acta Crystallographica Section C, 1992, 48, 894-897 |
2001359 | CIF Paper | C10 H10 S2 | I 41/a | 22.386; 22.386; 13.8834 90; 90; 90 | 6957.4 | Brett, W. A.; Rademacher, P.; Boese, R. Structure of 1,3,6,8-tetrahydrodithieno[3,4-<i>a</i>:3',4'-<i>c</i>]benzene Acta Crystallographica Section C, 1993, 49, 1566-1568 |
2001475 | CIF Paper | C30 H20 N6 | I 41/a | 27.699; 27.699; 6.169 90; 90; 90 | 4733.1 | Breu, J.; Range, K.-J. Structure of 5,5',6,6'-tetraphenyl-3,3'-bi-1,2,4-triazine Acta Crystallographica Section C, 1993, 49, 1541-1543 |
2001934 | CIF Paper | K O4 Re | I 41/a | 5.68174; 5.68174; 12.7118 90; 90; 90 | 410.36 | Brown, R. J. C.; Powell, B. M.; Stuart, S. N. Thermal effects in the structure of potassium perrhenate Acta Crystallographica Section C, 1993, 49, 214-216 |
2001935 | CIF Paper | K O4 Re | I 41/a | 5.66115; 5.66115; 12.611 90; 90; 90 | 404.165 | Brown, R. J. C.; Powell, B. M.; Stuart, S. N. Thermal effects in the structure of potassium perrhenate Acta Crystallographica Section C, 1993, 49, 214-216 |
2001936 | CIF Paper | K O4 Re | I 41/a | 5.65029; 5.65029; 12.5556 90; 90; 90 | 400.847 | Brown, R. J. C.; Powell, B. M.; Stuart, S. N. Thermal effects in the structure of potassium perrhenate Acta Crystallographica Section C, 1993, 49, 214-216 |
2005834 | CIF Paper | C12 H21 Cd N6 O6.5 | I 41/a | 13.791; 13.791; 20.313 90; 90; 90 | 3863.4 | Chotalia, R.; Hambley, T. W.; Ridley, D. D.; Turner, P. A Cadmium(II) Complex of Creatinine, [Cd(C~2~H~3~O~2~)~2~(C~4~H~7~N~3~O)~2~].0.5H~2~O Acta Crystallographica Section C, 1996, 52, 3043-3045 |
2009460 | CIF Paper | C7 H26 B18 Co N O2 | I 41/a | 23.971; 23.971; 14.398 90; 90; 90 | 8273.2 | Císařová, I.; Malý, K.; Hummel, L. Bridged bis(dicarbadodecaborane)cobalt(III) Acta Crystallographica Section C, 1994, 50, 198-200 |
2009848 | CIF Paper | C28 H16 F12 Sn | I 41/a | 17.3167; 17.3167; 8.8439 90; 90; 90 | 2652 | Smith, F.E.; Khoo, L.E.; Hynes, R.C.; Zhang, Y.Z.; Eng, G. Tetrakis[<i>m</i>-(trifluoromethyl)phenyl]tin(IV) Acta Crystallographica Section C, 1994, 50, 1046-1049 |
2009895 | CIF Paper | Cl5 H18 Ir N4 O3 Pt | I 41/a | 15.655; 15.655; 23.554 90; 90; 90 | 5772.6 | Garner, E.; Bele, M. Tetraammineplatinum(II) aquapentachloroiridate(III) dihydrate, [Pt(NH~3~)~4~][IrCl~5~(H~2~O)].2H~2~O Acta Crystallographica Section C, 1994, 50, 994-996 |
2009950 | CIF Paper | C15 H13 N O4 | I 41/a | 19.531; 19.531; 14.131 90; 90; 90 | 5390.4 | Chandra Mohan, K.; Ravikumar, K.; Vittal, T. V. S. K.; Gido, C. K. 2-(3-Benzyloxy-4-nitrophenyl)oxirane, an intermediate in the synthesis of formoterol Acta Crystallographica Section C, 1994, 50, 1294-1295 |
2019867 | CIF HKL Paper | C28 H56 Mn12 N8 O60 | I 41/a | 15.7293; 15.7293; 27.901 90; 90; 90 | 6903 | Thuijs, Annaliese E.; Christou, George; Abboud, Khalil A. [Mn~12~O~12~(O~2~CMe)~12~(NO~3~)~4~(H~2~O)~4~]: facile synthesis of a new type of Mn~12~ complex Acta Crystallographica Section C, 2015, 71 |
2020778 | CIF HKL Paper | C90 H68 Ca O29 Zn6 | I 41/a | 33.1506; 33.1506; 16.6829 90; 90; 90 | 18333.9 | Guo, Pei-Ying; Ma, De-Yun; Guo, Hai-Fu A twofold interpenetrating three-dimensional heterometallic metal‒organic framework with pcu topology based on 2-methylbiphenyl-4,4'-dicarboxylic acid Acta Crystallographica Section C, 2017, 73, 470-475 |
2020785 | CIF HKL | C13 H13 Cl2 N5 O2 | I 41/a | 19.513; 19.513; 17.613 90; 90; 90 | 6706 | Freire, Eleonora; Echeverría, Gustavo A.; Baggio, Ricardo Lamotriginium crotonate and lamotriginium salicylate ethanol monosolvate: the role of solvent molecules in the packing organization Acta Crystallographica Section C, 2017, 73, 563-568 |
2100785 | CIF Paper | C12 H8 O4 | I 41/a | 22.086; 22.086; 9.463 90; 90; 90 | 4616 | Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E. 1,2-Naphthalenedicarboxylic acid: structures of channel clathrates and an unsolvated crystalline phase Acta Crystallographica Section B, 1992, 48, 290-297 |
2240411 | CIF HKL Paper | C14 H10 Cr N3 O8 | I 41/a | 7.0305; 7.0305; 28.995 90; 90; 90 | 1433.2 | Moon, Dohyun; Choi, Jong-Ha Crystal structure of ammonium bis(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')chromate(III) from synchrotron data Acta Crystallographica Section E, 2015, 71, 210-212 |
2241108 | CIF HKL | C25 H32 N4 O8 | I 41/a | 14.4474; 14.4474; 12.2965 90; 90; 90 | 2566.62 | Matsumoto, Kouzou; Kawashita, Kazuaki; Kannami, Masaki; Oda, Masaji Crystal structure of tetrakis(1-oxidopyridin-2-yl)methane methanol tetrasolvate Acta Crystallographica Section E, 2015, 71, o754-o755 |
2241522 | CIF HKL | C20 H18 N4 O4 | I 41/a | 10.2295; 10.2295; 36.281 90; 90; 90 | 3796.5 | Alfonso, Montserrat; Stoeckli-Evans, Helen Dimethyl and diethyl esters of 5,6-bis(pyridin-2-yl)pyrazine-2,3-dicarboxylic acid: a comparison Acta Crystallographica Section E, 2016, 72, 233-237 |
2241749 | CIF HKL Paper | C12 H22 Br4 Cd N4 | I 41/a | 14.691; 14.691; 20.075 90; 90; 90 | 4332.7 | Dordević, Tamara; Gerger, Sabrina; Karanović, Ljiljana Crystal structure of the tetragonal polymorph of bis(1-ethyl-3-methylimidazolium) tetrabromidocadmate Acta Crystallographica Section E, 2016, 72, 1013-1016 |
2242256 | CIF HKL Paper | Na O4 Tc | I 41/a | 5.2945; 5.2945; 11.747 90; 90; 90 | 329.29 | German, Konstantin E.; Grigoriev, Mikhail S.; Garashchenko, Bogdan L.; Kopytin, Alexander V.; Tyupina, Ekaterina A. Redetermination of the crystal structure of NaTcO~4~ at 100 and 296K based on single-crystal X-ray data Acta Crystallographica Section E, 2017, 73, 1037-1040 |
2242338 | CIF HKL Paper | C26 H14 Cl6 O5 | I 41/a | 41.432; 41.432; 7.7844 90; 90; 90 | 13362.8 | Wang, Lili; Filatov, Alexander S.; Engel, Gregory S. Crystal structure of 4'-allyl-4,5,6,7,2',7'-hexachlorofluorescein allyl ester unknown solvate Acta Crystallographica Section E, 2018, 74, 83-87 |
2242884 | CIF HKL | C19 H15 Cl6 N O4 | I 41/a | 29.625; 29.625; 10.2427 90; 90; 90 | 8989.4 | Manohar, R.; Harikrishna, M.; Etti, S. Harikrishna; Ramanathan, C.; Gunasekaran, K. Crystal structure of 4,5,6,7,8,8-hexachloro-2-(3,4-dimethoxyphenethyl)-3a,4,7,7a-tetrahydro-1<i>H</i>-4,7-methanoisoindole-1,3(2<i>H</i>)-dione [+solvent] Acta Crystallographica Section E, 2019, 75, 562-564 |
2242949 | CIF HKL Paper | C16 H15 Cl N2 O3 | I 41/a | 15.314; 15.314; 25.736 90; 90; 90 | 6036 | Narasimhamurthy, Kereyagalahally H.; Chandra; Sagar, Belakavadi K.; Rangappa, Kanchugarakoppal S.; Yathirajan, Hemmige S.; Glidewell, Christopher The crystal structure of (<i>RS</i>)-7-chloro-2-(2,5-dimethoxyphenyl)-2,3-dihydroquinazolin-4(1<i>H</i>)-one: two hydrogen bonds generate an elegant three-dimensional framework structure Acta Crystallographica Section E, 2019, 75, 843-847 |
4033044 | CIF | C65 H41 N5 | I 41/a | 18.263; 18.263; 61.044 90; 90; 90 | 20360 | Huang, Fu; Wang, Guangxia; Ma, Lishuang; Wang, Ying; Chen, Xuebo; Che, Yanke; Jiang, Hua Molecular Spur Gears Based on a Switchable Quinquepyridine Foldamer Acting as a Stator. The Journal of organic chemistry, 2017, 82, 12106-12111 |
4062540 | CIF | C31 H40 O Ti | I 41/a | 31.5859; 31.5859; 10.8055 90; 90; 90 | 10780.3 | Fenwick, Andrew E.; Phomphrai, Khamphee; Thorn, Matthew G.; Vilardo, Jonathan S.; Trefun, Christine A.; Hanna, Brigitte; Fanwick, Phillip E.; Rothwell, Ian P. Formation of Neutral and Cationic Methyl Derivatives of Titanium Containing Cyclopentadienyl and Aryloxide Ancillary Ligation Organometallics, 2004, 23, 2146-2156 |
4081168 | CIF | C9 H18 Li N | I 41/a | 17.806; 17.806; 12.312 90; 90; 90 | 3903.6 | Zhang, Shaoguang; Zhan, Ming; Zhang, Wen-Xiong; Xi, Zhenfeng 3-D Brick-Wall Polymeric Structure of TMEDA-Supported 1,4-Dilithio-1,3-Butadiene Organometallics, 2013, 32, 4020 |
4085623 | CIF | C37 H28 Cl2 N5 P Ru | I 41/a | 32.3373; 32.3373; 15.1351 90; 90; 90 | 15826.8 | Li, Ke; Niu, Jun-Long; Yang, Ming-Ze; Li, Zhen; Wu, Li-Yuan; Hao, Xin-Qi; Song, Mao-Ping New Type of 2,6-Bis(imidazo[1,2-a]pyridin-2-yl)pyridine-Based Ruthenium Complexes: Active Catalysts for Transfer Hydrogenation of Ketones Organometallics, 2015, 34, 1170 |
4086725 | CIF | C25 H40 Cl Ir N4 | I 41/a | 25.892; 25.892; 27.666 90; 90; 90 | 18547 | Gomez-Lopez, Jessica L.; Chávez, Daniel; Parra-Hake, Miguel; Royappa, Arun T.; Rheingold, Arnold L.; Grotjahn, Douglas B.; Miranda-Soto, Valentín Synthesis and Reactivity of Bis(protic N-heterocyclic carbene)iridium(III) Complexes Organometallics, 2016, 35, 3148 |
4120333 | CIF HKL | C9 H17 Li O | I 41/a | 18.8947; 18.8947; 10.2755 90; 90; 90 | 3668.5 | Chicheung Su; Russell Hopson; Paul G. Williard Characterization of Cyclopentyllithium and Cyclopentyllithium Tetrahydrofuran Complex Journal of the American Chemical Society, 2013, 135, 12400-12406 |
4124358 | CIF | C28 H29 N3 O Pd | I 41/a | 27.9607; 27.9607; 12.0343 90; 90; 90 | 9408.4 | Nakano, Ryo; Nozaki, Kyoko Copolymerization of Propylene and Polar Monomers Using Pd/IzQO Catalysts. Journal of the American Chemical Society, 2015, 137, 10934-10937 |
4125535 | CIF | C148 H136 Cl12 | I 41/a | 18.9935; 18.9935; 50.612 90; 90; 90 | 18258.4 | Moneypenny, 2nd, Timothy P; Walter, Nathan P.; Cai, Zhikun; Miao, Yu-Run; Gray, Danielle L.; Hinman, Jordan J.; Lee, Semin; Zhang, Yang; Moore, Jeffrey S. Impact of Shape Persistence on the Porosity of Molecular Cages. Journal of the American Chemical Society, 2017, 139, 3259-3264 |
4125993 | CIF | C48 H48 B F10 N O3 S Zr | I 41/a | 25.3643; 25.3643; 33.4936 90; 90; 90 | 21548 | Jian, Zhongbao; Kehr, Gerald; Daniliuc, Constantin G.; Wibbeling, Birgit; Wiegand, Thomas; Siedow, Melanie; Eckert, Hellmut; Bursch, Markus; Grimme, Stefan; Erker, Gerhard CO-Reduction Chemistry: Reaction of a CO-Derived Formylhydridoborate with Carbon Monoxide, with Carbon Dioxide, and with Dihydrogen. Journal of the American Chemical Society, 2017 |
4126028 | CIF | C66 H0 Hf3 O18 | I 41/a | 33.087; 33.087; 21.564 90; 90; 90 | 23607 | Cao, Lingyun; Lin, Zekai; Shi, Wenjie; Wang, Zi; Zhang, Cankun; Hu, Xuefu; Wang, Cheng; Lin, Wenbin Exciton Migration and Amplified Quenching on Two-Dimensional Metal-Organic Layers. Journal of the American Chemical Society, 2017, 139, 7020-7029 |
4126308 | CIF | C260 H180 As8 F48 Fe4 N28 | I 41/a | 24.8124; 24.8124; 47.889 90; 90; 90 | 29483.1 | Ronson, Tanya K.; Meng, Wenjing; Nitschke, Jonathan R. Design Principles for the Optimization of Guest Binding in Aromatic-Paneled Fe(II)4L6 Cages. Journal of the American Chemical Society, 2017, 139, 9698-9707 |
4126900 | CIF | C44 H22 N4 O8 | I 41/a | 15.469; 15.469; 34.551 90; 90; 90 | 8267.7 | Wu, Yilei; Han, Ji-Min; Hong, Michael; Krzyaniak, Matthew D.; Blackburn, Anthea K.; Fernando, Isurika R.; Cao, Dennis D.; Wasielewski, Michael R.; Stoddart, J. Fraser X-Shaped Oligomeric Pyromellitimide Polyradicals. Journal of the American Chemical Society, 2017 |
4127017 | CIF | C76 H108 Ag14 B60 N8 S12 | I 41/a | 27.1757; 27.1757; 26.6358 90; 90; 90 | 19671 | Wang, Zhao-Yang; Wang, Meng-Qi; Li, Yan-Ling; Luo, Peng; Jia, Tong-Tong; Huang, Ren-Wu; Zang, Shuang-Quan; Mak, Thomas C. W. Atomically Precise Site-Specific Tailoring and Directional Assembly of Superatomic Silver Nanoclusters. Journal of the American Chemical Society, 2018 |
4127162 | CIF | C6 H5 Br0.36 Cl0.64 O2 | I 41/a | 19.067; 19.067; 6.882 90; 90; 90 | 2502 | Paul, Mithun; Chakraborty, Shaunak; Desiraju, Gautam R. Six-component Molecular Solids, ABC[D1-(x+y)ExFy]2. Journal of the American Chemical Society, 2018 |
4127163 | CIF | C6.19 H5 Br0.81 O2 | I 41/a | 19.231; 19.231; 6.9229 90; 90; 90 | 2560.3 | Paul, Mithun; Chakraborty, Shaunak; Desiraju, Gautam R. Six-component Molecular Solids, ABC[D1-(x+y)ExFy]2. Journal of the American Chemical Society, 2018 |
4127165 | CIF | C6.24 H5 Br0.32 Cl0.44 O2 | I 41/a | 19.153; 19.153; 6.9155 90; 90; 90 | 2536.9 | Paul, Mithun; Chakraborty, Shaunak; Desiraju, Gautam R. Six-component Molecular Solids, ABC[D1-(x+y)ExFy]2. Journal of the American Chemical Society, 2018 |
4325351 | CIF | C12 H22 Cl4 N4 Zn | I 41/a | 14.0059; 14.0059; 19.138 90; 90; 90 | 3754.21 | Julien Estager; Peter Nockemann; Kenneth R. Seddon; Małgorzata Swadźba-Kwaśny; Sophie Tyrrell Validation of Speciation Techniques: A Study of Chlorozincate(II) Ionic Liquids Inorganic Chemistry, 2011, 50, 5258-5271 |
4330564 | CIF | C26.18 H33.35 Cl2.35 N5 P Rh | I 41/a | 31.8629; 31.8629; 10.9579 90; 90; 90 | 11124.9 | Sarath Wanniarachchi; Brendan J. Liddle; Brandon Kizer; Jeewantha S. Hewage; Sergey V. Lindeman; James R. Gardinier Syntheses and Electronic Properties of Rhodium(III) Complexes Bearing a Redox-Active Ligand Inorganic Chemistry, 2012, 51, 10572-10580 |
4338511 | CIF | F5 Li U | I 41/a | 14.8467; 14.8467; 6.5168 90; 90; 90 | 1436.46 | Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; Zur Loye, Hans-Conrad Mild Hydrothermal Crystal Growth, Structure, and Magnetic Properties of Ternary U(IV) Containing Fluorides: LiUF5, KU2F9, K7U6F31, RbUF5, RbU2F9, and RbU3F13. Inorganic chemistry, 2014, 53, 6289-6298 |
4340859 | CIF | C11.96 H31.98 B11 I0.02 N O2 | I 41/a | 17.3207; 17.3207; 26.9149 90; 90; 90 | 8074.6 | Hailmann, Michael; Konieczka, Szymon Z.; Himmelspach, Alexander; Löblein, Jochen; Reiss, Guido J.; Finze, Maik Carba-closo-dodecaborate Anions with Two Functional Groups: [1-R-12-HC≡C-closo-1-CB11H10](-) (R = CN, NC, CO2H, C(O)NH2, NHC(O)H). Inorganic chemistry, 2014, 53, 9385-9399 |
4341851 | CIF | C17 H8 Co F6 O4 | I 41/a | 28.3446; 28.3446; 10.5434 90; 90; 90 | 8470.7 | Bernini, María Celeste; de Paz, Julio Romero; Snejko, Natalia; Sáez-Puche, Regino; Gutierrez-Puebla, Enrique; Monge, María Ángeles Unusual Magnetic Behaviors and Electronic Configurations Driven by Diverse Co(II) or Mn(II) MOF Architectures. Inorganic chemistry, 2014, 141204082337009 |
4341854 | CIF | C34 H16 F12 Mn2 O8 | I 41/a | 28.5047; 28.5047; 10.5027 90; 90; 90 | 8533.6 | Bernini, María Celeste; de Paz, Julio Romero; Snejko, Natalia; Sáez-Puche, Regino; Gutierrez-Puebla, Enrique; Monge, María Ángeles Unusual Magnetic Behaviors and Electronic Configurations Driven by Diverse Co(II) or Mn(II) MOF Architectures. Inorganic chemistry, 2014, 141204082337009 |
4343097 | CIF | C72 H136 In8 N16 Se38 Sn8 | I 41/a | 19.5931; 19.5931; 37.8365 90; 90; 90 | 14525 | Du, Cheng-Feng; Li, Jian-Rong; Zhang, Bo; Shen, Nan-Nan; Huang, Xiao-Ying From T2,2@Bmmim to Alkali@T2,2@Bmmim Ivory Ball-like Clusters: Ionothermal Syntheses, Precise Doping, and Photocatalytic Properties. Inorganic chemistry, 2015, 54, 5874-5878 |
4343098 | CIF | C72 H136 Cs In9 N16 Se38 Sn7 | I 41/a | 19.6437; 19.6437; 37.7046 90; 90; 90 | 14549.3 | Du, Cheng-Feng; Li, Jian-Rong; Zhang, Bo; Shen, Nan-Nan; Huang, Xiao-Ying From T2,2@Bmmim to Alkali@T2,2@Bmmim Ivory Ball-like Clusters: Ionothermal Syntheses, Precise Doping, and Photocatalytic Properties. Inorganic chemistry, 2015, 54, 5874-5878 |
4343099 | CIF | C72 H136 In9 N16 Rb Se38 Sn7 | I 41/a | 19.6218; 19.6218; 37.6897 90; 90; 90 | 14511.1 | Du, Cheng-Feng; Li, Jian-Rong; Zhang, Bo; Shen, Nan-Nan; Huang, Xiao-Ying From T2,2@Bmmim to Alkali@T2,2@Bmmim Ivory Ball-like Clusters: Ionothermal Syntheses, Precise Doping, and Photocatalytic Properties. Inorganic chemistry, 2015, 54, 5874-5878 |
4343261 | CIF | Mn3 O8 Ta2 | I 41/a | 11.2133; 11.2133; 9.7723 90; 90; 90 | 1228.75 | Rickert, Karl; Pozzi, Eric A.; Khanal, Rabi; Onoue, Masatoshi; Trimarchi, Giancarlo; Medvedeva, Julia E.; Hersam, Mark C.; Van Duyne, Richard P.; Poeppelmeier, Kenneth R. Selective Crystal Growth and Structural, Optical, and Electronic Studies of Mn3Ta2O8. Inorganic chemistry, 2015, 54, 6513-6519 |
4343363 | CIF | C24 H31 Br3 Cu3 N5 P2 | I 41/a | 29.959; 29.959; 14.054 90; 90; 90 | 12614 | Siddiqui, Mujahuddin M.; Mague, Joel T.; Balakrishna, Maravanji S. Diamondoid-Type Copper Coordination Polymers Containing Soft Cyclodiphosphazane Ligands. Inorganic chemistry, 2015, 54, 6063-6065 |
4343365 | CIF | C25 H30 Cl2 Cu2 I2 N2 P2 | I 41/a | 15.592; 15.592; 26.068 90; 90; 90 | 6337 | Siddiqui, Mujahuddin M.; Mague, Joel T.; Balakrishna, Maravanji S. Diamondoid-Type Copper Coordination Polymers Containing Soft Cyclodiphosphazane Ligands. Inorganic chemistry, 2015, 54, 6063-6065 |
4345135 | CIF | C22 H28 Cl N3 Os | I 41/a | 28.7379; 28.7379; 10.0804 90; 90; 90 | 8325.1 | Riedl, Christoph A.; Flocke, Lea S.; Hejl, Michaela; Roller, Alexander; Klose, Matthias H. M.; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K. Introducing the 4-Phenyl-1,2,3-Triazole Moiety as a Versatile Scaffold for the Development of Cytotoxic Ruthenium(II) and Osmium(II) Arene Cyclometalates. Inorganic chemistry, 2017, 56, 528-541 |
4345136 | CIF | C21 H26 Cl N3 Os | I 41/a | 28.1686; 28.1686; 10.1755 90; 90; 90 | 8074 | Riedl, Christoph A.; Flocke, Lea S.; Hejl, Michaela; Roller, Alexander; Klose, Matthias H. M.; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K. Introducing the 4-Phenyl-1,2,3-Triazole Moiety as a Versatile Scaffold for the Development of Cytotoxic Ruthenium(II) and Osmium(II) Arene Cyclometalates. Inorganic chemistry, 2017, 56, 528-541 |
4345141 | CIF | C22 H28 Cl N3 Ru | I 41/a | 28.6971; 28.6971; 10.0994 90; 90; 90 | 8317.1 | Riedl, Christoph A.; Flocke, Lea S.; Hejl, Michaela; Roller, Alexander; Klose, Matthias H. M.; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K. Introducing the 4-Phenyl-1,2,3-Triazole Moiety as a Versatile Scaffold for the Development of Cytotoxic Ruthenium(II) and Osmium(II) Arene Cyclometalates. Inorganic chemistry, 2017, 56, 528-541 |
4345142 | CIF | C21 H26 Cl N3 Ru | I 41/a | 28.0525; 28.0525; 10.1626 90; 90; 90 | 7997.4 | Riedl, Christoph A.; Flocke, Lea S.; Hejl, Michaela; Roller, Alexander; Klose, Matthias H. M.; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K. Introducing the 4-Phenyl-1,2,3-Triazole Moiety as a Versatile Scaffold for the Development of Cytotoxic Ruthenium(II) and Osmium(II) Arene Cyclometalates. Inorganic chemistry, 2017, 56, 528-541 |
4345420 | CIF | C24 H34 Na2 O18 U2 | I 41/a | 18.0521; 18.0521; 19.4747 90; 90; 90 | 6346.4 | Thuéry, Pierre; Harrowfield, Jack Coordination Polymers and Cage-Containing Frameworks in Uranyl Ion Complexes with rac- and (1R,2R)-trans-1,2-Cyclohexanedicarboxylates: Consequences of Chirality. Inorganic chemistry, 2017, 56, 1455-1469 |
4345421 | CIF | C24 H34 Ag2 O18 U2 | I 41/a | 18.1546; 18.1546; 19.5356 90; 90; 90 | 6438.7 | Thuéry, Pierre; Harrowfield, Jack Coordination Polymers and Cage-Containing Frameworks in Uranyl Ion Complexes with rac- and (1R,2R)-trans-1,2-Cyclohexanedicarboxylates: Consequences of Chirality. Inorganic chemistry, 2017, 56, 1455-1469 |
4507507 | CIF | C48 H50 Co La2 N8 O29 | I 41/a | 46.038; 46.038; 11.3254 90; 90; 90 | 24004 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507508 | CIF | C48 H52 Co N8 O30 Pr2 | I 41/a | 45.942; 45.942; 11.2367 90; 90; 90 | 23716.9 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507509 | CIF | C48 H50 Co N8 Nd2 O29 | I 41/a | 45.7979; 45.7979; 11.2276 90; 90; 90 | 23549.3 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507510 | CIF | C48 H50 Co N8 O29 Sm2 | I 41/a | 45.9697; 45.9697; 11.1834 90; 90; 90 | 23632.9 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507511 | CIF | C48 H50 Co Eu2 N8 O29 | I 41/a | 45.8777; 45.8777; 11.10616 90; 90; 90 | 23375.8 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507512 | CIF | C48 H46 Co Gd2 N8 O27 | I 41/a | 45.204; 45.204; 10.7836 90; 90; 90 | 22035.2 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507513 | CIF | C48 H48 Co N8 O28 Tb2 | I 41/a | 45.822; 45.822; 11.0046 90; 90; 90 | 23105.9 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4507514 | CIF | C48 H48 Co Dy2 N8 O29 | I 41/a | 45.87; 45.87; 10.998 90; 90; 90 | 23140 | Zhou, Jing-Min; Shi, Wei; Xu, Na; Cheng, Peng A New Family of 4f-3d Heterometallic Metal‒Organic Frameworks with 2,2′-Bipyridine-3,3′-dicarboxylic Acid: Syntheses, Structures and Magnetic Properties Crystal Growth & Design, 2013, 13, 1218 |
4512583 | CIF | C21 H26 O5 | I 41/a | 22.3255; 22.3255; 14.2555 90; 90; 90 | 7105.3 | Martin, Mackenzie D.; Calcul, Laurent; Smith, Courtney; Jinwal, Umesh K.; Fontaine, Sarah N.; Darling, April; Seeley, Kent; Wojtas, Lukasz; Narayan, Malathi; Gestwicki, Jason E.; Smith, Garry R.; Reitz, Allen B.; Baker, Bill J.; Dickey, Chad A. Synthesis, stereochemical analysis, and derivatization of myricanol provide new probes that promote autophagic tau clearance. ACS chemical biology, 2015, 10, 1099-1109 |
4513232 | CIF | C52 H32 Ag2 N6 O6 Si | I 41/a | 17.0103; 17.0103; 77.059 90; 90; 90 | 22297 | Geyer, Florian L.; Rominger, Frank; Vogtland, Maximilian; Bunz, Uwe H. F. Interpenetrated Frameworks with Anisotropic Pore Structures from a Tetrahedral Pyridine Ligand Crystal Growth & Design, 2015, 15, 3539 |
4513236 | CIF | C56 H32 N4 Si | I 41/a | 26.518; 26.518; 6.3122 90; 90; 90 | 4439 | Geyer, Florian L.; Rominger, Frank; Vogtland, Maximilian; Bunz, Uwe H. F. Interpenetrated Frameworks with Anisotropic Pore Structures from a Tetrahedral Pyridine Ligand Crystal Growth & Design, 2015, 15, 3539 |
4513238 | CIF | C44 H52 Si5 | I 41/a | 14.5595; 14.5595; 22.373 90; 90; 90 | 4742.6 | Geyer, Florian L.; Rominger, Frank; Vogtland, Maximilian; Bunz, Uwe H. F. Interpenetrated Frameworks with Anisotropic Pore Structures from a Tetrahedral Pyridine Ligand Crystal Growth & Design, 2015, 15, 3539 |
4514017 | CIF | C35 H54 Cl2 Cu2 N10 | I 41/a | 20.4817; 20.4817; 21.6349 90; 90; 90 | 9075.8 | Trose, Michael; Lazreg, Faïma; Chang, Tao; Nahra, Fady; Cordes, David B.; Slawin, Alexandra M. Z.; Cazin, Catherine S. J. Neutral Dinuclear Copper(I)-NHC Complexes: Synthesis and Application in the Hydrosilylation of Ketones ACS Catalysis, 2017, 7, 238 |
4514410 | CIF | C200 H204 Ag22 Cl4 P8 S12 | I 41/a | 19.4007; 19.4007; 57.9021 90; 90; 90 | 21793.6 | Khatun, Esma; Bodiuzzaman, Mohammad; Sugi, Korath Shivan; Chakraborty, Papri; Paramasivam, Ganesan; Dar, Wakeel Ahmed; Ahuja, Tripti; Antharjanam, Sudhadevi; Pradeep, Thalappil Confining an Ag<sub>10</sub> Core in an Ag<sub>12</sub> Shell: A Four-Electron Superatom with Enhanced Photoluminescence upon Crystallization. ACS nano, 2019 |
6000090 | CIF | Cd Cu2 S8 Sn3 | I 41/a | 7.3827; 7.3827; 10.4152 90; 90; 90 | 567.67 | Chykhrij, S. I.; Sysa, L. V.; Parasyuk, O. V.; Piskach, L. V. Crystal structure of the Cu2CdSn3S8 compound Journal of Alloys and Compounds, 2000, 307, 124-126 |
6000163 | CIF | O24 Re4 Sr11 | I 41/a | 11.6779; 11.6779; 16.1488 90; 90; 90 | 2202.27 | Bramnik, K. G.; Miehe, G.; Ehrenberg, H.; Fuess, H.; Abakumov, A. M.; Shpanchenko, R. V.; Pomjakushin, V. Y.; Balagurov, A. M. Preparation, structure, and magnetic studies of a new Sr11Re4O24 double oxide Journal of Solid State Chemistry, 2000, 149, 49-55 |
6000270 | CIF | Mn3 O8 Ta2 | I 41/a | 11.2728; 11.2728; 9.803 90; 90; 90 | 1245.73 | Grins, J.; Esmaeilzadeh, S.; Berastegui, P.; Eriksson, S. Determination of the magnetic structure at 10 k of Mn3Ta2O8, and refinement of the crystal structure at 295 K, using neutron powder diffraction data Journal of Materials Chemistry, 1999, 9, 1575-1578 |
6000388 | CIF | Mn3 O8 Ta2 | I 41/a | 11.2728; 11.2728; 9.803 90; 90; 90 | 1245.73 | Esmaeilzadeh, S.; Grins, J.; Fitch, A. Determination of the fluorite related structure of Mn3Ta2O8, using synchrotron X-ray powder and electron diffraction data Journal of Materials Chemistry, 1998, 8, 2493-2497 |
6000759 | CIF | C4 H8 K O12 Y | I 41/a | 11.4612; 11.4612; 8.904 90; 90; 90 | 1169.62 | Bataille, T.; Auffrédic, J. P.; Louër, D. A powder diffraction study of the crystal structure and the dehydration process of yttrium potassium oxalate tetrahydrate Materials Science Forum, 2000, 321, 976-981 |
7019330 | CIF | C120.75 H104.75 Cd2 Fe2 N13 O23 | I 41/a | 18.967; 18.967; 61.245 90; 90; 90 | 22033 | Smythe, Nathan C.; Butler, Derek P.; Moore, Curtis E.; McGowan, William R.; Rheingold, Arnold L.; Beauvais, Laurance G. A heterobimetallic metal-organic framework with tunable reactive metal sites: synthesis, characterization, and reactivity. Dalton transactions (Cambridge, England : 2003), 2012, 41, 7855-7858 |
7020208 | CIF | C5 H12 Cl4 S2 Te | I 41/a | 9.881; 9.881; 26.388 90; 90; 90 | 2576.4 | Hector, Andrew L.; Jolleys, Andrew; Levason, William; Reid, Gillian TeX4 (X = F, Cl, Br) as Lewis acids‒complexes with soft thio- and seleno-ether ligands. Dalton transactions (Cambridge, England : 2003), 2012, 41, 10988-10999 |
7022602 | CIF | C45 H30 Cu3 N6 | I 41/a | 30.835; 30.835; 29.306 90; 90; 90 | 27864 | Grzywa, Maciej; Geßner, Christof; Denysenko, Dmytro; Bredenkötter, Björn; Gschwind, Fabienne; Fromm, Katharina M.; Nitek, Wojciech; Klemm, Elias; Volkmer, Dirk CFA-2 and CFA-3 (Coordination Framework Augsburg University-2 and -3); novel MOFs assembled from trinuclear Cu(I)/Ag(I) secondary building units and 3,3',5,5'-tetraphenyl-bipyrazolate ligands. Dalton transactions (Cambridge, England : 2003), 2013, 42, 6909-6921 |
7023552 | CIF | C92.62 H60.62 Cl1.85 N4 O4 Zn | I 41/a | 28.0259; 28.0259; 10.1867 90; 90; 90 | 8001.2 | Ishizuka, Tomoya; Sankar, Muniappan; Kojima, Takahiko Control of the spatial arrangements of supramolecular networks based on saddle-distorted porphyrins by intermolecular hydrogen bonding. Dalton transactions (Cambridge, England : 2003), 2013, 42, 16073-16079 |
7028318 | CIF | C104 H140 Cu4 Na4 O32 Si12 | I 41/a | 30.9472; 30.9472; 12.6009 90; 90; 90 | 12068.2 | Dronova, Marina S.; Bilyachenko, Alexey N.; Yalymov, Alexey I.; Kozlov, Yuriy N.; Shul'pina, Lidia S.; Korlyukov, Alexander A.; Arkhipov, Dmitry E.; Levitsky, Mikhail M.; Shubina, Elena S.; Shul'pin, Georgiy B. Solvent-controlled synthesis of tetranuclear cage-like copper(II) silsesquioxanes. Remarkable features of the cage structures and their high catalytic activity in oxidation with peroxides. Dalton transactions (Cambridge, England : 2003), 2014, 43, 872-882 |
7028389 | CIF | C16 H15 Ag F3 N3 O6 S | I 41/a | 25.9649; 25.9649; 11.8154 90; 90; 90 | 7965.7 | Sniekers, Jeroen; Brooks, Neil R.; Schaltin, Stijn; Van Meervelt, Luc; Fransaer, Jan; Binnemans, Koen High current density electrodeposition of silver from silver-containing liquid metal salts with pyridine-N-oxide ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 1589-1598 |
7029526 | CIF | C72 H88 N4 O2 Pt | I 41/a | 28.8481; 28.8481; 14.8117 90; 90; 90 | 12326.5 | Moiseev, A. G.; Margulies, E. A.; Schneider, J. A.; Bélanger-Gariépy, F; Perepichka, D. F. Protecting the triplet excited state in sterically congested platinum porphyrin. Dalton transactions (Cambridge, England : 2003), 2014, 43, 2676-2683 |
7030869 | CIF | C456 H538 Cl53 Fe10 N90 O256 Pr20 Sb60 | I 41/a | 59.122; 59.122; 39.2567 90; 90; 90 | 137218 | Zou, Guo-Dong; Wang, Ze-Ping; Song, Ying; Hu, Bing; Huang, Xiao-Ying Syntheses, structures and photocatalytic properties of five new praseodymium-antimony oxochlorides: from discrete clusters to 3D inorganic-organic hybrid racemic compounds. Dalton transactions (Cambridge, England : 2003), 2014, 43, 10064-10073 |
7031023 | CIF | C204 H252 Mn12 N24 O77 | I 41/a | 39.8049; 39.8049; 37.7169 90; 90; 90 | 59760 | Frost, J. M.; Sanz, S.; Rajeshkumar, T.; Pitak, M. B.; Coles, S. J.; Rajaraman, G.; Wernsdorfer, W.; Schnack, J.; Lusby, P. J.; Brechin, E. K. A truncated [Mn(III)12] tetrahedron from oxime-based [Mn(III)3O] building blocks. Dalton transactions (Cambridge, England : 2003), 2014, 43, 10690-10694 |
7035110 | CIF | C28 H38 Cu N4 O9 | I 41/a | 23.5927; 23.5927; 11.7356 90; 90; 90 | 6532.2 | Bryant, Macguire R.; Burrows, Andrew D.; Fitchett, Christopher M.; Hawes, Chris S.; Hunter, Sally O.; Keenan, Luke L.; Kelly, David J.; Kruger, Paul E.; Mahon, Mary F.; Richardson, Christopher The synthesis and characterisation of coordination and hydrogen-bonded networks based on 4-(3,5-dimethyl-1H-pyrazol-4-yl)benzoic acid. Dalton transactions (Cambridge, England : 2003), 2015, 44, 9269-9280 |
7035410 | CIF | C26 H20 N8 Os | I 41/a | 29.488; 29.488; 16.688 90; 90; 90 | 14511 | Das, Ankita; Mobin, Shaikh M.; Lahiri, Goutam Kumar Recognition of fractional non-innocent feature of osmium coordinated 2,2'-biimidazole or 2,2'-bis(4,5-dimethylimidazole) and their interactions with anions. Dalton transactions (Cambridge, England : 2003), 2015, 44, 13204-13219 |
7036751 | CIF | C20 H12 Co N10 O4 | I 41/a | 8.792; 8.792; 27.916 90; 90; 90 | 2157.9 | Miller, Reece G.; Narayanaswamy, Suresh; Clark, Simon M.; Dera, Przemslaw; Jameson, Geoffrey B.; Tallon, Jeffery L.; Brooker, Sally Pressure induced separation of phase-transition-triggered-abrupt vs. gradual components of spin crossover. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20843-20849 |
7036874 | CIF | C24.5 H17 Cl O12 S2 W2 | I 41/a | 26.7813; 26.7813; 17.3239 90; 90; 90 | 12425.4 | Lamprecht, Zandria; van Jaarsveld, Nina A.; Bezuidenhout, Daniela I.; Liles, David C.; Lotz, Simon Synthesis and properties of mono- and dimetal Fischer multicarbene complexes derived from thiophene and thieno[2,3-b]thiophene. Dalton transactions (Cambridge, England : 2003), 2015, 44, 19218-19231 |
7037538 | CIF | C216 H288 O108 Ti26 | I 41/a | 25.9224; 25.9224; 41.59 90; 90; 90 | 27947 | Hou, Jin-Le; Luo, Wen; Wu, Yin-Yin; Su, Hu-Chao; Zhang, Guang-Lin; Zhu, Qin-Yu; Dai, Jie Two Ti13-oxo-clusters showing non-compact structures, film electrode preparation and photocurrent properties. Dalton transactions (Cambridge, England : 2003), 2015, 44, 19829-19835 |
7037539 | CIF | C108 H140 Cl4 O54 Ti13 | I 41/a | 25.876; 25.876; 43.429 90; 90; 90 | 29079 | Hou, Jin-Le; Luo, Wen; Wu, Yin-Yin; Su, Hu-Chao; Zhang, Guang-Lin; Zhu, Qin-Yu; Dai, Jie Two Ti13-oxo-clusters showing non-compact structures, film electrode preparation and photocurrent properties. Dalton transactions (Cambridge, England : 2003), 2015, 44, 19829-19835 |
7039189 | CIF | C140 H108 Cl12 N8 O28 Ti10 | I 41/a | 29.1802; 29.1802; 16.145 90; 90; 90 | 13747.2 | Chaumont, Clément; Chaumont, Alain; Kyritsakas, Nathalie; Mobian, Pierre; Henry, Marc Titanium oxo-clusters derivatized from the Ti10O12(cat)8(py)8 complex: structural investigation and spectroscopic studies of light absorption. Dalton transactions (Cambridge, England : 2003), 2016, 45, 8760-8769 |
7039190 | CIF | C156 H124 Cl12 N8 O44 Ti10 | I 41/a | 31.272; 31.272; 15.6882 90; 90; 90 | 15342 | Chaumont, Clément; Chaumont, Alain; Kyritsakas, Nathalie; Mobian, Pierre; Henry, Marc Titanium oxo-clusters derivatized from the Ti10O12(cat)8(py)8 complex: structural investigation and spectroscopic studies of light absorption. Dalton transactions (Cambridge, England : 2003), 2016, 45, 8760-8769 |
7040284 | CIF | C310 H596 B12 Cl24 Fe60 N108 O174 | I 41/a | 42.8834; 42.8834; 83.8832 90; 90; 90 | 154260 | Jiménez, J-R; Mondal, A.; Chamoreau, L.-M.; Fertey, P.; Tuna, F.; Julve, M.; Bousseksou, A.; Lescouëzec, R; Lisnard, L. An {Fe60} tetrahedral cage: building nanoscopic molecular assemblies through cyanometallate and alkoxo linkers. Dalton transactions (Cambridge, England : 2003), 2016, 45, 17610-17615 |
7041021 | CIF | C56 H56 Fe2 N16 W | I 41/a | 20.549; 20.549; 13.464 90; 90; 90 | 5685.3 | Wei, Rong-Min; Kong, Ming; Cao, Fan; Li, Jing; Pu, Tian-Cheng; Yang, Li; Zhang, Xiu-Ling; Song, You Water induced spin-crossover behaviour and magneto-structural correlation in octacyanotungstate(iv)-based iron(ii) complexes. Dalton transactions (Cambridge, England : 2003), 2016, 45, 18643-18652 |
7041066 | CIF | C100 H144 Cu5 Mn10 N12 O60 | I 41/a | 27.5814; 27.5814; 18.4546 90; 90; 90 | 14039 | Frost, Jamie M.; Kettles, Fraser J.; Wilson, Claire; Murrie, Mark Rational serendipity: "undirected" synthesis of a large {MnCu} complex from pre-formed Mn(II) building blocks. Dalton transactions (Cambridge, England : 2003), 2016, 45, 18094-18097 |
7041069 | CIF | C60 H58 Ce N4 Na O2 | I 41/a | 28.2049; 28.2049; 26.1852 90; 90; 90 | 20830.8 | Armstrong, Keith C.; Hohloch, Stephan; Lohrey, Trevor D.; Zarkesh, Ryan A.; Arnold, John; Anstey, Mitchell R. Control of clustering behavior in anionic cerium(iii) corrole complexes: from oligomers to monomers. Dalton transactions (Cambridge, England : 2003), 2016, 45, 18653-18660 |
7042832 | CIF | C184 H168 Cl8 N48 O56 Zn4 | I 41/a | 24.8871; 24.8871; 34.3819 90; 90; 90 | 21295 | Barry, Dawn; Hawes, Chris Samuel; Byrne, Joseph Peter; la Cour Poulsen, Bjørn; Ruether, Manuel; O'Brien, John E; Gunnlaugsson, Thorfinnur A folded [2×2] metallo-supramolecular grid from a bis-tridentate (1,2,3-triazol-4-yl)-picolinamide (tzpa) ligand Dalton Trans., 2017 |
7042907 | CIF | C12 H16 Cl2 N4 O8 Zn | I 41/a | 14.9255; 14.9255; 15.314 90; 90; 90 | 3411.5 | Reddy, Andrew; Sangenito, Leandro Stefano; Guedes, Arthur de Azevedo; Branquinha, Marta Helena; Kavanagh, Kevin; McGinley, John; Dos Santos, André Luis Souza; Velasco-Torrijos, Trinidad Glycosylated metal chelators as anti-parasitic agents with tunable selectivity. Dalton transactions (Cambridge, England : 2003), 2017, 46, 5297-5307 |
7043038 | CIF | C36 H52 Ga N2 O2 P Si | I 41/a | 36.96; 36.96; 11.4658 90; 90; 90 | 15663 | Balmer, Markus; Kapitein, Manuel; von Hänisch, Carsten Improved reactivity of a cyclic 13/15 compound by increased steric demand Dalton Trans., 2017 |
7043140 | CIF | C84 H136 Ge4 N4 | I 41/a | 39.612; 39.612; 10.206 90; 90; 90 | 16014 | Roesky, Herbert W.; Kundu, Subrata; Samuel, Prinson P.; Luebben, Anna; Andrada, Diego Marcelo; Frenking, G.; Dittrich, Birger Carbene Stabilized Interconnected Bis-germylene and its Silicon Analogue with Small Methyl Substituents Dalton Trans., 2017 |
7043141 | CIF | C42 H68 N2 Si2 | I 41/a | 39.475; 39.475; 10.222 90; 90; 90 | 15929 | Roesky, Herbert W.; Kundu, Subrata; Samuel, Prinson P.; Luebben, Anna; Andrada, Diego Marcelo; Frenking, G.; Dittrich, Birger Carbene Stabilized Interconnected Bis-germylene and its Silicon Analogue with Small Methyl Substituents Dalton Trans., 2017 |
7043279 | CIF | C69.6 H60.5 Co2 N12 O48.25 Sb8 V14 | I 41/a | 19.81131; 19.81131; 56.5195 90; 90; 90 | 22183.2 | Cui, Xiaobing; guo, haiyang; Zhang, Xiao; xiao, lina An unprecedented antimonato-polyoxovanadate (SbPOVs) based on both α-[V14Sb8O42]4- and β-[V14Sb8O42]4- isomers Dalton Trans., 2017 |
7043280 | CIF | C69.6 H60.5 Co2 N12 O48.25 Sb8 V14 | I 41/a | 19.81131; 19.81131; 56.5195 90; 90; 90 | 22183.2 | Cui, Xiaobing; guo, haiyang; Zhang, Xiao; xiao, lina An unprecedented antimonato-polyoxovanadate (SbPOVs) based on both α-[V14Sb8O42]4- and β-[V14Sb8O42]4- isomers Dalton Trans., 2017 |
7043430 | CIF | C5 H12 Cl3 Nb S Se2 | I 41/a | 10.0061; 10.0061; 26.11 90; 90; 90 | 2614.19 | Chang, Yao-Pang; Hector, Andrew L.; Levason, William; Reid, Gillian Chalcogenoether complexes of Nb(V) thio- and seleno-halides as single source precursors for low pressure chemical vapour deposition of NbS2 and NbSe2 thin films Dalton Trans., 2017 |
7043946 | CIF | C40 H42 Cu2 Dy N9 O13 | I 41/a | 17.317; 17.317; 30.722 90; 90; 90 | 9213 | Mahapatra, Prithwish; Ghosh, Soumavo; Koizumi, Naoki; Kanetomo, Takuya; Ishida, Takayuki; Drew, Michael G.B; Ghosh, Ashutosh Structural Variations in (CuL)2Ln Complexes of a Series of Lanthanide Ions with Salen-Type Unsymmetrical Schiff Base(H2L): The Dy and Tb Derivatives as Potential Single-Molecule Magnets Dalton Trans., 2017 |
7043947 | CIF | C40 H42 Cu2 N9 O13 Tb | I 41/a | 17.351; 17.351; 30.46 90; 90; 90 | 9170 | Mahapatra, Prithwish; Ghosh, Soumavo; Koizumi, Naoki; Kanetomo, Takuya; Ishida, Takayuki; Drew, Michael G.B; Ghosh, Ashutosh Structural Variations in (CuL)2Ln Complexes of a Series of Lanthanide Ions with Salen-Type Unsymmetrical Schiff Base(H2L): The Dy and Tb Derivatives as Potential Single-Molecule Magnets Dalton Trans., 2017 |
7043948 | CIF | C40 H42 Cu2 Gd N9 O13 | I 41/a | 17.341; 17.341; 30.703 90; 90; 90 | 9233 | Mahapatra, Prithwish; Ghosh, Soumavo; Koizumi, Naoki; Kanetomo, Takuya; Ishida, Takayuki; Drew, Michael G.B; Ghosh, Ashutosh Structural Variations in (CuL)2Ln Complexes of a Series of Lanthanide Ions with Salen-Type Unsymmetrical Schiff Base(H2L): The Dy and Tb Derivatives as Potential Single-Molecule Magnets Dalton Trans., 2017 |
7044566 | CIF | C26 H20 Cl2 Cu N6 O9.5 | I 41/a | 20.7098; 20.7098; 27.0998 90; 90; 90 | 11623 | Sethuraman, Muthuramalingam; Khamrang, Themmila; Velusamy, Marappan; Ramasamy, Mayilmurugan Catalytic fixation of atmospheric carbon dioxide by copper(II) complexes of bidentate ligands Dalton Trans., 2017 |
7044650 | CIF | C26 H27 Cl2 Co N6 O10 | I 41/a | 11.8893; 11.8893; 42.742 90; 90; 90 | 6041.8 | Carmos dos Santos, Nadia Alessandra; Natali, Mirco; Badetti, Elena; Wurst, Klaus; Licini, Giulia; ZONTA, CRISTIANO Cobalt, nickel, and iron complexes of 8-hydroxyquinoline-di(2-picolyl)amine for light-driven hydrogen evolution Dalton Transactions, 2017 |
7045342 | CIF | C58 H32 F10 Ir2 N6 O2 | I 41/a | 32.9387; 32.9387; 8.6913 90; 90; 90 | 9429.7 | Congrave, Daniel G.; Hsu, Yu-Ting; Batsanov, Andrei S.; Beeby, Andrew; Bryce, Martin R. Sky-blue emitting bridged diiridium complexes: beneficial effects of intramolecular π‒π stacking Dalton Transactions, 2018 |
7045499 | CIF | C48 H112 Ga4 Mn6 N16 S20 Sn4 | I 41/a | 23.3697; 23.3697; 20.7308 90; 90; 90 | 11322 | Zhang, Yingying; Hu, Dandan; Xue, Chaozhuang; Yang, Huajun; Wang, Xiang; Wu, Tao A 3D Neutral Chalcogenide Framework Built from Supertetrahedral T3 Cluster and Metal Complex for Electrocatalytic Oxygen Reduction Reaction. Dalton Transactions, 2018 |
7046273 | CIF | C47 H77 B3 Mg N2 O6 | I 41/a | 37.2496; 37.2496; 14.5258 90; 90; 90 | 20155 | Hill, Michael; Mahon, Mary F.; Pecharman, Anne-Frederique Diborane Heterolysis: Breaking and Making B-B bonds at Magnesium Dalton Transactions, 2018 |
7046373 | CIF | C20 H60 Ga4 Mg4 O4 | I 41/a | 17.887; 17.887; 10.612 90; 90; 90 | 3395 | Stuhl, Christoph; Anwander, Reiner Dimethylmagnesium revisited Dalton Transactions, 2018 |
7047129 | CIF | C41 H36 N2 O7 P2 Pt S3 | I 41/a | 37.9658; 37.9658; 12.125 90; 90; 90 | 17477 | Icsel, Ceyda; Yilmaz, Veysel T.; Aygün, Muhittin; Cevatemre, Buse; Alper, Pinar; Ulukaya, Engin Palladium(II) and platinum(II) saccharinate complexes with bis(diphenylphosphino)methane/ethane: synthesis, S-phase arrest and ROS-mediated apoptosis in human colon cancer cells Dalton Transactions, 2018 |
7047591 | CIF | C53 H41 Cl Hg N4 | I 41/a | 41.823; 41.823; 9.8448 90; 90; 90 | 17220.2 | Tung, Jo-Yu; Chen, Yi-Chun; Liu, Ta-Kang; Tsai, Wei-Joe; Lin, Hsiang-Yin; Chen, Jyh-Horung; Chang, Yu-Chang The η1-H‒C…Hg agostic interactions in mercury complexes of N-confused porphyrin Dalton Transactions, 2018 |
7047593 | CIF | C53 H37 Hg I N4 O2 | I 41/a | 31.7147; 31.7147; 18.769 90; 90; 90 | 18878 | Tung, Jo-Yu; Chen, Yi-Chun; Liu, Ta-Kang; Tsai, Wei-Joe; Lin, Hsiang-Yin; Chen, Jyh-Horung; Chang, Yu-Chang The η1-H‒C…Hg agostic interactions in mercury complexes of N-confused porphyrin Dalton Transactions, 2018 |
7047646 | CIF | C12 H8 N2 O5 Pb2 | I 41/a | 22.4281; 22.4281; 11.1579 90; 90; 90 | 5612.6 | Zhai, Lu; Wu, Xiao-Shuo; Wang, Yi-Xiong; Li, Shan-Qing; Qian, Yin; Wang, Xiao-Zu; Ren, Xiaoming Metal ion coordination enhancing quantum efficiency of ligand phosphorescence in a double-stranded helical chain coordination polymer of Pb2+ with nicotinic acid Dalton Transactions, 2018 |
7048032 | CIF | C38 H34 Cu4 F12 N4 O11 | I 41/a | 12.52; 12.52; 35.8306 90; 90; 90 | 5616.5 | Das, Manisha; Canaj, Angelos; Bertolasi, Valerio; Murrie, Mark; Ray, Debashis Strategic Synthesis of [Cu2], [Cu4] and [Cu5] Complexes: Inhibition and Triggering of Ligand Arm Hydrolysis and Self-aggregation by Chosen Ancillary Bridges Dalton Transactions, 2018 |
7048354 | CIF | C46 H24 Br8 Cl4 Cu N4 | I 41/a | 20.6006; 20.6006; 10.102 90; 90; 90 | 4287.1 | Rueffer, Tobias; Al-Shewiki, Rasha; Korb, Marcus; Hildebrandt, Alexander; Zahn, Stefan; Naumov, Sergej; Buschbeck, Roy; Lang, Heinrich Diaqua-β-Octaferrocenyltetraphenylporphyrin: A Multiredox-active and Air-stable 16π Non-Aromat Dalton Transactions, 2018 |
7048582 | CIF | C54 H73 N O6 W | I 41/a | 27.3856; 27.3856; 26.848 90; 90; 90 | 20135.2 | Sun, Ziyue; Zhao, Yanxia; Prior, Timothy J.; Elsegood, Mark R. J.; Wang, Kuiyuan; Xing, Tian; Redshaw, Carl Mono-oxo molybdenum(vi) and tungsten(vi) complexes bearing chelating aryloxides: synthesis, structure and ring opening polymerization of cyclic esters Dalton Transactions, 2019 |
7048686 | CIF | C24 H45 I3 Mo N P2 | I 41/a | 23.5322; 23.5322; 21.991 90; 90; 90 | 12177.8 | Itabashi, Takayuki; Mori, Okki; Arashiba, Kazuya; Eizawa, Aya; Nakajima, Kazunari; Nishibayashi, Yoshiaki Effect of substituents on molybdenum triiodide complexes bearing PNP-type pincer ligands toward catalytic nitrogen fixation Dalton Transactions, 2019 |
7048691 | CIF | C24 H45 I3 Mo N O P2 | I 41/a | 23.7105; 23.7105; 22.0142 90; 90; 90 | 12376.1 | Itabashi, Takayuki; Mori, Okki; Arashiba, Kazuya; Eizawa, Aya; Nakajima, Kazunari; Nishibayashi, Yoshiaki Effect of substituents on molybdenum triiodide complexes bearing PNP-type pincer ligands toward catalytic nitrogen fixation Dalton Transactions, 2019 |
7049049 | CIF | C82 H72 Fe8 Ge6 O14 | I 41/a | 20.9394; 20.9394; 17.7553 90; 90; 90 | 7785 | Schnepf, Andreas; Schrenk, Claudio; Preißing, Lars On the reaction of GeCl2·Dioxane with KFeCp(CO)2: Isolation and characterization of novel bimetallic clusters Dalton Transactions, 2019 |
7049395 | CIF | C32 H48 Cu4 I22 N16 Sb6 | I 41/a | 40.6216; 40.6216; 12.3875 90; 90; 90 | 20440.8 | Dehnhardt, Natalie; Böth, André; Heine, Johanna Surprising discoveries on the way to an old compound: four transient iodido antimonates Dalton Transactions, 2019 |
7049871 | CIF | C25 H15 N4 O4 Re | I 41/a | 22.5847; 22.5847; 17.1723 90; 90; 90 | 8759.1 | Das, Tapashi; Rajak, Kajal Krishna Experimental and theoretical investigation of a metalloreceptor bearing a [Re(CO)3]+ core incorporating a multifunctional ligand: selective reactivity towards Zn2+ and CN− ions Dalton Transactions, 2019 |
7049911 | CIF | C32 H56 Cl Co2 N16 O12 W | I 41/a | 12.3208; 12.3208; 34.355 90; 90; 90 | 5215.2 | Qian, Jun; Yoshikawa, Hirofumi; Hu, jingchun; Humphrey, Mark G.; Zhang, Jinfang; Awaga, Kunio; Zhang, Chi Auxiliary ligand-induced structural diversities of octacyanometalate-based heterobimetallic coordination polymers towards diverse magnetic properties Dalton Transactions, 2019 |
7049913 | CIF | C32 H56 Cl Co2 Mo N16 O12 | I 41/a | 12.332; 12.332; 34.23 90; 90; 90 | 5205.6 | Qian, Jun; Yoshikawa, Hirofumi; Hu, jingchun; Humphrey, Mark G.; Zhang, Jinfang; Awaga, Kunio; Zhang, Chi Auxiliary ligand-induced structural diversities of octacyanometalate-based heterobimetallic coordination polymers towards diverse magnetic properties Dalton Transactions, 2019 |
7049942 | CIF | C38 H54 Al N3 | I 41/a | 32.0061; 32.0061; 13.945 90; 90; 90 | 14285.1 | Gallardo-Villagrán, Manuel; Vidal, Fernando; Palma, Pilar; Alvarez González, Eleuterio; Chen, Eugene; Campora, Juan; Rodríguez Delgado, Antonio Aluminium (III) dialkyl 2,6-bisimino-4R-dihydropyridinates(-1): Selective Synthesis, Structure and Controlled Dimerization. Dalton Transactions, 2019 |
7054072 | CIF | C18 H33 Co2 N2 O11.5 | I 41/a | 28.365; 28.365; 13.361 90; 90; 90 | 10750 | Kim, Tae Kyung; Lee, Kyung Joo; Choi, Min; Park, Noejung; Moon, Dohyun; Moon, Hoi Ri Metal‒organic frameworks constructed from flexible ditopic ligands: conformational diversity of an aliphatic ligand New Journal of Chemistry, 2013, 37, 4130 |
7054446 | CIF | C60 H72 N8 O4 S4 | I 41/a | 19.53; 19.53; 15.3376 90; 90; 90 | 5850.1 | Zhao, Jiang-Lin; Tomiyasu, Hirotsugu; Ni, Xin-Long; Zeng, Xi; Elsegood, Mark R. J.; Redshaw, Carl; Rahman, Shofiur; Georghiou, Paris E.; Yamato, Takehiko Synthesis and evaluation of a novel ionophore based on a thiacalix[4]arene derivative bearing imidazole units New J. Chem., 2014, 38, 6041 |
7054999 | CIF | C18 H15 Mo N3 O5 | I 41/a | 25.2633; 25.2633; 11.2412 90; 90; 90 | 7174.52 | Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation New J. Chem., 2015, 39, 7322 |
7055075 | CIF | C9 H8 I2 O | I 41/a | 23.9673; 23.9673; 7.5322 90; 90; 90 | 4326.7 | Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin Halogen bonding in the crystal structures of 1,2-diiodo alkenes New J. Chem., 2015, 39, 8522 |
7058129 | CIF | C84 H113.4 N34 O37.7 S2 | I 41/a | 38.5719; 38.5719; 14.8762 90; 90; 90 | 22133 | Vedernikov, Artem I.; Lobova, Natalia A.; Kuzmina, Lyudmila G.; Fomina, Marina V.; Strelenko, Yuri A.; Howard, Judith A. K.; Gromov, Sergey P. Self-assembly of cucurbiturils and cyclodextrins to supramolecular millstones with naphthalene derivatives capable of translocations in the host cavities New Journal of Chemistry, 2019 |
7058352 | CIF | C27 H27 Cl N2 O8 | I 41/a | 25.773; 25.773; 16.667 90; 90; 90 | 11071 | Huang, Ying; Huang, Yi-Xin; Sun, Jing; Yan, Chaoguo [3+2] cycloaddition reaction for synthesis of spiro[indoline-3,3'-pyrrolidines] and evaluation of cytotoxicity to cancer cells New Journal of Chemistry, 2019 |
7058422 | CIF | C56 H40 Ag4 Mo12 N16 O40 Si | I 41/a | 23.1326; 23.1326; 14.8376 90; 90; 90 | 7939.9 | Tian, Aixiang; Fu, Yubo; Cui, Hongtao; Ying, Jun; Yang, Mengle; Yang, Yan; Wang, Xiuli A series of metal-organic loops templated by [SiMo12O40]4- and [β-Mo8O26]4- anions by using double chelate ligands: amperometric sensoring and selective photocatalytic properties New Journal of Chemistry, 2019 |
7109524 | CIF | C72 H82 Cl18 N16 S10 Sn4 Zn8 | I 41/a | 26.7544; 26.7544; 15.648 90; 90; 90 | 11200.8 | Beatrix E. K. Barth; Eliza Leusmann; Klaus Harms; Stefanie Dehnen Towards the installation of transition metal ions on donor ligand decorated tin sulfide clusters Chem.Commun., 2013, 49, 6590 |
7111976 | CIF | C45 H28 Mn N5 | I 41/a | 25.762; 25.762; 5.3833 90; 90; 90 | 3572.8 | Xi Chen; Shu-Qi Wu; Ai-Li Cui; Hui-Zhong Kou A cyano-bridged single-chain magnet featuring alternate high- and low-spin manganese(III) porphyrins Chem.Commun., 2014, 50, 2120 |
7117102 | CIF | C76 H28 F10 O2 | I 41/a | 28.7283; 28.7283; 12.1809 90; 90; 90 | 10053.1 | Baddigam Kiran Reddy; Santosh C. Gadekar; Venkataramanarao G. Anand Non-covalent composites of antiaromatic isophlorin-fullerene Chem.Commun., 2015, 51, 8276 |
7118388 | CIF | C57 H92 N12 Ni2 O16 | I 41/a | 27.286; 27.286; 8.343 90; 90; 90 | 6212 | Jiang, Xiang; Kou, Hui-Zhong Solid state reconstructive phase transition from porous supramolecular network to porous coordination polymer. Chemical communications (Cambridge, England), 2016, 52, 2952-2955 |
7118818 | CIF | C18 H16 N2 O2 | I 41/a | 24.392; 24.392; 4.8236 90; 90; 90 | 2869.9 | Grzybowski, Marek; Deperasińska, Irena; Chotkowski, Maciej; Banasiewicz, Marzena; Makarewicz, Artur; Kozankiewicz, Bolesław; Gryko, Daniel T. Dipyrrolonaphthyridinediones - structurally unique cross-conjugated dyes. Chemical communications (Cambridge, England), 2016, 52, 5108-5111 |
7120986 | CIF | C30 H72 O8 Si7 | I 41/a | 29.502; 29.502; 10.4338 90; 90; 90 | 9081.2 | Yokouchi, Yuki; Ishida, Shintaro; Onodera, Tsunenobu; Oikawa, Hidetoshi; Iwamoto, Takeaki Facile synthesis and bridgehead-functionalization of bicyclo[3.3.3]pentasiloxanes Chemical Communications, 2018 |
7121379 | CIF | C24 H18 B N | I 41/a | 26.7935; 26.7935; 9.9207 90; 90; 90 | 7122 | Yruegas, Sam; Martinez, Jesse J.; Martin, Caleb Daniel Intermolecular Insertion Reactions of Azides Into 9-Borafluorenes to Generate 9,10-B,N-Phenanthrenes Chemical Communications, 2018 |
7121532 | CIF | C344 H334 Cl13 F6 K2 N71 O68 S2 | I 41/a | 65.2962; 65.2962; 42.3749 90; 90; 90 | 180669 | Mateus, Pedro; Wicher, Barbara; Ferrand, Yann; Huc, Ivan Carbohydrate binding through first- and second-sphere coordination within aromatic oligoamide metallofoldamers Chemical Communications, 2018 |
7122364 | CIF | C42 H49 N2 O5 U | I 41/a | 29.7978; 29.7978; 21.0965 90; 90; 90 | 18731.8 | Chaudhry, Mohammad; Lelj, Francesco; MacLachlan, Mark Expanded Campestarene Hosts for Tetra- and Dinuclear Uranyl(VI) Complexes Chemical Communications, 2018 |
7122607 | CIF | C208 H224 N64 Ni16 O64 | I 41/a | 19.5487; 19.5487; 29.8878 90; 90; 90 | 11421.7 | Kivi, Charlie Eric William; Gelfand, Benjamin Sidney; Dureckova, Hana; Ho, Ha T. K.; Ma, Cindy; Shimizu, George K. H.; Woo, Tom; Song, Datong 3D Porous Metal‒Organic Framework for Selective Adsorption of Methane over Dinitrogen under Ambient Pressure Chemical Communications, 2018 |
7123229 | CIF | C136 H188 Cl12 N8 O28 | I 41/a | 27.2239; 27.2239; 20.9401 90; 90; 90 | 15519.6 | Peng, Zhiyong; Guo, Xuwen; Xu, Weitao; Li, Jian; Deng, Pengchi; Xiao, Xin; Feng, Wen; Yuan, Lihua Strong positive allosteric cooperativity in ternary complexes based on hydrogen-bonded aromatic amide macrocycles Chemical Communications, 2019 |
7156072 | CIF | C9 H12 O2 | I 41/a | 20.704; 20.704; 7.2027 90; 90; 90 | 3087.5 | Yujie, Zhu; Huo, Jing qian; Fan, Zhijin; Wu, Qifan; Xiang, Li; Shuang, Zhou; Xiong, Lixia; Tatiana, Kalinina; Tania, Gluhareva Efficient construction of bioactive trans-5A5B6C spirolactones via bicyclo[4.3.0] α-hydroxyketones Organic & Biomolecular Chemistry, 2018 |
7156232 | CIF | C30 H24 Cl2 I N O2 | I 41/a | 18.2568; 18.2568; 33.758 90; 90; 90 | 11251.9 | Baire, Beeraiah; Chinta, Bhavani Shankar; Vasikarla, Kamala Prasad; Sanapa, Harikrishna Highly, regioselective electrophile induced cyclizations of 2-(prop-1-ynyl)benzamides Organic & Biomolecular Chemistry, 2018 |
7156875 | CIF | C12 H25 Cl2 N5 | I 41/a | 17.722; 17.722; 28.3433 90; 90; 90 | 8901.8 | Kocsis, Istvan Zsolt; Motloch, Petr; Guerreiro, Ana; Qiu Mexia De Azeredo, Carolina; Bernardes, Gonçalo J. L.; Hunter, Christopher Alexander Triaminopyrimidine derivatives as transmembrane HCl transporters Organic & Biomolecular Chemistry, 2019 |
7214346 | CIF | C80 H88 Cl6 N8 Ni3 O16 | I 41/a | 16.298; 16.298; 30.945 90; 90; 90 | 8220 | Hawes, Chris S.; Batten, Stuart R.; Turner, David R. Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands CrystEngComm, 2014, 16, 3737 |
7214347 | CIF | C80 H88 Cl6 Co3 N8 O16 | I 41/a | 16.353; 16.353; 30.894 90; 90; 90 | 8262 | Hawes, Chris S.; Batten, Stuart R.; Turner, David R. Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands CrystEngComm, 2014, 16, 3737 |
7217288 | CIF | C34 H54 O2 | I 41/a | 23.87; 23.87; 10.781 90; 90; 90 | 6143 | Söhner, T.; Braun, F.; Over, L. C.; Mehlhose, S.; Rominger, F.; Straub, B. F. Halogen-free water-stable aluminates as replacement for persistent fluorinated weakly-coordinating anions Green Chem., 2014, 16, 4696 |
7221719 | CIF | C76 H76 Co4 N12 O20 | I 41/a | 15.0627; 15.0627; 33.6307 90; 90; 90 | 7630.3 | Loukopoulos, Edward; Berkoff, Benjamin; Griffiths, Kieran; Keeble, Victoria; Dokorou, Vassiliki N.; Tsipis, Athanassios C.; Escuer, Albert; Kostakis, George E. Cobalt(ii/iii), nickel(ii) and copper(ii) coordination clusters employing a monoanionic Schiff base ligand: synthetic, topological and computational mechanistic aspects CrystEngComm, 2015, 17, 6753 |
7221720 | CIF | C76 H76 Co4 N12 O24 | I 41/a | 15.0145; 15.0145; 33.6543 90; 90; 90 | 7586.9 | Loukopoulos, Edward; Berkoff, Benjamin; Griffiths, Kieran; Keeble, Victoria; Dokorou, Vassiliki N.; Tsipis, Athanassios C.; Escuer, Albert; Kostakis, George E. Cobalt(ii/iii), nickel(ii) and copper(ii) coordination clusters employing a monoanionic Schiff base ligand: synthetic, topological and computational mechanistic aspects CrystEngComm, 2015, 17, 6753 |
7223270 | CIF | C65 H108 N12 Ni2 O16 | I 41/a | 18.7966; 18.7966; 21.2715 90; 90; 90 | 7515.5 | Jiang, Xiang; Hu, Kong-Qiu; Kou, Hui-Zhong Tunable gas adsorption properties of porous coordination polymers by modification of macrocyclic metallic tectons CrystEngComm, 2016, 18, 4084 |
7223459 | CIF | C52 H58 As8 N16 Ni2 O49 V14 | I 41/a | 15.5647; 15.5647; 38.904 90; 90; 90 | 9424.9 | Guo, Hai-Yang; Li, Zhi-Fang; Zhang, Xiao; Fu, Li-Wei; Hu, Yang-Yang; Guo, Lan-Lan; Cui, Xiao-Bing; Huo, Qi-Sheng; Xu, Ji-Qing New self-assembly hybrid compounds based on arsenic‒vanadium clusters and transition metal mixed-organic-ligand complexes CrystEngComm, 2016, 18, 566 |
7223586 | CIF | C60 H74 Ag2 B2 F8 N8 O S8 | I 41/a | 16.0983; 16.0983; 54.7728 90; 90; 90 | 14194.7 | Ovsyannikov, A. S.; Noamane, M. H.; Abidi, R.; Ferlay, S.; Solovieva, S. E.; Antipin, I. S.; Konovalov, A. I.; Kyritsakas, N.; Hosseini, M. W. Molecular tectonics: dimensionality and geometry control of silver coordination networks based on pyrazolyl appended thiacalixarenes CrystEngComm, 2016, 18, 691 |
7223784 | CIF | Bi0.55 Mo O4 | I 41/a | 5.239; 5.239; 11.567 90; 90; 90 | 317.5 | Zhang, Yang; Cong, Hengjiang; Ji, Nianjing; Liu, Jian; Duan, Xiulan; Li, Jing; Cao, Wenwu; Wang, Jiyang; Jiang, Huaidong Effect of high bismuth deficiency on structure and oxide ion conductivity of a Bi0.55MoO4single crystal CrystEngComm, 2015, 17, 8746 |
7223856 | CIF | C22 H27 F6 N3 | I 41/a | 23.863; 23.863; 16.635 90; 90; 90 | 9473 | Alonso-Moreno, Carlos; BRAVO, IVAN; Posadas, Inmaculada; Albaladejo, José; CARRILLO-HERMOSILLA, FERNANDO; Ceña, Valentín; Garzon, Andres; López-Solera, Isabel; Romero-Castillo, Laura Phenyl-Guanidine Derivatives as Potential Therapeutic Agents for Glioblastoma Multiforme: Catalytic Syntheses, Cytotoxic Effects and DNA Affinity RSC Adv., 2016 |
7224054 | CIF | C26.12 H72.5 Na4 Nb6 O35.12 Ru2 | I 41/a | 30.105; 30.105; 14.0549 90; 90; 90 | 12738 | Abramov, Pavel A.; Vicent, Cristian; Kompankov, Nikolay B.; Laricheva, Yuliya A.; Sokolov, Maksim Nailyevich Unique solubility of polyoxoniobate salts in methanol: coordination to cations and POM methylation RSC Adv., 2016 |
7225804 | CIF | C40 H32 Cu4 N24 O40 Si W12 | I 41/a | 35.1044; 35.1044; 11.7352 90; 90; 90 | 14461.5 | Chen, Yan-Mei; Yu, Ying-Hui; Zhang, Han-Zhong; Hou, Guang-Feng; Gao, Jin-Sheng; Yan, Peng-Fei Ligand-induced isomerization: from 3D to 2D→3D POMOFs constructed from silicotungstate anions, Cu(i) and 1,n-di(4H-1,2,4-triazol-4-yl)benzene (n = 3, 4) ligands CrystEngComm, 2016, 18, 6389 |
7225820 | CIF | C62 H88 Cl4 Fe4 N16 O24 | I 41/a | 26.284; 26.284; 12.9228 90; 90; 90 | 8927.7 | Pan, Jia-li; Guo, Qian; Yang, Bing; Li, Yu-yi; Cao, Jin-ge; Meng, Xiang-gao; Xiao, Feng-ping Tetra-Fe(iii) and deca-Mn(iii) metallacrowns built from bis-salicylhydrazide ligands: synthesis, structures and magnetic properties CrystEngComm, 2016, 18, 6143 |
7225821 | CIF | C62 H88 Br4 Fe4 N16 O24 | I 41/a | 26.292; 26.292; 12.959 90; 90; 90 | 8958 | Pan, Jia-li; Guo, Qian; Yang, Bing; Li, Yu-yi; Cao, Jin-ge; Meng, Xiang-gao; Xiao, Feng-ping Tetra-Fe(iii) and deca-Mn(iii) metallacrowns built from bis-salicylhydrazide ligands: synthesis, structures and magnetic properties CrystEngComm, 2016, 18, 6143 |
7225986 | CIF | C83 H140 N8 Ni8 O59 | I 41/a | 29.353; 29.353; 16.1124 90; 90; 90 | 13882.4 | Fondo, Matilde; Doejo, Jesús; García-Deibe, Ana M.; Sanmartín-Matalobos, Jesús; Vicente, Ramón A Ni8metallacalix[4]arene and a Cu4molecular rhomboid: limiting the nuclearity of carboxysalen-like metal complexes CrystEngComm, 2016, 18, 6673 |
7226748 | CIF | C24 H20 Dy N8 Na O8 | I 41/a | 18.0441; 18.0441; 8.3135 90; 90; 90 | 2706.8 | Fernández, Belén; Oyarzabal, Itziar; Fischer-Fodor, Eva; Macavei, Sergiu; Sánchez, Ignacio; Seco, José M.; Gómez-Ruiz, Santiago; Rodríguez-Diéguez, Antonio Multifunctional applications of a dysprosium-based metal‒organic chain with single-ion magnet behaviour CrystEngComm, 2016, 18, 8718 |
7227201 | CIF | C29 H16 F12 Mn N2 O4 | I 41/a | 11.645; 11.645; 52.7 90; 90; 90 | 7146 | Mocanu, Teodora; Pop, Lidia; Hădade, Niculina D.; Shova, Sergiu; Grosu, Ion; Andruh, Marius Coordination polymers constructed from tetrahedral-shaped adamantane tectons CrystEngComm, 2017, 19, 27 |
7227277 | CIF | C12 H12 N22 O12 Zn5 | I 41/a | 15.5031; 15.5031; 12.0934 90; 90; 90 | 2906.6 | Ye, Yingxiang; Wu, Xiuzhen; Yao, Zizhu; Wu, Ling; Cai, Zetao; Wang, Lihua; Ma, Xiuling; Chen, Qian-Huo; Zhang, Zhangjing; Xiang, Shengchang Metal‒organic frameworks with a large breathing effect to host hydroxyl compounds for high anhydrous proton conductivity over a wide temperature range from subzero to 125 °C J. Mater. Chem. A, 2016, 4, 4062-4070 |
7228497 | CIF | C22 H26 Ca0.25 Cl0.5 N14 O18.38 | I 41/a | 31.3154; 31.3154; 14.3835 90; 90; 90 | 14105.2 | Danylyuk, Oksana Exploring cucurbit[6]uril-peptide interactions in the solid state: crystal structure of cucurbit[6]uril complexes with glycyl-containing dipeptides CrystEngComm, 2017 |
7230022 | CIF | C27 H12 O13 Ru3 | I 41/a | 36.9032; 36.9032; 8.9609 90; 90; 90 | 12203.4 | Xu, Lei; Li, Shasha; Jiang, Liping; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei Electronic and steric effects of substituents in 1,3-diphenylprop-2-yn-1-one during its reaction with Ru3(CO)12 RSC Advances, 2018, 8, 4354 |
7230919 | CIF | C2.22 H2.09 N0.25 Ni0.25 O0.98 | I 41/a | 23.7839; 23.7839; 36.666 90; 90; 90 | 20741 | Yue, Qi; Liu, Xu; Guo, Wei-Xiao; Gao, En-Qing Structural diversity and magnetic properties of Co(II)/Mn(II)/Ni(II) coordination polymers constructed from an unsymmetrical tetracarboxylic acid and varying N-donor ligands CrystEngComm, 2018 |
7231499 | CIF | Gd2.28 Li1.16 Mo4 O16 | I 41/a | 5.1932; 5.1932; 11.426 90; 90; 90 | 308.15 | Sun, Shijia; Qi, Wei; Chen, Weidong; Lou, Fei; Zhong, Degao; Hu, Chen; Zhang, Lizhen; Lin, Zhoubin; Teng, Bing Li2Gd4(MoO4)7 crystal preparation and spectral properties applying to 2.0 μm lasers CrystEngComm, 2018 |
7231551 | CIF | C84 H80 O8 | I 41/a | 13.045; 13.045; 40.2669 90; 90; 90 | 6852.3 | Muravev, Anton A.; Solovieva, Svetlana E.; Galieva, Farida B.; Bazanova, Olga B.; Rizvanov, Ildar Kh.; Ivshin, Kamil A.; Kataeva, Olga N.; Matthews, Susan E.; Antipin, Igor S. Calixarene alpha-ketoacetylenes: versatile platforms for reaction with hydrazine nucleophile RSC Advances, 2018, 8, 32765 |
9000999 | CIF | Mn4 O12 Si4 | I 41/a | 11.774; 11.774; 11.636 90; 90; 90 | 1613.06 | Fujino, K.; Momoi, H.; Sawamoto, H.; Kumazawa, M. Crystal structure and chemistry of MnSiO3 tetragonal garnet American Mineralogist, 1986, 71, 781-785 |
9001611 | CIF | Ca0.489 Mg3.511 O12 Si4 | I 41/a | 11.5816; 11.5816; 11.5288 90; 90; 90 | 1546.4 | Hazen, R. M.; Downs, R. T.; Finger, L. W.; Conrad, P. G.; Gasparik, T. Crystal chemistry of Ca-bearing majorite American Mineralogist, 1994, 79, 581-584 |
9002025 | CIF | Al0.36 Cr0.28 Mg3.68 O12 Si4.68 | I 41/a | 11.512; 11.512; 11.515 90; 90; 90 | 1526.04 | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ito, E. Structure refinement of birefringent Cr-bearing majorite Mg3(Mg.34Si.34Al.18Cr.14)2Si3O12 American Mineralogist, 1999, 84, 199-202 |
9002384 | CIF | Ca3 Ge3 Mn2 O12 | I 41/a | 12.3098; 12.3098; 12.3277 90; 90; 90 | 1868.03 | Heinemann, S.; Miletich, R. Structure and twinning of tetragonal Ca3Mn2Ge3O12 garnet American Mineralogist, 2000, 85, 993-1000 |
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