Crystallography Open Database
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Searching space group like 'C 2 2 21'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1000103 | CIF | Al2 Ca F9 K | C 2 2 21 | 12.343; 7.152; 22.679 90; 90; 90 | 2002 | Hemon, A; Le Bail, A; Courbion, G Crystal structure approach of KCaAl~2~F~9~. A new hexagonaltungsten- bronze related structure European Journal of Solid State Inorganic Chemistry, 1993, 30, 415-426 |
1001010 | CIF | Nb3.09 O8.22 Tl | C 2 2 21 | 7.551; 13.005; 7.734 90; 90; 90 | 759.5 | Gasperin, M Un niobate de thallium de type 'bronze hexagonal' excedentaire en cations Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2306-2308 |
1001610 | CIF | Mo4 O22 P4 Rb3 | C 2 2 21 | 14.222; 14.223; 19.22699 90; 90; 90 | 3889.2 | Borel, M M; Leclaire, A; Guesdon, A; Grandin, A; Raveau, B Mixed valent molybdenum monophosphates with an intersecting tunnel structure: A~3~O~2~(MoO)~4~(PO~4~)~4~ (A=Rb, Tl) Journal of Solid State Chemistry, 1994, 112, 15-21 |
1008237 | CIF | F3 K0.3 Nb | C 2 2 21 | 7.54; 13.06; 7.75 90; 90; 90 | 763.2 | Masse, R; Aleonard, S; Averbuch-Pouchot, M T Chemical Preparation and X-ray Structure Determination of K~0.3~ Nb F Journal of Solid State Chemistry, 1984, 53, 136-139 |
1008303 | CIF | Mn2 N0.86 | C 2 2 21 | 4.8552; 8.4088; 4.5327 90; 90; 90 | 185.1 | Eddine, M N; Bertaut, E F Structure cristallographique et magnetique de Mn~2~ N~0.86~ a basse Temperature Solid State Communications, 1977, 23, 147-150 |
1008376 | CIF | Ba S3 V | C 2 2 21 | 6.7572; 11.4866; 5.5994 90; 90; 90 | 434.6 | Ghedira, M; Anne, M; Chenavas, J; Marezio, M; Sayetat, F Powder neutron diffraction studies of the low-temperature phase transitions in stoichiometric Ba V S~3~ Journal of Physics C, 1986, 19, 6489-6503 |
1010159 | CIF | Al F5 Tl2 | C 2 2 21 | 10.06; 8.24; 7.46 90; 90; 90 | 618.4 | Brosset, C Herstellung und Kristallbau der Verbindungen Tl Al F~4~ und Tl~2~ Al F~5~ Zeitschrift fuer Anorganische und Allgemeine Chemie, 1937, 235, 139-147 |
1011063 | CIF | H2 O | C 2 2 21 | 7.8; 4.5; 5.56 90; 90; 90 | 195.2 | McFarlan, Ronald L. The Structure of Ice II The Journal of Chemical Physics, 1936, 4, 60-64 |
1100169 | CIF | C20 H20 N16 O8 Pd2 | C 2 2 21 | 12.864; 14.634; 30.703 90; 90; 90 | 5779.7 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron, 2004, 23, 2373-2379 |
1100389 | CIF | C32 H30 Cl N2 O4 P | C 2 2 21 | 7.967; 24.71; 14.722 90; 90; 90 | 2898.24 | Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt; Magull, Jörg μ~2~-Chlorokomplexe von Succinimid und N-Chlorsuccinimid. Die Kristallstrukturen von PPh~4~[Cl(Succinimid)~2~], PPh~4~[[Cl(N-Cl-Succinimid)~2~] und N-Chlorphthalimid / μ~2~-Chloro Complexes of Succinimide and N-Chlorosuccinimide. The Crystal Structures of PPh~4~[Cl(Succinimide)~2~], PPh~4~[Cl(N-Cl-Succinimide)~2~] and N-Chlorophthalimide} Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences, 1994, 49, 506-512 |
1501989 | CIF | C24 H30 N2 O5 | C 2 2 21 | 5.6207; 21.3127; 37.844 90; 90; 90 | 4533.4 | Hong, Bor-Cherng; Dange, Nitin S.; Hsu, Che-Sheng; Liao, Ju-Hsiou; Lee, Gene-Hsiang Dynamic kinetic asymmetric synthesis of five contiguous stereogenic centers by sequential organocatalytic stetter and Michael-aldol reaction: enantioselective synthesis of fully substituted cyclopentanols bearing a quaternary stereocenter. Organic letters, 2011, 13, 1338-1341 |
1502211 | CIF | C59.95 H91.375 Cl1.575 O8.475 | C 2 2 21 | 18.3457; 24.3333; 24.9713 90; 90; 90 | 11147.5 | Bai, Xinyan; Barnes, Charles; Pascal, Jr, Robert A; Chen, Xueyi; Dias, Jerry Ray Bile acid-based cage compounds with lipophilic outer shells and inner cavities. Organic letters, 2011, 13, 3064-3067 |
1503325 | CIF | C20 H18 Cl2 Pd | C 2 2 21 | 7.61; 16.8437; 13.2376 90; 90; 90 | 1696.8 | Zhang, Shu-Sheng; Wang, Zhi-Qian; Xu, Ming-Hua; Lin, Guo-Qiang Chiral diene as the ligand for the synthesis of axially chiral compounds via palladium-catalyzed Suzuki-Miyaura coupling reaction. Organic letters, 2010, 12, 5546-5549 |
1503928 | CIF | C12 H12 O5 | C 2 2 21 | 6.1208; 9.984; 17.437 90; 90; 90 | 1065.6 | Schneider, Tobias F.; Kaschel, Johannes; Dittrich, Birger; Werz, Daniel B. anti-Oligoannelated THF moieties: synthesis via push-pull-substituted cyclopropanes. Organic letters, 2009, 11, 2317-2320 |
1504482 | CIF | C32 H29 N3 O2 | C 2 2 21 | 11.6384; 18.8748; 23.44 90; 90; 90 | 5149.1 | Gerstenberger, Brian S.; Lin, Jinzhen; Mimieux, Yvette S.; Brown, Lauren E.; Oliver, Allen G.; Konopelski, Joseph P. Structural characterization of an enantiomerically pure amino acid imidazolide and direct formation of the beta-lactam nucleus from an alpha-amino acid. Organic letters, 2008, 10, 369-372 |
1505226 | CIF | C24 H39 N O8 | C 2 2 21 | 13.491; 15.501; 21.975 90; 90; 90 | 4595.5 | Gao, Feng; Chen, Qiao-Hong; Wang, Feng-Peng C19-diterpenoid alkaloids from Aconitum hemsleyanum var. circinatum. Journal of natural products, 2007, 70, 876-879 |
1505697 | CIF | F1.28 O48 Si24 | C 2 2 21 | 12.905; 21.344; 5.1279 90; 90; 90 | 1412.5 | Burton, Allen; Darton, Richard J.; Davis, Mark E.; Hwang, Song-Jong; Morris, Russell E.; Ogino, Isao; Zones, Stacey I. Structure-directing agent location and non-centrosymmetric structure of fluoride-containing zeolite SSZ-55. The journal of physical chemistry. B, 2006, 110, 5273-5278 |
1506489 | CIF | C15 H20 O3 | C 2 2 21 | 7.338; 15.567; 23.86 90; 90; 90 | 2726 | Jeffery, David W.; Perkins, Michael V.; White, Jonathan M. Synthesis of an analogue of the marine polypropionate tridachiahydropyrone. Organic letters, 2005, 7, 407-409 |
1507038 | CIF | C10 H4 S4 | C 2 2 21 | 4.776; 13.918; 14.7 90; 90; 90 | 977.1 | Nenajdenko, Valentine G.; Sumerin, Viktor V.; Chernichenko, Konstantin Yu; Balenkova, Elizabeth S. A new route to annulated oligothiophenes. Organic letters, 2004, 6, 3437-3439 |
1507066 | CIF | C46.5 H69 Cl3 N6 O14.5 Zn3 | C 2 2 21 | 15.5481; 26.735; 27.74 90; 90; 90 | 11531 | Gao, Jian; Zingaro, Ralph A.; Reibenspies, Joseph H.; Martell, Arthur E. Direct observation of enantioselective synergism at trimetallic centers. Organic letters, 2004, 6, 2453-2455 |
1507468 | CIF | C64 H89 Cl6 N5 O8 | C 2 2 21 | 12.621; 22.358; 23.335 90; 90; 90 | 6585 | Falábu, Dezsö; Shivanyuk, Alexander; Nissinen, Maija; Rissanen, Kari Complexation of Small Molecules by Open-Ended Resorcarene Hosts Organic Letters, 2002, 4, 3019 |
1507713 | CIF | C23 H21.5 Br0.5 F2 N3 O | C 2 2 21 | 12.772; 18.1424; 17.4735 90; 90; 90 | 4048.9 | Schönherr, Heike; Leighton, James L. Direct and highly enantioselective iso-Pictet-Spengler reactions with α-ketoamides: access to underexplored indole core structures. Organic letters, 2012, 14, 2610-2613 |
1508093 | CIF | C73.5 H87 Cl15 N12 | C 2 2 21 | 16.861; 32.059; 29.48 90; 90; 90 | 15935 | Hasell, Tom; Wu, Xiaofeng; Jones, James T. A.; Bacsa, John; Steiner, Alexander; Mitra, Tamoghna; Trewin, Abbie; Adams, Dave J.; Cooper, Andrew I. Triply interlocked covalent organic cages. Nature chemistry, 2010, 2, 750-755 |
1508103 | CIF | C100 H108 Cl F24 N4 O20 P4 S8 | C 2 2 21 | 13.4168; 37.385; 27.8719 90; 90; 90 | 13980.2 | Spruell, Jason M.; Coskun, Ali; Friedman, Douglas C.; Forgan, Ross S.; Sarjeant, Amy A.; Trabolsi, Ali; Fahrenbach, Albert C.; Barin, Gokhan; Paxton, Walter F.; Dey, Sanjeev K.; Olson, Mark A.; Benítez, Diego; Tkatchouk, Ekaterina; Colvin, Michael T.; Carmielli, Raanan; Caldwell, Stuart T.; Rosair, Georgina M.; Hewage, Shanika Gunatilaka; Duclairoir, Florence; Seymour, Jennifer L.; Slawin, Alexandra M. Z.; Goddard, 3rd, William A; Wasielewski, Michael R.; Cooke, Graeme; Stoddart, J. Fraser Highly stable tetrathiafulvalene radical dimers in [3]catenanes. Nature chemistry, 2010, 2, 870-879 |
1508728 | CIF | C11 H9 N3 | C 2 2 21 | 10.7653; 11.5943; 29.2492 90; 90; 90 | 3650.8 | Wu, Wen-Bin; Huang, Jing-Mei Highly Regioselective C-N Bond Formation through C-H Azolation of Indoles Promoted by Iodine in Aqueous Media. Organic letters, 2012, 14, 5832-5835 |
1512214 | CIF | C103 H144 Cl28 N24 O12 | C 2 2 21 | 16.62503; 17.42571; 94.3127 90; 90; 90 | 27322.7 | Aav, Riina; Shmatova, Elena; Reile, Indrek; Borissova, Maria; Topić, Filip; Rissanen, Kari New Chiral Cyclohexylhemicucurbit[6]uril Organic Letters, 2013, 15, 3786 |
1513052 | CIF | C12 H16 N O3 | C 2 2 21 | 5.6469; 14.472; 28.247 90; 90; 90 | 2308.4 | Ivanova, Bojidarka; Spiteller, Michael Salts of aromatic amines: Crystal structures, spectroscopic and non-linear optical properties Spectrochimica Acta Part A, 2010, 77, 849 |
1513168 | CIF | C10 H16 N2 O7 | C 2 2 21 | 8.0606; 14.6983; 23.782 90; 90; 90 | 2817.6 | Ivanova, Bojidarka; Spiteller, Michael Noncentrosymmetric Crystals with Marked Nonlinear Optical Properties Journal of Physical Chemistry A, 2010, 114, 5099-5103 |
1513533 | CIF | C68 H92 N4 O25 S4 | C 2 2 21 | 12.9248; 15.416; 39.31 90; 90; 90 | 7832.5 | Brawn, Ryan A.; Zhu, Kaicheng; Panek, James S. Rhodium(II)-catalyzed alkyne amination of homopropargylic sulfamate esters: stereoselective synthesis of functionalized norcaradienes by arene cyclopropanation. Organic letters, 2014, 16, 74-77 |
1514483 | CIF | C57 H74 Cl4 Cu2 N4 S2 | C 2 2 21 | 14.073; 21.02; 19.083 90; 90; 90 | 5645 | Zhang, Shiyu; Warren, Timothy H. Three coordinate models for the binuclear CuA electron-transfer site Chemical Science, 2013, 4, 1786 |
1515169 | CIF | C108 H168 N12 | C 2 2 21 | 18.9708; 25.2751; 26.5778 90; 90; 90 | 12743.8 | Giri, Nicola; Davidson, Christine E.; Melaugh, Gavin; Del Pópolo, Mario G.; Jones, James T. A.; Hasell, Tom; Cooper, Andrew I.; Horton, Peter N.; Hursthouse, Michael B.; James, Stuart L. Alkylated organic cages: from porous crystals to neat liquids Chemical Science, 2012, 3, 2153 |
1515277 | CIF | C24 H70 N6 O30 S2 | C 2 2 21 | 6.7453; 25.6806; 25.6822 90; 90; 90 | 4448.76 | Hanessian, Stephen; Maianti, Juan Pablo; Ly, Vu Linh; Deschênes-Simard, Benoît Structural and kinetic study of self-assembling macrocyclic dimer natural product aminoglycoside 66-40C and unnatural variants Chemical Science, 2012, 3, 249 |
1515758 | CIF | C18 H16 Cl F O2 | C 2 2 21 | 9.877; 12.0636; 27.244 90; 90; 90 | 3246.2 | Li, Yi; Xu, Ming-Hua Rhodium-catalyzed asymmetric tandem cyclization for efficient and rapid access to underexplored heterocyclic tertiary allylic alcohols containing a tetrasubstituted olefin. Organic letters, 2014, 16, 2712-2715 |
1517033 | CIF | C19.5 H12 Co1.5 N4.5 | C 2 2 21 | 8.4667; 16.5199; 24.2164 90; 90; 90 | 3387.1 | Bin Yuan; Min Min Yue; Ying Wang; Ju Yan Liu; Bin Ding; Xiao Jun Zhao Cyano-bridged assemblies induced by positive ions: Hydrothermal syntheses, crystal and powder X-ray structures, and magnetic properties Inorganica Chimica Acta, 2013, 402, 1-5 |
1517140 | CIF | C48 H52 N2 O4 Ti | C 2 2 21 | 18.434; 18.468; 24.873 90; 90; 90 | 8468 | Liang Chen; Ning Zhao; Qiuwen Wang; Guohua Hou; Haibin Song; Guofu Zi Synthesis, structure, and catalytic activity of titanium complexes with chiral biaryl Schiff-base ligands Inorganica Chimica Acta, 2013, 402, 140-155 |
1517983 | CIF | C57 H49.5 Eu N6 O11.5 | C 2 2 21 | 26.0015; 26.4029; 30.8305 90; 90; 90 | 21165.6 | Kotova, Oxana; Blasco, Salvador; Twamley, Brendan; O'Brien, John; Peacock, Robert D.; Kitchen, Jonathan A.; Martínez-Calvo, Miguel; Gunnlaugsson, Thorfinnur The application of chiroptical spectroscopy (circular dichroism) in quantifying binding events in lanthanide directed synthesis of chiral luminescent self-assembly structures Chem. Sci., 2015, 6, 457 |
1520274 | CIF | C17 H21 N O4 | C 2 2 21 | 7.4019; 15.8155; 26.8034 90; 90; 90 | 3137.73 | Coles, Simon J.; Hursthouse, Michael B.; Motherwell, W. C17H21NO4 Crystal Structure Report Archive, 2008, 416 |
1525169 | CIF | O7 Ta Y3 | C 2 2 21 | 10.4762; 7.4237; 7.4522 90; 90; 90 | 579.574 | Rossell, H.J. Fluorite-related phases Ln3 M O7, Ln= rare earth, Y or Sc, M= Nb, Sb or Ta Journal of Solid State Chemistry, 1979, 27, 115-122 |
1525170 | CIF | Gd O7 Sb Y2 | C 2 2 21 | 10.5172; 7.4527; 7.4806 90; 90; 90 | 586.341 | Rossell, H.J. Fluorite-related phases Ln3 M O7, Ln= rare earth, Y or Sc, M= Nb, Sb or Ta Journal of Solid State Chemistry, 1979, 27, 115-122 |
1526254 | CIF | Cd O4 Rb2 Si | C 2 2 21 | 11.426; 11.023; 16.725 90; 90; 90 | 2106.49 | Hansing, J.; Moeller, A. Rb2 Cd Si O4 : synthesis and crystal structure Journal of Solid State Chemistry, 2001, 162, 214-219 |
1530304 | CIF | Ca H Na O4 Si | C 2 2 21 | 5.71; 9.18; 7.03 90; 90; 90 | 368.497 | Ljutin, V.I.; Kazak, V.F.; Ilyukhin, V.V.; Belov, H.V. Crystal structure of Na Ca H Si O4 Doklady Akademii Nauk SSSR, 1972, 205, 582-584 |
1530369 | CIF | La O9 P3 | C 2 2 21 | 11.303; 8.648; 7.397 90; 90; 90 | 723.045 | Matuszewski, J.; Kropiwnicka, J.; Znamierowska, T. The Crystal Structure of Lanthanum Metaphosphate La P3 O9 Journal of Solid State Chemistry, 1988, 75, 285-290 |
1530729 | CIF | O9 Ta2 Th2 | C 2 2 21 | 11.5915; 15.4967; 7.4029 90; 90; 90 | 1329.78 | Schmidt, G.; Gruehn, R. Darstellung und Struktur von Th2 Ta2 O9 Journal of the Less-Common Metals, 1989, 156, 75-86 |
1530858 | CIF | H28 Mg Mo7 O54 U6 | C 2 2 21 | 11.313; 20.163; 23.877 90; 90; 90 | 5446.44 | Tabachenko, V.V.; Kovba, L.M.; Serezhkin, V.N. Crystal structures of Mg (U O2)6 (Mo O4)7 (H2 O)18 and Sr (U O2)6 (Mo O4)7 (H2 O)15 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1984, 10, 558-562 |
1530859 | CIF | H38 Mo7 O59 Sr U6 | C 2 2 21 | 11.166; 20.281; 24.061 90; 90; 90 | 5448.8 | Tabachenko, V.V.; Kovba, L.M.; Serezhkin, V.N. Crystal structures of Mg (U O2)6 (Mo O4)7 (H2 O)18 and Sr (U O2)6 (Mo O4)7 (H2 O)15 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1984, 10, 558-562 |
1532548 | CIF | Al O4 P | C 2 2 21 | 7.0843; 7.0823; 6.9989 90; 90; 90 | 351.157 | Achary, S.N.; Jayakumar, O.D.; Tyagi, A.K.; Kulshreshtha, S.K. Preparation, phase transition and thermal expansion studies on low-cristobalite type Al1-x Gax P O4 (x = 0.0, 0.20, 0.50, 0.80 and 1.00) Journal of Solid State Chemistry, 2003, 176, 37-46 |
1532551 | CIF | Al0.8 Ga0.2 O4 P | C 2 2 21 | 7.0529; 7.0558; 6.9551 90; 90; 90 | 346.113 | Achary, S.N.; Tyagi, A.K.; Jayakumar, O.D.; Kulshreshtha, S.K. Preparation, phase transition and thermal expansion studies on low-cristobalite type Al1-x Gax P O4 (x = 0.0, 0.20, 0.50, 0.80 and1.00) Journal of Solid State Chemistry, 2003, 176, 37-46 |
1532554 | CIF | Al0.5 Ga0.5 O4 P | C 2 2 21 | 7.0295; 7.0173; 6.9217 90; 90; 90 | 341.434 | Achary, S.N.; Jayakumar, O.D.; Tyagi, A.K.; Kulshreshtha, S.K. Preparation, phase transition and thermal expansion studies on low-cristobalite type Al1-x Gax P O4 (x = 0.0, 0.20, 0.50, 0.80 and1.00) Journal of Solid State Chemistry, 2003, 176, 37-46 |
1532557 | CIF | Al0.2 Ga0.8 O4 P | C 2 2 21 | 6.9968; 6.9794; 6.8884 90; 90; 90 | 336.384 | Achary, S.N.; Kulshreshtha, S.K.; Tyagi, A.K.; Jayakumar, O.D. Preparation, phase transition and thermal expansion studies on low-cristobalite type Al1-x Gax P O4 (x = 0.0, 0.20, 0.50, 0.80 and1.00) Journal of Solid State Chemistry, 2003, 176, 37-46 |
1532560 | CIF | Ga O4 P | C 2 2 21 | 6.9876; 6.9624; 6.8774 90; 90; 90 | 334.589 | Achary, S.N.; Jayakumar, O.D.; Tyagi, A.K.; Kulshreshtha, S.K. Preparation, phase transition and thermal expansion studies on low-cristobalite type Al1-x Gax P O4 (x = 0.0, 0.20, 0.50, 0.80 and1.00) Journal of Solid State Chemistry, 2003, 176, 37-46 |
1532955 | CIF | O9 P3 Pr | C 2 2 21 | 11.234; 8.5289; 7.3199 90; 90; 90 | 701.346 | Jouini, A.; Ferid, M.; Gacon, J.C.; Grosvalet, L.; Thozet, A.; Trabelsi-Ayadi, M. Crystal structure and optical study of praseodymium polyphosphate Pr (P O3)3 Materials Research Bulletin, 2003, 38, 1613-1622 |
1533026 | CIF | Ba5 Na2 O14 Ru3 | C 2 2 21 | 5.845; 10.145; 24.163 90; 90; 90 | 1432.81 | Quarez, E.; Mentre, O. Electrosynthesis, structural transitions and characterization of the new 10H-(Ba5 Ru3 Na2 O14) Solid State Sciences, 2003, 5, 1105-1116 |
1533442 | CIF | Al O4 P | C 2 2 21 | 7.1023; 7.0956; 7.0146 90; 90; 90 | 353.501 | Graetsch, H.A. Thermal expansion and thermally induced variations of the crystal structure of Al P O4 low crystobalite Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-), 2003, 2003, 289-301 |
1533778 | CIF | Dy3 O7 Re | C 2 2 21 | 10.561; 7.4613; 7.4567 90; 90; 90 | 587.579 | Hinatsu, Y.; Taira, N.; Wakeshima, M.; Kawabuchi, N. Structures and magnetic properties of rare earth rhenium oxides Ln3 Re O7 (Ln = Gd, Tb and Dy) Journal of Alloys Compd., 2004, 374, 79-83 |
1533849 | CIF | D0.8 Sn Ti3 | C 2 2 21 | 6.179; 9.877; 4.7898 90; 90; 90 | 292.321 | Vennstrom, M.; Grechnev, A.; Eriksson, O.; Andersson, Y. Phase relations in the (Ti3 Sn) - D system Journal of Alloys Compd., 2004, 364, 127-131 |
1534520 | CIF | Al3 O20 P6 Rb | C 2 2 21 | 9.8757; 12.8854; 11.9192 90; 90; 90 | 1516.75 | Lesage, J.; Guesdon, A.; Raveau, B. Two aluminotriphosphates with closely related intersecting tunnel structures involving tetrahedral "AlP" chains and layers : A Al3 (P3 O10)2, A = Rb, Cs Journal of Solid State Chemistry, 2005, 178, 1212-1220 |
1534924 | CIF | Ba Nb2 O6 | C 2 2 21 | 7.88; 12.215; 10.292 90; 90; 90 | 990.648 | Sirotinkin, V.P.; Sirotinkin, S.P. Structure of high temperature modification of Ba Nb2 O6 Zhurnal Neorganicheskoi Khimii, 1990, 35, 2189-2191 |
1536895 | CIF | Bi2 Cs F7 | C 2 2 21 | 16.215; 28.085; 12.7 90; 90; 90 | 5783.56 | Rastsvetaeva, R.K.; Butashin, A.V.; Maksimov, B.A.; Kaminskii, A.A.; Golubev, A.M. Synthesis, crystal structure and some properties of Cs Bi2 F7 : (Nd 3+) Kristallografiya, 1996, 41, 444-449 |
1537060 | CIF | C2 Br3 La3 | C 2 2 21 | 11.533; 17.06979; 17.05399 90; 90; 90 | 3357.35 | Zheng, C.; Oeckler, O.; Mattausch, H.J.; Simon, A. La3 X3 Z - compounds with condensed La6 Z octahedra helically connected in three dimensions Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 2151-2162 |
1539131 | CIF | Fe P4 | C 2 2 21 | 5.005; 10.213; 5.53 90; 90; 90 | 282.672 | Sugitani, M.; Kinomura, N.; Koizumi, M.; Kume, S. Preparation and properties of a new iron phosphide Fe P4 Journal of Solid State Chemistry, 1978, 26, 195-201 |
1539621 | CIF | H4 N O12 P4 Y | C 2 2 21 | 11.955; 10.374; 17.36 90; 90; 90 | 2153.01 | Bagieu-Beucher, M.; Guitel, J.C. Crystal structure of the yttrium-ammonium polyphosphate Y (N H4) (P O3)4 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1988, 559, 123-130 |
1540210 | CIF | Er K O12 P4 | C 2 2 21 | 11.75; 10.325; 17.31 90; 90; 90 | 2100.03 | Karpov, O.G.; Dorokhova, G.I. Crystal structure of a new polymorphic modification of K Er P4 O12 Kristallografiya, 1989, 34, 1006-1008 |
1540425 | CIF | C18 H14 N O4 | C 2 2 21 | 6.8797; 17.32; 26.023 90; 90; 90 | 3100.8 | Artuso, Emma; Ghibaudi, Elena; Lace, Beatrice; Marabello, Domenica; Vinciguerra, Daniele; Lombardi, Chiara; Koltai, Hinanit; Kapulnik, Yoram; Novero, Mara; Occhiato, Ernesto G.; Scarpi, Dina; Parisotto, Stefano; Deagostino, Annamaria; Venturello, Paolo; Mayzlish-Gati, Einav; Bier, Ariel; Prandi, Cristina Stereochemical Assignment of Strigolactone Analogues Confirms Their Selective Biological Activity. Journal of natural products, 2015, 78, 2624-2633 |
1541717 | CIF | C6 H8 Cl9 Cs5 N6 Nb6 O7 | C 2 2 21 | 8.7854; 23.9393; 18.027 90; 90; 90 | 3791.37 | Naumov, N.G.; Cordier, S.; Perrin, C. Two (Nb6 Cl9 O3 (C N)6)(5-) isomer anions in two Nb6 cluster oxyhalides: Cs5 (Nb6 Cl9 O3 (C N)6) * 4(H2 O) and (Me4 N)5 (Nb6 Cl9 O3 (C N)6) * 5(H2 O) Angew. Chem. Int. ed., 2002, 41, 3002-3004 |
1543773 | CIF | C15 H19 O5.5 | C 2 2 21 | 11.0841; 20.46; 12.6447 90; 90; 90 | 2867.57 | Zhou, Xue-Ming; Zheng, Cai-Juan; Gan, Li-She; Chen, Guang-Ying; Zhang, Xiao-Peng; Song, Xiao-Ping; Li, Gao-Nan; Sun, Chong-Ge Bioactive Phenanthrene and Bibenzyl Derivatives from the Stems of Dendrobium nobile. Journal of natural products, 2016, 79, 1791-1797 |
1544266 | CIF | C20 H26 Cl2 Co N4 | C 2 2 21 | 11.8914; 12.9438; 15.3741 90; 90; 90 | 2366.4 | Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations Catal. Sci. Technol., 2016, 6, 7408 |
1544270 | CIF | C22 H32 Cl2 Co N4 O | C 2 2 21 | 11.2962; 13.9276; 14.5394 90; 90; 90 | 2287.5 | Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations Catal. Sci. Technol., 2016, 6, 7408 |
1546337 | CIF | C43 H58 F6 N4 O6 Pd2 | C 2 2 21 | 9.2657; 29.63; 19.311 90; 90; 90 | 5301.7 | Gair, Joe J.; Haines, Brandon E.; Filatov, Alexander S.; Musaev, D. G.; Lewis, Jared C. Mono-N-Protected Amino Acid Ligands Stabilize Dimeric Palladium(II) Complexes of Importance to C-H Functionalization Chem. Sci., 2017 |
1547076 | CIF | C28 H54 B Fe N O2 P2 | C 2 2 21 | 12.9849; 18.5848; 26.1432 90; 90; 90 | 6308.9 | Nakajima, Kazunari; Kato, Takeru; Nishibayashi, Yoshiaki Hydroboration of Alkynes Catalyzed by Pyrrolide-Based PNP Pincer-Iron Complexes. Organic letters, 2017, 19, 4323-4326 |
1548363 | CIF | C100 H100 Ag15 Cl4 N4 O10 P12 | C 2 2 21 | 18.702; 36.975; 28.652 90; 90; 90 | 19813 | Shen, Xue-Tao; Ma, Xue-Li; Ni, Qing-Ling; Ma, Meng-Xia; Gui, Liu-Cheng; Hou, Cheng; Hou, Ruo-Bing; Wang, Xiu-Jian [Ag<sub>15</sub>(N-triphos)<sub>4</sub>(Cl<sub>4</sub>)](NO<sub>3</sub>)<sub>3</sub>: a stable Ag-P superatom with eight electrons (N-triphos = tris((diphenylphosphino)methyl)amine). Nanoscale, 2018, 10, 515-519 |
1548708 | CIF | C54 H64 Ho N14 O16 | C 2 2 21 | 17.455; 47.542; 27.414 90; 90; 90 | 22749 | Ga-Lai Law; Tiffany A. Pham; Jide Xu; Kenneth N. Raymond A Single Sensisitizer for the Excitation of Visible and NIR Lanthanide Emitters (Sm, Eu, Tb, Dy and Ho) in Water with High Quantum Yields Angewandte Chemie Int. Ed. Engl, 2012, 51, 2371-2374 |
1549010 | CIF | C41 H64 O9 | C 2 2 21 | 7.8136; 22.8068; 65.613 90; 90; 90 | 11692.4 | Remy, Simon; Olivon, Florent; Desrat, Sandy; Blanchard, Florent; Eparvier, Véronique; Leyssen, Pieter; Neyts, Johan; Roussi, Fanny; Touboul, David; Litaudon, Marc Structurally Diverse Diterpenoids from Sandwithia guyanensis Journal of Natural Products, 2018 |
1549172 | CIF | C19 H22.75 N2 O4.38 Zn | C 2 2 21 | 24.662; 37.18; 8.7826 90; 90; 90 | 8053.1 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
1549408 | CIF | C112 H88 Co N8 O8 | C 2 2 21 | 12.7206; 36.0918; 22.8341 90; 90; 90 | 10483.3 | Wen, Xin; Wang, Yong; Zhang, X. Peter Enantioselective radical process for synthesis of chiral indolines by metalloradical alkylation of diverse C(sp<sup>3</sup>)-H bonds. Chemical science, 2018, 9, 5082-5086 |
1549991 | CIF | O7 Sm3 Ta | C 2 2 21 | 10.7818; 7.6197; 7.6556 90; 90; 90 | 628.94 | Hinatsu, Y.; Doi, Y. Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1073 K Journal of the Ceramic Society of Japan, 2018, 126, 743-749 |
1549992 | CIF | Eu0.6 Nb O7 Sm2.4 | C 2 2 21 | 10.7488; 7.6036; 7.6521 90; 90; 90 | 625.4 | Hinatsu, Y.; Doi, Y. Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 973 K Journal of the Ceramic Society of Japan, 2018, 126, 743-749 |
1550172 | CIF | O7 Re Yb3 | C 2 2 21 | 10.4422; 7.4149; 7.4123 90; 90; 90 | 573.92 | Inabayashi, M.; Doi, Y.; Wakeshima, M.; Hinatsu, Y. Magnetic properties of rare earth rhenium oxides Ln3ReO7 (Ln = Y, Er-Lu) with fluorite-related structure Journal of the Ceramic Society of Japan, 2018, 126, 920-924 |
1551021 | CIF | Nd3 O7 Ta | C 2 2 21 | 10.825; 7.6099; 7.6814 90; 90; 90 | 632.77 | Hinatsu, Y.; Doi, Y. Studies on phase transitions of rare earth tantalites (Sm1-xLnx)3TaO7 (Ln = Nd, Eu) with fluorite-related structure Journal of the Ceramic Society of Japan, 2019, 127, 273-278 |
1551378 | CIF | C20 H19 N3 | C 2 2 21 | 7.32208; 18.4404; 23.9475 90; 90; 90 | 3233.44 | Jiang, Huanfeng; He, Dandan; Zhuang, Zeyan; Wang, Xu; Li, Jiawei; Li, Jianxiao; Wu, Wanqing; Zhao, Zujin; Tang, Ben Zhong Assembly of 1H-Isoindole Derivatives by Selective Carbon-Nitrogen Triple Bond Activation: Access to Aggregation-Induced Emission Fluorophores for Lipid Droplets Imaging Chemical Science, 2019 |
1551379 | CIF | C18 H17 N3 S | C 2 2 21 | 7.306; 18.404; 23.763 90; 90; 90 | 3195 | Jiang, Huanfeng; He, Dandan; Zhuang, Zeyan; Wang, Xu; Li, Jiawei; Li, Jianxiao; Wu, Wanqing; Zhao, Zujin; Tang, Ben Zhong Assembly of 1H-Isoindole Derivatives by Selective Carbon-Nitrogen Triple Bond Activation: Access to Aggregation-Induced Emission Fluorophores for Lipid Droplets Imaging Chemical Science, 2019 |
1551518 | CIF | C52 H72 N28 S8 Zn4 | C 2 2 21 | 15.137; 16.265; 28.91 90; 90; 90 | 7118 | Yu, Ping; Deng, Jungang; Cai, Jinhua; Zhang, Zhenlei; Zhang, Juzheng; Hamid Khan, Muhammad; Liang, Hong; Yang, Feng Anticancer and biological properties of a Zn-2,6-diacetylpyridine bis(thiosemicarbazone) complex. Metallomics : integrated biometal science, 2019, 11, 1372-1386 |
1551877 | CIF | C114.75 H141 N12 | C 2 2 21 | 28.3772; 35.137; 21.3407 90; 90; 90 | 21279 | Tamoghna Mitra; Kim E. Jelfs; Marc Schmidtmann; Adham Ahmed; Samantha Y. Chong; Dave J. Adams; Andrew I. Cooper Molecular shape sorting using molecular organic cages Nature Chemistry, 2013, 5, 276-281 |
1551960 | CIF | C34.48 H34.96 Cl0.96 O14 | C 2 2 21 | 9.8002; 11.4061; 30.952 90; 90; 90 | 3459.9 | Tian Qin; Sarah L. Skraba-Joiner; Zeinab G. Khalil; Richard P. Johnson; Robert J. Capon; John A. Porco Jr Atropselective syntheses of (-) and (+) rugulotrosin A utilizing point-to-axial chirality transfer Nature Chemistry, 2015, 7, 234-240 |
1552617 | CIF | C20 H30 O4 | C 2 2 21 | 7.7029; 10.5851; 43.558 90; 90; 90 | 3551.5 | Niu, Siwen; Xia, Jin-Mei; Li, Zengpeng; Yang, Long-He; Yi, Zhi-Wei; Xie, Chun-Lan; Peng, Guizhen; Luo, Zhu-Hua; Shao, Zongze; Yang, Xian-Wen Aphidicolin Chemistry of the Deep-Sea-Derived Fungus <i>Botryotinia fuckeliana</i> MCCC 3A00494. Journal of natural products, 2019, 82, 2307-2331 |
1553213 | CIF | C17 H25 Cl N2 O2 | C 2 2 21 | 10.351; 11.942; 26.963 90; 90; 90 | 3332.9 | Fu, Jian-Guo; Xu, Guang-Qiang; Ding, Rui; Lin, Guo-Qiang; Sun, Bing-Feng Asymmetric total synthesis of Lycopodium alkaloids α-obscurine, N-desmethyl-α-obscurine, β-obscurine and N-desmethyl-β-obscurine Organic Chemistry Frontiers, 2016, 3, 62 |
1554270 | CIF | C78 H96 N4 O22 | C 2 2 21 | 10.70154; 27.4281; 26.4591 90; 90; 90 | 7766.35 | Li, Wan-Shan; Yang, Yang; Liu, Jun-Jun; Shen, Li; Shi, Zhi; Wu, Jun Scaffold diversity-oriented synthesis of limonoid dimers: discovery of an axially chiral agent within vivoanti-breast cancer activity Organic Chemistry Frontiers, 2018, 5, 1079 |
1554666 | CIF | C33 H22 N4 O2 | C 2 2 21 | 12.0721; 17.9566; 12.2305 90; 90; 90 | 2651.3 | Zhao, Na; Gao, Wangwang; Zhang, Min; Yang, Junfang; Zheng, Xiaoyan; Li, Yue; Cui, Rongrong; Yin, Wei; Li, Nan Regulation of circular dichroism behavior and construction of tunable solid-state circularly polarized luminescence based on BINOL derivatives Materials Chemistry Frontiers, 2019, 3, 1613 |
1554669 | CIF | C48 H30 F6 N4 O2 | C 2 2 21 | 18.4373; 25.7446; 11.6266 90; 90; 90 | 5518.7 | Zhao, Na; Gao, Wangwang; Zhang, Min; Yang, Junfang; Zheng, Xiaoyan; Li, Yue; Cui, Rongrong; Yin, Wei; Li, Nan Regulation of circular dichroism behavior and construction of tunable solid-state circularly polarized luminescence based on BINOL derivatives Materials Chemistry Frontiers, 2019, 3, 1613 |
1554740 | CIF | C43 H36 N4 O9 | C 2 2 21 | 17.41181; 27.6471; 17.61491 90; 90; 90 | 8479.57 | Liu, Xiong-Li; Gong, Yi; Chen, Shuang; Zuo, Xiong; Yao, Zhen; Zhou, Ying Bifunctional oxindole-chromone 4C building block directed asymmetric synthesis of bispirocyclic hexahydroxanthones featuring five contiguous stereocenters and two side-by-side oxindoles Organic Chemistry Frontiers, 2019, 6, 1603 |
1555241 | CIF | C76 H48 O4 | C 2 2 21 | 9.5716; 40.233; 14.5609 90; 90; 90 | 5607.3 | Chen, Jing-Xing; Han, Jian-Wei; Wong, Henry N. C. Synthesis and Chiroptical Properties of Double-Helical (M)- and (P)-o-Oligophenylenes. Organic letters, 2015, 17, 4296-4299 |
1555242 | CIF | C26 H18 O2 | C 2 2 21 | 9.6233; 28.1324; 14.4388 90; 90; 90 | 3908.97 | Chen, Jing-Xing; Han, Jian-Wei; Wong, Henry N. C. Synthesis and Chiroptical Properties of Double-Helical (M)- and (P)-o-Oligophenylenes. Organic letters, 2015, 17, 4296-4299 |
1555243 | CIF | C26 H18 Br2 O2 | C 2 2 21 | 9.5385; 16.362; 14.106 90; 90; 90 | 2201.5 | Chen, Jing-Xing; Han, Jian-Wei; Wong, Henry N. C. Synthesis and Chiroptical Properties of Double-Helical (M)- and (P)-o-Oligophenylenes. Organic letters, 2015, 17, 4296-4299 |
1555413 | CIF | C21 H17 N O5 S2 | C 2 2 21 | 11.289; 10.612; 32.425 90; 90; 90 | 3884.5 | Li, Zequan; Shi, Yian Chiral Phosphine Oxide-Sc(OTf)3 Complex Catalyzed Enantioselective Bromoaminocyclization of 2-Benzofuranylmethyl N-Tosylcarbamates. Approach to a Novel Class of Optically Active Spiro Compounds. Organic letters, 2015, 17, 5752-5755 |
1555746 | CIF | C43 H52 Cl6 N2 O8 | C 2 2 21 | 18.3635; 25.2508; 9.9745 90; 90; 90 | 4625.1 | Garcia, Alfredo; Drown, Bryon S.; Hergenrother, Paul J. Access to a Structurally Complex Compound Collection via Ring Distortion of the Alkaloid Sinomenine. Organic letters, 2016, 18, 4852-4855 |
1555868 | CIF | C90.5 H69 Br4 Cl5 N4 O8 S4 | C 2 2 21 | 20.4233; 28.5691; 33.289 90; 90; 90 | 19423 | Arai, Takayoshi; Miyazaki, Tomoya; Ogawa, Hiroki; Masu, Hyuma PyBidine-Ni(OAc)<sub>2</sub>-Catalyzed Michael/Aldol Reaction of Methyleneindolinones and Thiosalicylaldehydes for Stereochemically Divergent Thiochromanyl-spirooxindoles. Organic letters, 2016, 18, 5824-5827 |
1556373 | CIF | C19 H24 Br2 Cl2 N4 Ni | C 2 2 21 | 14.2034; 11.5066; 14.6836 90; 90; 90 | 2399.8 | Budhai, Asheena; Omondi, Bernard; Ojwach, Stephen O.; Obuah, Collins; Osei-Twum, Emmanuel Y.; Darkwa, James Tandem ethylene oligomerisation and Friedel‒Crafts alkylation of toluene catalysed by bis-(3,5-dimethylpyrazol-1-ylmethyl)benzene nickel(ii) complexes and ethylaluminium dichloride Catalysis Science & Technology, 2013, 3, 3130 |
1558592 | CIF | C154 H182 F12 Ir4 N24 O33 S4 | C 2 2 21 | 21.4001; 56.956; 13.5367 90; 90; 90 | 16499.4 | Dang, Li-Long; Gao, Xiang; Lin, Yue-Jian; Jin, Guo-Xin Selective synthesis and structural transformation between a molecular ring-in-ring architecture and an abnormal trefoil knot Chemical Science, 2020 |
1558858 | CIF | C50 H28 | C 2 2 21 | 11.6264; 30.039; 26.9101 90; 90; 90 | 9398.2 | Zhu, Kaige KZ; Kamochi, Kosuke KK; Kodama, Takuya; Tobisu, Mamoru; Amaya, Toru Chiral cyclic [n]spirobifluorenylenes: carbon nanorings consisting of helically arranged quaterphenyl rods illustrating partial units of woven patterns Chemical Science, 2020 |
1559553 | CIF | C39 H42 Br Cl N2 O6 S | C 2 2 21 | 12.0049; 17.7292; 35.641 90; 90; 90 | 7585.7 | St-Pierre, Gabrielle; Cherney, Alan H.; Chen, Wencan; Dong, Xiaofei; Dornan, Peter K.; Griffin, Daniel J.; Houk, K. N.; Lin, Janice B.; Osgood, Stephen; Silva Elipe, Maria V.; Timmons, Heath C.; Xie, Yong; Tedrow, Jason S.; Thiel, Oliver R.; Smith, Austin G. Accelerated Development of a Scalable Ring-Closing Metathesis to Manufacture AMG 176 Using a Combined High-Throughput Experimentation and Computational Modeling Approach Organic Process Research & Development, 2020 |
1561880 | CIF | C22 H22 Ag2 F12 N6 O4 Sb2 | C 2 2 21 | 11.3985; 22.943; 23.982 90; 90; 90 | 6271.7 | Kuai, Hai-Wei; Cheng, Xiao-Chun; Li, Deng-Hao; Hu, Tao; Zhu, Xiao-Hong Syntheses, characterization and properties of silver, copper and palladium complexes from bis(oxazoline)-containing ligands Journal of Solid State Chemistry, 2015, 228, 65-75 |
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