Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1514075 | CIF | Li0.07 Mn2 O4 | F d -3 m :2 | 8.033; 8.033; 8.033 90; 90; 90 | 518.36 | Mukai, K.; Sugiyama, J.; Kamazawa, K.; Ikedo, Y.; Andreica, D.; Amato, A. Magnetic properties of the chemically delithiated Li(x) Mn2 O4 with 0.07 <= x <= 1 Journal of Solid State Chemistry, 2011, 184, 1096-1104 |
| 1514076 | CIF | Li0.95 Mn2.06 O4 | F d -3 m :2 | 8.2361; 8.2361; 8.2361 90; 90; 90 | 558.68 | Monge, M. A.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514077 | CIF | Li0.2 Mn1.9 O4 | F d -3 m :2 | 8.096; 8.096; 8.096 90; 90; 90 | 530.7 | Monge, M. A.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514078 | CIF | Li0.65 Mn2.08 O4 | F d -3 m :2 | 8.213; 8.213; 8.213 90; 90; 90 | 554 | Monge, M. A.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514079 | CIF | Li0.87 Mn1.98 O4 | F d -3 m :2 | 8.258; 8.258; 8.258 90; 90; 90 | 563.2 | Monge, M. A.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514080 | CIF | Li0.6 Mn2.04 O4 | F d -3 m :2 | 8.233; 8.233; 8.233 90; 90; 90 | 558.1 | Monge, M. A.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514081 | CIF | Li0.1 Mn2.048 O4 | F d -3 m :2 | 8.151; 8.151; 8.151 90; 90; 90 | 541.5 | Monge, M. A.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514082 | CIF | C63 H57 Cl3 N10 O6 | P 1 21/c 1 | 25.3068; 10.567; 21.5706 90; 101.372; 90 | 5655.1 | Kai-Chi Chang; In-Hao Su; Gene-Hsiang Lee; Wen-Sheng Chung Triazole- and azo-coupled calix[4]arene as a highly sensitive chromogenic sensor for Ca2+ and Pb2+ ions Tetrahedron Letters, 2007, 48, 7274-7278 |
| 1514083 | CIF | Li2 O2 | P -6 | 6.305; 6.305; 7.71 90; 90; 120 | 265.433 | Feher, F.; von Wilucki, I.; Dost, G. Ueber die Kristallstruktur des Lithiumperoxyds, Li2 O2 Chemische Berichte, 1953, 86, 1429-1437 |
| 1514084 | CIF | Li2 O2 | P 63/m m c | 3.142; 3.142; 7.65 90; 90; 120 | 65.404 | Föppl, H. Die Kristallstrukturen der Alkaliperoxyde Zeitschrift für anorganische und allgemeine Chemie, 1957, 291, 12-50 |
| 1514085 | CIF | Li2 O2 | P 63/m m c | 3.1525; 3.1525; 3.855 90; 90; 120 | 33.179 | Cota, L. G.; de la Mora, P. On the structure of lithium peroxide Chemische Berichte, 1953, 86, 1429-1437 |
| 1514086 | CIF | Li2 O | F m -3 m | 4.61; 4.61; 4.61 90; 90; 90 | 97.972 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514087 | CIF | Li2 O | F m -3 m | 4.623; 4.623; 4.623 90; 90; 90 | 98.803 | Taylor, D. Thermal expansion data: II. Binary oxides with the fluorite and rutile structure, M O2, and the antifluorite structure M2 O British Ceramic Transactions and Journal, 1984, 83, 32-37 |
| 1514088 | CIF | Li2 O | R -3 m :H | 3.624; 3.624; 7.97 90; 90; 120 | 90.649 | Masaki, N.; Doi, K.; Nasu, S.; Tanifuji, T.; Uchida, K. Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums, Natriums und Kaliums Journal of Nuclear Materials, 1979, 84, 341-342 |
| 1514089 | CIF | Li2 O2 | P 63/m m c | 3.164; 3.164; 7.724 90; 90; 120 | 66.965 | Zhuravlev, Yu. N.; Obolonskaya, O. S. Structure, mechanical stability and chemical bond in alkali metal oxides Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii), 2010, 51, 1005-1013 |
| 1514090 | CIF | Li O2 | P n n m | 3.992; 4.877; 2.961 90; 90; 90 | 57.648 | Zhuravlev, Yu. N.; Obolonskaya, O. S. Structure, mechanical stability and chemical bond in alkali metal oxides Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii), 2010, 51, 1005-1013 |
| 1514091 | CIF | Li O3 | I m m 2 | 3.053; 4.931; 5.197 90; 90; 90 | 78.237 | Zhuravlev, Yu. N.; Obolonskaya, O. S. Structure, mechanical stability and chemical bond in alkali metal oxides Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii), 2010, 51, 1005-1013 |
| 1514092 | CIF | Li2 O | F m -3 m | 4.62; 4.62; 4.62 90; 90; 90 | 98.611 | Zhuravlev, Yu. N.; Obolonskaya, O. S. Structure, mechanical stability and chemical bond in alkali metal oxides Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii), 2010, 51, 1005-1013 |
| 1514093 | CIF | Li2 O | F m -3 m | 4.728; 4.728; 4.728 90; 90; 90 | 105.69 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514094 | CIF | Li2 O | F m -3 m | 4.764; 4.764; 4.764 90; 90; 90 | 108.1 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514095 | CIF | Li2 O | F m -3 m | 4.782; 4.782; 4.782 90; 90; 90 | 109.4 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514096 | CIF | Li2 O | F m -3 m | 4.807; 4.807; 4.807 90; 90; 90 | 111.1 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514097 | CIF | Li2 O | F m -3 m | 4.837; 4.837; 4.837 90; 90; 90 | 113.2 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514098 | CIF | Li2 O | F m -3 m | 4.689; 4.689; 4.689 90; 90; 90 | 103.1 | Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M. Investigation of thermally induced Li+ ion disorder in Li2O using neutron diffraction. Journal of Physics: Condensed Matter, 1991, 3, 4761-4781 |
| 1514099 | CIF | Mn O | F m -3 m | 4.446; 4.446; 4.446 90; 90; 90 | 87.88 | Sasaki, Satoshi; Fujino, Kiyoshi; Takéuchi, Yoshio X-Ray Determination of Electron-Density Distributions in Oxides, MgO, MnO, CoO, and NiO, and Atomic Scattering Factors of their Constituent Atoms Proceedings of the Japan Academy, Series B: Physical and Biological Sciences, 1979, 55, 43-48 |
| 1514100 | CIF | Mn5 O8 | C 1 2/m 1 | 10.347; 5.724; 4.852 90; 109.41; 90 | 271.033 | Oswald, H. R.; Wampetich, M. J. Die Kristallstrukturen von Mn5 O8 und Cd2 Mn3 O8 Helvetica Chimica Acta, 1967, 50, 2023-2034 |
| 1514101 | CIF | Mn O2 | P 42/m n m | 4.388; 4.388; 2.865 90; 90; 90 | 55.16 | Kondrashev, Yu. D.; Zaslavskii, A. I. The structure of the modifications of manganese oxide Izvestiya Akademii Nauk SSSR, Seriya Fizicheskaya, 1951, 15, 179-186 |
| 1514102 | CIF | Mn O2 | P b n m | 4.533; 9.27; 2.866 90; 90; 90 | 120.4 | Bystroem, A. M. The crystal structure of ramsdellite, an orthorhombic modification of Mn O2 Acta Chemica Scandinavica (1-27,1973-42,1988), 1949, 3, 163-173 |
| 1514103 | CIF | Mn2 O3 | P b c a | 9.4118; 9.4177; 9.4233 90; 90; 90 | 835.26 | Norrestam, R. Alpha-manganese(III) oxide - a C-type sesquioxide of orthorhombic symmetry Acta Chemica Scandinavica (1-27,1973-42,1988), 1967, 21, 2871-2884 |
| 1514104 | CIF | Mn3 O4 | P b c m | 3.026; 9.769; 9.568 90; 90; 90 | 282.84 | Kuznetsov, L. M.; Tsvigunov, A. N.; Brudina, K. P. Pressure diagram of manganese(II,III) oxide and crystal structure of the high pressure phase of delta-manganese(II,III) oxide Geokhimiya, 1979, 1979, 254-260 |
| 1514105 | CIF | Mn O | F m -3 m | 4.444; 4.444; 4.444 90; 90; 90 | 87.77 | Kuriyama, M.; Hosoya, S. X-ray measurement of scattering factors of manganese and oxygen in manganous oxide Journal of the Physical Society of Japan, 1962, 17, 1022-1029 |
| 1514106 | CIF | Mn2 O3 | I a -3 | 9.42; 9.42; 9.42 90; 90; 90 | 835.897 | Fert, A. Structure de quelques oxydes de terres rares Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977), 1962, 85, 267-270 |
| 1514107 | CIF | Mn2 O3 | I a -3 | 9.41; 9.41; 9.41 90; 90; 90 | 833.2 | Aminoff, G. Lattice dimensions and space group of braunite Kunglia Svenska Vetenskaps Akademiens Handlingar, 1931, 9, 14-22 |
| 1514108 | CIF | Mn O | F m -3 m | 4.41; 4.41; 4.41 90; 90; 90 | 85.766 | Levi, G. R. The crystal structure of Mn O Rendiconti dell`Istituto Lombardo di Science e Lettere Classe di Science Mathematiche e Naturali, 1924, 57, 619-624 |
| 1514109 | CIF | Mn O2 | P b n m | 4.513; 9.264; 2.859 90; 90; 90 | 119.53 | Miura, H.; Kudou, H.; Choi, J. H.; Hariya, Y. The crystal structure of ramsdellite from Pirika mine Journal of the Faculty of Science, Hokkaido University, Series 4, 1990, 22, 611-617 |
| 1514110 | CIF | Mn O2 | P 42/m n m | 4.4; 4.4; 2.87 90; 90; 90 | 55.563 | John, A. S. Crystal structure of the rutile type Physical Review (1,1893-132,1963/141,1966-188,1969), 1923, 21, 389-389 |
| 1514111 | CIF | Mn O | F m -3 m | 4.444; 4.444; 4.444 90; 90; 90 | 87.765 | Jay, A. H.; Andrews, K. W. Note on oxide systems pertaining to steel - making furnace slags: Fe O - Mn O, Fe O - Mg O, Ca O - Mn O, Mg O - Mn O Journal of the Iron and Steel Institute (London), 1945, 152, 15-18 |
| 1514112 | CIF | Mn2 O7 | P 1 21/c 1 | 6.7956; 16.6868; 9.4539 90; 100.2; 90 | 1055.1 | Simon, A.; Dronskowski, R.; Krebs, B.; Hettich, B. Die Kristallstruktur von Mn2 O7 Angewandte Chemie (German Edition), 1987, 99, 160-161 |
| 1514113 | CIF | Mn2 O3 | I a -3 | 9.43; 9.43; 9.43 90; 90; 90 | 838.562 | Hase, W. Neutronographische Bestimmung der Kristallstrukturparameter von Dy2 O3, Tm2 O3 und alpha-Mn2 O3 Physica Status Solidi, 1963, 3, 446-449 |
| 1514114 | CIF | Mn O | F m -3 m | 4.442; 4.442; 4.442 90; 90; 90 | 87.647 | Barrett, C. A.; Evans, E. B. Solid solubility and lattice parameter of Ni O - Mn O Journal of the American Ceramic Society, 1964, 47, 533-533 |
| 1514115 | CIF | Mn3 O4 | I 41/a m d :2 | 5.765; 5.765; 9.442 90; 90; 90 | 313.81 | Jarosch, D. Crystal structure refinement and reflectance measurements of hausmannite, Mn3 O4 Mineralogy and Petrology, 1987, 37, 15-23 |
| 1514116 | CIF | Mn0.98 O2 | I 4/m | 9.7876; 9.7876; 2.865 90; 90; 90 | 274.459 | Rossouw, M. H.; Liles, D. C.; Thackeray, M. M.; David, W. I. F.; Hull, S. Alpha manganese dioxide for lithium batteries: a structural and electrochemical study Materials Research Bulletin, 1992, 27, 221-230 |
| 1514117 | CIF | Mn O2 | P 42/m n m | 4.4041; 4.4041; 2.8765 90; 90; 90 | 55.793 | Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J. Powder neutron diffraction study of pyrolusite, beta-Mn O2 Australian Journal of Chemistry, 1993, 46, 939-944 |
| 1514118 | CIF | Mn O | F m -3 m | 4.443; 4.443; 4.443 90; 90; 90 | 87.706 | Brooksbank, D.; Andrews, K. W. Thermal expansion of some inclusions found in steels and relation to tessellated stresses Journal of the Iron and Steel Institute (London), 1968, 206, 593-599 |
| 1514119 | CIF | Mn2 O3 | I a -3 | 9.408; 9.408; 9.408 90; 90; 90 | 832.706 | Morozov, I. S.; Kuznetsov, V. G. The crystal structure of Mn2 O3 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1949, 1949, 343-353 |
| 1514120 | CIF | Mn3 O4 | I 41/a m d :1 | 5.763; 5.763; 9.456 90; 90; 90 | 314.054 | Boucher, B.; Buhl, R.; Perrin, M. Proprietes et structure magnetique de Mn3 O4 Journal of Physics and Chemistry of Solids, 1971, 32, 2429-2437 |
| 1514121 | CIF | Mn3 O4 | I 41/a m d :1 | 5.7574; 5.7574; 9.4239 90; 90; 90 | 312.38 | Baron, V.; Gutzmer, J.; Rundloef, H.; Tellgren, R. The influence of iron substitution on the magnetic properties of hausmannite, Mn(2+) (Mn, Fe)2(3+) O4 American Mineralogist, 1998, 83, 786-793 |
| 1514122 | CIF | C48 H38 N6 O5 | P b c a | 18.444; 15.948; 25.573 90; 90; 90 | 7522 | Nakano, Emi; Mutoh, Katsuya; Kobayashi, Yoichi; Abe, Jiro Electrochemistry of photochromic [2.2]paracyclophane-bridged imidazole dimers: rational understanding of the electronic structures. The journal of physical chemistry. A, 2014, 118, 2288-2297 |
| 1514123 | CIF | C38 H58 Fe P2 | P 1 21 1 | 13.1315; 9.8741; 13.7239 90; 103.615; 90 | 1729.46 | Wiegand, Thomas; Eckert, Hellmut; Ren, Jinjun; Brunklaus, Gunther; Fröhlich, Roland; Daniliuc, Constantin G.; Lübbe, Gerrit; Bussmann, Kathrin; Kehr, Gerald; Erker, Gerhard; Grimme, Stefan Indirect "no-bond" (31)p···(31)p spin-spin couplings in p,p-[3]ferrocenophanes: insights from solid-state NMR spectroscopy and DFT calculations. The journal of physical chemistry. A, 2014, 118, 2316-2331 |
| 1514124 | CIF | C38 H46 Fe P2 | P 1 21 1 | 13.2558; 9.2386; 13.4456 90; 99.992; 90 | 1621.64 | Wiegand, Thomas; Eckert, Hellmut; Ren, Jinjun; Brunklaus, Gunther; Fröhlich, Roland; Daniliuc, Constantin G.; Lübbe, Gerrit; Bussmann, Kathrin; Kehr, Gerald; Erker, Gerhard; Grimme, Stefan Indirect "no-bond" (31)p···(31)p spin-spin couplings in p,p-[3]ferrocenophanes: insights from solid-state NMR spectroscopy and DFT calculations. The journal of physical chemistry. A, 2014, 118, 2316-2331 |
| 1514125 | CIF | C39 H48 Cl2 Fe P2 | P b c a | 13.4011; 21.5414; 48.6745 90; 90; 90 | 14051.3 | Wiegand, Thomas; Eckert, Hellmut; Ren, Jinjun; Brunklaus, Gunther; Fröhlich, Roland; Daniliuc, Constantin G.; Lübbe, Gerrit; Bussmann, Kathrin; Kehr, Gerald; Erker, Gerhard; Grimme, Stefan Indirect "no-bond" (31)p···(31)p spin-spin couplings in p,p-[3]ferrocenophanes: insights from solid-state NMR spectroscopy and DFT calculations. The journal of physical chemistry. A, 2014, 118, 2316-2331 |
| 1514126 | CIF | C38 H58 Fe P2 | P -1 | 11.9515; 12.1683; 14.2621 110.684; 97.566; 114.389 | 1670.91 | Wiegand, Thomas; Eckert, Hellmut; Ren, Jinjun; Brunklaus, Gunther; Fröhlich, Roland; Daniliuc, Constantin G.; Lübbe, Gerrit; Bussmann, Kathrin; Kehr, Gerald; Erker, Gerhard; Grimme, Stefan Indirect "no-bond" (31)p···(31)p spin-spin couplings in p,p-[3]ferrocenophanes: insights from solid-state NMR spectroscopy and DFT calculations. The journal of physical chemistry. A, 2014, 118, 2316-2331 |
| 1514127 | CIF | C14 H15 N3 O3 | P -1 | 10.16; 10.3036; 14.0553 99.674; 96.774; 97.811 | 1422 | Zencirci, Neslihan; Griesser, Ulrich J.; Gelbrich, Thomas; Kahlenberg, Volker; Jetti, Ram K. R.; Apperley, David C.; Harris, Robin K. New solvates of an old drug compound (phenobarbital): structure and stability. The journal of physical chemistry. B, 2014, 118, 3267-3280 |
| 1514128 | CIF | C13 H15 N3 O5 | P -1 | 10.2543; 10.4086; 13.709 98.774; 96.171; 98.962 | 1415.5 | Zencirci, Neslihan; Griesser, Ulrich J.; Gelbrich, Thomas; Kahlenberg, Volker; Jetti, Ram K. R.; Apperley, David C.; Harris, Robin K. New solvates of an old drug compound (phenobarbital): structure and stability. The journal of physical chemistry. B, 2014, 118, 3267-3280 |
| 1514129 | CIF | C13 H14 Cl2 N2 O3 | P 1 21/n 1 | 8.698; 11.9681; 14.259 90; 97.47; 90 | 1471.74 | Zencirci, Neslihan; Griesser, Ulrich J.; Gelbrich, Thomas; Kahlenberg, Volker; Jetti, Ram K. R.; Apperley, David C.; Harris, Robin K. New solvates of an old drug compound (phenobarbital): structure and stability. The journal of physical chemistry. B, 2014, 118, 3267-3280 |
| 1514130 | CIF | C14 H16 N2 O4 | P 1 21/n 1 | 6.86417; 11.9645; 16.6842 90; 98.071; 90 | 1356.64 | Zencirci, Neslihan; Griesser, Ulrich J.; Gelbrich, Thomas; Kahlenberg, Volker; Jetti, Ram K. R.; Apperley, David C.; Harris, Robin K. New solvates of an old drug compound (phenobarbital): structure and stability. The journal of physical chemistry. B, 2014, 118, 3267-3280 |
| 1514131 | CIF | C16 H20 N2 O5 | P 1 21/n 1 | 10.6052; 10.5502; 14.681 90; 92.028; 90 | 1641.58 | Zencirci, Neslihan; Griesser, Ulrich J.; Gelbrich, Thomas; Kahlenberg, Volker; Jetti, Ram K. R.; Apperley, David C.; Harris, Robin K. New solvates of an old drug compound (phenobarbital): structure and stability. The journal of physical chemistry. B, 2014, 118, 3267-3280 |
| 1514132 | CIF | C16 H20 N2 O5 | P 1 21/c 1 | 17.639; 10.4165; 18.374 90; 108.281; 90 | 3205.6 | Zencirci, Neslihan; Griesser, Ulrich J.; Gelbrich, Thomas; Kahlenberg, Volker; Jetti, Ram K. R.; Apperley, David C.; Harris, Robin K. New solvates of an old drug compound (phenobarbital): structure and stability. The journal of physical chemistry. B, 2014, 118, 3267-3280 |
| 1514133 | CIF | C37 H28 Al F15 N2 | P -1 | 9.8638; 10.5358; 18.0155 81.532; 77.639; 84.01 | 1803.74 | Jia, Yin-Bao; Wang, Yan-Bo; Ren, Wei-Min; Xu, Tieqi; Wang, Jing; Lu, Xiao-Bing Mechanistic Aspects of Initiation and Deactivation inN-Heterocyclic Olefin Mediated Polymerization of Acrylates with Alane as Activator Macromolecules, 2014, 47, 1966 |
| 1514134 | CIF | C46 H38 Al F15 N2 | P -1 | 11.277; 11.709; 18 105; 103.215; 102.156 | 2141 | Jia, Yin-Bao; Wang, Yan-Bo; Ren, Wei-Min; Xu, Tieqi; Wang, Jing; Lu, Xiao-Bing Mechanistic Aspects of Initiation and Deactivation inN-Heterocyclic Olefin Mediated Polymerization of Acrylates with Alane as Activator Macromolecules, 2014, 47, 1966 |
| 1514135 | CIF | C40 H26 Al F15 N2 | P 1 21/c 1 | 10.2014; 17.3415; 20.5293 90; 96.982; 90 | 3604.9 | Jia, Yin-Bao; Wang, Yan-Bo; Ren, Wei-Min; Xu, Tieqi; Wang, Jing; Lu, Xiao-Bing Mechanistic Aspects of Initiation and Deactivation inN-Heterocyclic Olefin Mediated Polymerization of Acrylates with Alane as Activator Macromolecules, 2014, 47, 1966 |
| 1514137 | CIF | C27 H35 Cl3 Fe N2 O | P b c a | 15.98; 14.393; 24.368 90; 90; 90 | 5604.6 | Hennessy, Elisabeth T.; Liu, Richard Y.; Iovan, Diana A.; Duncan, Ryan A.; Betley, Theodore A. Iron-mediated intermolecular N-group transfer chemistry with olefinic substrates Chemical Science, 2014, 5, 1526 |
| 1514138 | CIF | C18 H17 Cl O4 | P 1 21 1 | 6.6348; 11.6431; 10.7797 90; 99.155; 90 | 822.12 | Manna, Madhu Sudan; Mukherjee, Santanu Remarkable influence of secondary catalyst site on enantioselective desymmetrization of cyclopentenedione Chemical Science, 2014, 5, 1627 |
| 1514139 | CIF | C17 H18 O2 | P 21 21 21 | 6.569; 13.286; 17.05 90; 90; 90 | 1488 | Manna, Madhu Sudan; Mukherjee, Santanu Remarkable influence of secondary catalyst site on enantioselective desymmetrization of cyclopentenedione Chemical Science, 2014, 5, 1627 |
| 1514140 | CIF | C18 H15 Cl O4 | P 21 21 21 | 6.465; 16.927; 29.143 90; 90; 90 | 3189 | Manna, Madhu Sudan; Mukherjee, Santanu Remarkable influence of secondary catalyst site on enantioselective desymmetrization of cyclopentenedione Chemical Science, 2014, 5, 1627 |
| 1514143 | CIF | C26 H21 Co F6 N5 O6 S2 | P -1 | 8.0983; 12.4502; 15.5631 105.76; 103.114; 101.124 | 1415.5 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514144 | CIF | C33 H26.5 Co F12 N7.5 O6 S2 | P -1 | 16.288; 16.463; 17.02 62.683; 83.145; 83.634 | 4017.8 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514145 | CIF | C27 H22 Co F6 N6 O7 S2 | P -1 | 8.3555; 13.6865; 15.1917 116.451; 94.117; 90.678 | 1549.54 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514146 | CIF | C25 H20 Co F6 N4 O6 S2 | P 1 21/n 1 | 12.0052; 17.117; 13.5392 90; 99.567; 90 | 2743.5 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514147 | CIF | C27 H23 Co F6 N5 O6 S2 | P 1 21/c 1 | 12.8142; 16.9334; 13.8652 90; 98.362; 90 | 2976.6 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514148 | CIF | C26 H28 Co F6 N4 O9 S2 | P -1 | 9.6468; 11.9557; 14.9502 105.694; 105.787; 100.066 | 1538.89 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514149 | CIF | C30.5 H27 Co F6 N6 O6 S2 | I 1 2/a 1 | 24.9411; 11.4329; 26.1884 90; 116.585; 90 | 6678.1 | Khnayzer, R. S.; Thoi, V. S.; Nippe, M.; King, A. E.; Jurss, J. W.; El Roz, K. A.; Long, J. R.; Chang, C. J.; Castellano, F. N. Towards a comprehensive understanding of visible-light photogeneration of hydrogen from water using cobalt(ii) polypyridyl catalysts Energy & Environmental Science, 2014, 7, 1477 |
| 1514150 | CIF | C30 H30 Cu3 O24 | P -3 m 1 | 18.65; 18.65; 6.8329 90; 90; 120 | 2058.2 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514151 | CIF | C34.5 H36 Cu3 O22.5 | P -3 m 1 | 18.695; 18.695; 6.9489 90; 90; 120 | 2103.3 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514152 | CIF | C33.5 H32 Cu3 O21.5 | P -3 m 1 | 18.7034; 18.7034; 6.878 90; 90; 120 | 2083.69 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514153 | CIF | C35 H38 Cu3 O23 | P -3 m 1 | 18.6631; 18.6631; 6.9006 90; 90; 120 | 2081.5 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514154 | CIF | C38 H50 Cu3 O26 | P -3 m 1 | 18.5495; 18.5495; 6.8063 90; 90; 120 | 2028.2 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514155 | CIF | C33 H32 Cu3 O22 | P -3 m 1 | 18.577; 18.577; 6.8406 90; 90; 120 | 2044.4 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514156 | CIF | C36 H40 Cu3 O23 | P -3 m 1 | 18.459; 18.459; 6.7489 90; 90; 120 | 1991.5 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514157 | CIF | C30 H37 Cu3 O27.5 | P -3 m 1 | 18.623; 18.623; 6.8973 90; 90; 120 | 2071.6 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514158 | CIF | C37 H32.5 Cu3 N3.5 O20 | P -3 m 1 | 18.5488; 18.5488; 6.9375 90; 90; 120 | 2067.1 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514159 | CIF | C35 H31 Cu3 N2.5 O21 | P -3 m 1 | 18.5877; 18.5877; 6.874 90; 90; 120 | 2056.8 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514160 | CIF | C33 H35 Cu3 N O21.5 | P -3 m 1 | 18.626; 18.626; 6.8687 90; 90; 120 | 2063.7 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514161 | CIF | C32 H32 Cu3 N O22 | P -3 m 1 | 18.577; 18.577; 6.841 90; 90; 120 | 2044.6 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514162 | CIF | C38 H40 Cu3 O25 | P -3 m 1 | 18.542; 18.542; 6.8114 90; 90; 120 | 2028.1 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514163 | CIF | C42 H48 Cu3 O27 | P -3 m 1 | 18.2591; 18.2591; 6.6274 90; 90; 120 | 1913.5 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514164 | CIF | C34 H32 Cu3 O23 | P -3 m 1 | 17.991; 17.991; 6.5371 90; 90; 120 | 1832.4 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514165 | CIF | C18 H26 Cu3 O22 | F m -3 m | 26.315; 26.315; 26.315 90; 90; 90 | 18223 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514166 | CIF | C18 H38 Cu3 O28 | F m -3 m | 26.37; 26.37; 26.37 90; 90; 90 | 18337 | McKellar, Scott C.; Graham, Alexander J.; Allan, David R.; Mohideen, M Infas H; Morris, Russell E.; Moggach, Stephen A. The effect of pressure on the post-synthetic modification of a nanoporous metal-organic framework. Nanoscale, 2014, 6, 4163-4173 |
| 1514167 | CIF | C21 H20 N9 O10 Sm | P 1 21/c 1 | 6.0157; 21.542; 18.412 90; 92.247; 90 | 2384.2 | Ahmad, Waqar; Zhang, Lijuan; Zhou, Yunshan A series of mononuclear lanthanide complexes featuring 3-D supramolecular networks: synthesis, characterization and luminescent properties for sensing guest molecules. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 660-670 |
| 1514168 | CIF | C21 H20 N9 O10 Tb | P 1 21/c 1 | 5.9758; 21.4942; 18.3468 90; 91.887; 90 | 2355.3 | Ahmad, Waqar; Zhang, Lijuan; Zhou, Yunshan A series of mononuclear lanthanide complexes featuring 3-D supramolecular networks: synthesis, characterization and luminescent properties for sensing guest molecules. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 660-670 |
| 1514169 | CIF | C20 H19 O7 P | P -1 | 9.2111; 9.985; 10.545 95.976; 90.822; 105.171 | 930.09 | Morel, Flavien L.; Ranocchiari, Marco; van Bokhoven, Jeroen A. Synthesis and Characterization of Phosphine-Functionalized Metal–Organic Frameworks Based on MOF-5 and MIL-101 Topologies Industrial & Engineering Chemistry Research, 2014, 53, 9120 |
| 1514170 | CIF | C28 H38 O10 | P 1 21 1 | 14.8427; 12.9239; 15.4124 90; 118.131; 90 | 2607.2 | Xia, Hong-Min; Li, Chuang-Jun; Yang, Jing-Zhi; Ma, Jie; Chen, Xiao-Guang; Zhang, Dan; Li, Li; Zhang, Dong-Ming A,D-seco-Limonoids from the Stems of Clausena emarginata. Journal of natural products, 2014, 77, 784-791 |
| 1514171 | CIF | C29.679 H32.144 O11.107 | P 1 21/c 1 | 10.8156; 19.5038; 13.2864 90; 93.594; 90 | 2797.2 | Nagasawa, Ikuko; Kaneko, Akira; Suzuki, Toshihiro; Nishio, Kazuto; Kinoshita, Kaoru; Shiro, Motto; Koyama, Kiyotaka Potential Anti-angiogenesis Effects of p-Terphenyl Compounds from Polyozellus multiplex. Journal of natural products, 2014, 77, 963-968 |
| 1514172 | CIF | C9 H13 Cl O4 | P 1 21 1 | 9.6443; 4.7764; 11.5683 90; 94.929; 90 | 530.92 | Chang, Ya-Chih; Lu, Chung-Kuang; Chiang, Yin-Ru; Wang, Guei-Jane; Ju, Yu-Ming; Kuo, Yueh-Hsiung; Lee, Tzong-Huei Diterpene Glycosides and Polyketides from Xylotumulus gibbisporus. Journal of natural products, 2014, 77, 751-757 |
| 1514173 | CIF | C20 H20 O6 | P 1 21 1 | 10.8732; 6.6552; 12.7886 90; 105.053; 90 | 893.67 | Bautista, Elihú; Toscano, Rubén A; Ortega, Alfredo 5,10-seco-neo-Clerodanes and neo-Clerodanes from Salvia microphylla. Journal of natural products, 2014, 77, 1088-1092 |
| 1514174 | CIF | C20 H28 O4 | P 21 21 21 | 8.227; 11.0537; 18.858 90; 90; 90 | 1714.9 | Feng, Yu; Ren, Fengxia; Niu, Shubin; Wang, Lin; Li, Li; Liu, Xingzhong; Che, Yongsheng Guanacastane Diterpenoids from the Plant Endophytic Fungus Cercospora sp. Journal of natural products, 2014, 77, 873-881 |
| 1514175 | CIF | C40 H50 O8 | C 1 2 1 | 12.8255; 11.1968; 12.6545 90; 107.183; 90 | 1736.13 | Feng, Yu; Ren, Fengxia; Niu, Shubin; Wang, Lin; Li, Li; Liu, Xingzhong; Che, Yongsheng Guanacastane Diterpenoids from the Plant Endophytic Fungus Cercospora sp. Journal of natural products, 2014, 77, 873-881 |
| 1514176 | CIF | C21 H22 O10 | C 1 c 1 | 4.3655; 49.452; 8.9782 90; 91.731; 90 | 1937.4 | Li, Hanxiang; Jiang, Jieyi; Liu, Zhaoming; Lin, Shaoe; Xia, Guoping; Xia, Xuekui; Ding, Bo; He, Lei; Lu, Yongjun; She, Zhigang Peniphenones A-D from the Mangrove Fungus Penicillium dipodomyicola HN4-3A as Inhibitors of Mycobacterium tuberculosis Phosphatase MptpB. Journal of natural products, 2014, 77, 800-806 |
| 1514177 | CIF | C15 H16 O6 | P 21 21 21 | 4.5279; 15.4658; 19.9377 90; 90; 90 | 1396.19 | Li, Hanxiang; Jiang, Jieyi; Liu, Zhaoming; Lin, Shaoe; Xia, Guoping; Xia, Xuekui; Ding, Bo; He, Lei; Lu, Yongjun; She, Zhigang Peniphenones A-D from the Mangrove Fungus Penicillium dipodomyicola HN4-3A as Inhibitors of Mycobacterium tuberculosis Phosphatase MptpB. Journal of natural products, 2014, 77, 800-806 |
| 1514178 | CIF | C19 H24 O5 | P 1 21/c 1 | 21.945; 15.45; 10.384 90; 103.603; 90 | 3421.9 | Li, Hanxiang; Jiang, Jieyi; Liu, Zhaoming; Lin, Shaoe; Xia, Guoping; Xia, Xuekui; Ding, Bo; He, Lei; Lu, Yongjun; She, Zhigang Peniphenones A-D from the Mangrove Fungus Penicillium dipodomyicola HN4-3A as Inhibitors of Mycobacterium tuberculosis Phosphatase MptpB. Journal of natural products, 2014, 77, 800-806 |
| 1514179 | CIF | C18 H18 O6 | P 21 21 21 | 8.3424; 11.46; 16.107 90; 90; 90 | 1539.9 | Li, Hanxiang; Jiang, Jieyi; Liu, Zhaoming; Lin, Shaoe; Xia, Guoping; Xia, Xuekui; Ding, Bo; He, Lei; Lu, Yongjun; She, Zhigang Peniphenones A-D from the Mangrove Fungus Penicillium dipodomyicola HN4-3A as Inhibitors of Mycobacterium tuberculosis Phosphatase MptpB. Journal of natural products, 2014, 77, 800-806 |
| 1514180 | CIF | C34 H52 O5 | P 1 21 1 | 6.9978; 11.1764; 20.4376 90; 98.054; 90 | 1582.66 | Peng, Xing-Rong; Liu, Jie-Qing; Wang, Cui-Fang; Li, Xu-Yang; Shu, Yi; Zhou, Lin; Qiu, Ming-Hua Hepatoprotective Effects of Triterpenoids from Ganoderma cochlear. Journal of natural products, 2014, 77, 737-743 |
| 1514181 | CIF | C120 H216 Au36 S24 | P 1 21/n 1 | 18.5437; 29.3874; 32.6577 90; 96.612; 90 | 17678.5 | Das, Anindita; Liu, Chong; Zeng, Chenjie; Li, Gao; Li, Tao; Rosi, Nathaniel L.; Jin, Rongchao Cyclopentanethiolato-Protected Au36(SC5H9)24 Nanocluster: Crystal Structure and Implications for the Steric and Electronic Effects of Ligand. The journal of physical chemistry. A, 2014, 118, 8264-8269 |
| 1514182 | CIF | C8 H16 N2 O3 | P 61 | 14.4465; 14.4465; 10.0082 90; 90; 120 | 1808.89 | Altheimer, Benjamin D; Mehta, Manish A Effects of structural differences on the NMR chemical shifts in isostructural dipeptides. The journal of physical chemistry. A, 2014, 118, 2618-2628 |
| 1514183 | CIF | C6 Al K O5 Si2 | P 1 21/a 1 | 10.1307; 9.1486; 10.6002 90; 106.526; 90 | 941.86 | Bellettato, Michela; Bonoldi, Lucia; Cruciani, Giuseppe; Flego, Cristina; Guidetti, Stefania; Millini, Roberto; Montanari, Erica; Parker, Wallace O’Neil; Zanardi, Stefano Flexible Structure of a Thermally Stable Hybrid Aluminosilicate Built with Only the Three-Ring Unit The Journal of Physical Chemistry C, 2014, 118, 7458 |
| 1514184 | CIF | C6 Al K0.883 O7.255 Si2 | P 1 21/a 1 | 10.831; 10.4782; 10.6059 90; 109.924; 90 | 1131.61 | Bellettato, Michela; Bonoldi, Lucia; Cruciani, Giuseppe; Flego, Cristina; Guidetti, Stefania; Millini, Roberto; Montanari, Erica; Parker, Wallace O’Neil; Zanardi, Stefano Flexible Structure of a Thermally Stable Hybrid Aluminosilicate Built with Only the Three-Ring Unit The Journal of Physical Chemistry C, 2014, 118, 7458 |
| 1514185 | CIF | C15 H12 B F2 N O | P 1 21/a 1 | 14.493; 6.0834; 15.009 90; 107.679; 90 | 1260.8 | Yoshii, Ryousuke; Tanaka, Kazuo; Chujo, Yoshiki Conjugated Polymers Based on Tautomeric Units: Regulation of Main-Chain Conjugation and Expression of Aggregation Induced Emission Property via Boron-Complexation Macromolecules, 2014, 47, 2268 |
| 1514186 | CIF | C15 H13 N O | P 1 21/n 1 | 9.5137; 13.3349; 18.7322 90; 105.908; 90 | 2285.4 | Yoshii, Ryousuke; Tanaka, Kazuo; Chujo, Yoshiki Conjugated Polymers Based on Tautomeric Units: Regulation of Main-Chain Conjugation and Expression of Aggregation Induced Emission Property via Boron-Complexation Macromolecules, 2014, 47, 2268 |
| 1514187 | CIF | C20 H14 N2 O | I 41/a :2 | 21.452; 21.452; 13.2 90; 90; 90 | 6074 | Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells. Molecular pharmaceutics, 2014, 11, 1151 |
| 1514188 | CIF | C18 H17 N O2 | P -1 | 7.432; 10.432; 10.526 74.242; 77.299; 72.252 | 739.6 | Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells. Molecular pharmaceutics, 2014, 11, 1151 |
| 1514189 | CIF | C17 H15 N O2 | P 1 21/n 1 | 9.952; 13.391; 10.197 90; 99.739; 90 | 1339.3 | Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells. Molecular pharmaceutics, 2014, 11, 1151 |
| 1514190 | CIF | C36 H28 Cu N2 O4 | C 1 2/c 1 | 24.782; 7.293; 15.647 90; 92.667; 90 | 2824.9 | Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells. Molecular pharmaceutics, 2014, 11, 1151 |
| 1514191 | CIF | C34 H24 Cu N2 O4 | P 1 21/c 1 | 10.167; 21.499; 12.025 90; 93.542; 90 | 2623.4 | Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells. Molecular pharmaceutics, 2014, 11, 1151 |
| 1514192 | CIF | C38 H46 O2 | P 1 21/c 1 | 13.884; 8.9553; 24.8969 90; 104.109; 90 | 3002.2 | Taylor, Rupert G D; Carta, Mariolino; Bezzu, C Grazia; Walker, Jonathan; Msayib, Kadhum J; Kariuki, Benson M; McKeown, Neil B Triptycene-based organic molecules of intrinsic microporosity. Organic letters, 2014, 16, 1848-1851 |
| 1514193 | CIF | C38 H46 O2 | P 1 21/n 1 | 19.538; 8.798; 20.033 90; 114.939; 90 | 3122 | Taylor, Rupert G D; Carta, Mariolino; Bezzu, C Grazia; Walker, Jonathan; Msayib, Kadhum J; Kariuki, Benson M; McKeown, Neil B Triptycene-based organic molecules of intrinsic microporosity. Organic letters, 2014, 16, 1848-1851 |
| 1514194 | CIF | C163.5 H165.5 Cl16.5 N2 O8 | P 1 21/n 1 | 22.33; 25.38; 30.52 90; 110.84; 90 | 16165 | Taylor, Rupert G D; Carta, Mariolino; Bezzu, C Grazia; Walker, Jonathan; Msayib, Kadhum J; Kariuki, Benson M; McKeown, Neil B Triptycene-based organic molecules of intrinsic microporosity. Organic letters, 2014, 16, 1848-1851 |
| 1514195 | CIF | C33 H41 Br O5 | P 1 21/n 1 | 10.3108; 21.7962; 13.5496 90; 96.881; 90 | 3023.2 | Xu, Shiyan; Gu, Jixiang; Li, Huilin; Ma, Donghui; Xie, Xingang; She, Xuegong Enantioselective total synthesis of (-)-walsucochin B. Organic letters, 2014, 16, 1996-1999 |
| 1514196 | CIF | C23 H15 B Cl2 F2 N4 | P 1 21/c 1 | 10.4601; 21.5168; 9.1282 90; 91.501; 90 | 2053.8 | Jiang, Ting; Zhang, Ping; Yu, Changjiang; Yin, Jian; Jiao, Lijuan; Dai, En; Wang, Jun; Wei, Yun; Mu, Xiaolong; Hao, Erhong Straightforward Synthesis of Oligopyrroles through a Regioselective SNAr Reaction of Pyrroles and Halogenated Boron Dipyrrins. Organic letters, 2014, 16, 1952-1955 |
| 1514197 | CIF | C27 H23 B Cl2 F2 N4 | C 1 2/c 1 | 27.109; 5.0418; 37.898 90; 106.676; 90 | 4962 | Jiang, Ting; Zhang, Ping; Yu, Changjiang; Yin, Jian; Jiao, Lijuan; Dai, En; Wang, Jun; Wei, Yun; Mu, Xiaolong; Hao, Erhong Straightforward Synthesis of Oligopyrroles through a Regioselective SNAr Reaction of Pyrroles and Halogenated Boron Dipyrrins. Organic letters, 2014, 16, 1952-1955 |
| 1514198 | CIF | C27 H24 Cl2 N4 | A b a 2 | 26.511; 27.724; 7.4876 90; 90; 90 | 5503.3 | Jiang, Ting; Zhang, Ping; Yu, Changjiang; Yin, Jian; Jiao, Lijuan; Dai, En; Wang, Jun; Wei, Yun; Mu, Xiaolong; Hao, Erhong Straightforward Synthesis of Oligopyrroles through a Regioselective SNAr Reaction of Pyrroles and Halogenated Boron Dipyrrins. Organic letters, 2014, 16, 1952-1955 |
| 1514199 | CIF | C30 H16 | P 1 21/c 1 | 9.6985; 25.546; 17.0217 90; 105.367; 90 | 4066.5 | Nobusue, Shunpei; Yamane, Hiroshi; Miyoshi, Hirokazu; Tobe, Yoshito [4.2](2,2')(2,2')biphenylophanetriyne: a twisted biphenylophane with a highly distorted diacetylene bridge. Organic letters, 2014, 16, 1940-1943 |
| 1514200 | CIF | C16 H19 N3 O | P 1 21/c 1 | 6.6165; 18.9916; 11.2416 90; 93.587; 90 | 1409.83 | Vekariya, Rakesh H; Liu, Ruzhang; Aubé, Jeffrey A concomitant allylic azide rearrangement/intramolecular azide-alkyne cycloaddition sequence. Organic letters, 2014, 16, 1844-1847 |
| 1514201 | CIF | C16 H19 N3 O | P 1 21/c 1 | 6.614; 18.9847; 11.2005 90; 90.675; 90 | 1406.29 | Vekariya, Rakesh H; Liu, Ruzhang; Aubé, Jeffrey A concomitant allylic azide rearrangement/intramolecular azide-alkyne cycloaddition sequence. Organic letters, 2014, 16, 1844-1847 |
| 1514202 | CIF | C18 H21 N3 O | P b c a | 15.5492; 10.0774; 19.0625 90; 90; 90 | 2987 | Vekariya, Rakesh H; Liu, Ruzhang; Aubé, Jeffrey A concomitant allylic azide rearrangement/intramolecular azide-alkyne cycloaddition sequence. Organic letters, 2014, 16, 1844-1847 |
| 1514203 | CIF | C18 H21 N3 O | P 1 21/n 1 | 6.7407; 16.6911; 13.8906 90; 98.6652; 90 | 1544.99 | Vekariya, Rakesh H; Liu, Ruzhang; Aubé, Jeffrey A concomitant allylic azide rearrangement/intramolecular azide-alkyne cycloaddition sequence. Organic letters, 2014, 16, 1844-1847 |
| 1514204 | CIF | C22 H31 N3 O2 | P 1 21/c 1 | 9.2253; 10.5676; 21.0165 90; 97.559; 90 | 2031.08 | Vekariya, Rakesh H; Liu, Ruzhang; Aubé, Jeffrey A concomitant allylic azide rearrangement/intramolecular azide-alkyne cycloaddition sequence. Organic letters, 2014, 16, 1844-1847 |
| 1514205 | CIF | C24 H32 O5 | P 21 21 21 | 6.4163; 14.742; 21.517 90; 90; 90 | 2035.3 | Wang, Sha-Sha; Shi, Yong; Tian, Wei-Sheng Highly efficient and scalable synthesis of clionamine d. Organic letters, 2014, 16, 2177-2179 |
| 1514206 | CIF | C30 H23 N O2 S | P 1 21/n 1 | 18.5052; 10.5619; 24.279 90; 104.446; 90 | 4595.3 | Paul, Kartick; Bera, Krishnendu; Jalal, Swapnadeep; Sarkar, Soumen; Jana, Umasish Fe-Catalyzed Novel Domino Isomerization/Cyclodehydration of Substituted 2-[(Indoline-3-ylidene)(methyl)]benzaldehyde Derivatives: An Efficient Approach toward Benzo[b]carbazole Derivatives. Organic letters, 2014, 16, 2166-2169 |
| 1514207 | CIF | C31 H31 N O3 | P 21 21 21 | 9.1082; 9.9885; 27.957 90; 90; 90 | 2543.5 | Curto, John M; Dickstein, Joshua S; Berritt, Simon; Kozlowski, Marisa C Asymmetric Synthesis of α-Allyl-α-Aryl α-Amino Acids by Tandem Alkylation/π-Allylation of α-Iminoesters. Organic letters, 2014, 16, 1948-1951 |
| 1514208 | CIF | C16 H15 N O3 | P -1 | 9.0234; 9.1282; 10.3014 78.99; 70.106; 65.402 | 724.2 | Curto, John M; Dickstein, Joshua S; Berritt, Simon; Kozlowski, Marisa C Asymmetric Synthesis of α-Allyl-α-Aryl α-Amino Acids by Tandem Alkylation/π-Allylation of α-Iminoesters. Organic letters, 2014, 16, 1948-1951 |
| 1514209 | CIF | C28 H33 N3 O9 S2 | C 1 2 1 | 29.758; 6.786; 16.7258 90; 117.029; 90 | 3008.7 | Zhou, Jing; Yeung, Ying-Yeung N-Bromosuccinimide-Induced Aminocyclization-Aziridine Ring-Expansion Cascade: An Asymmetric and Highly Stereoselective Approach toward the Synthesis of Azepane. Organic letters, 2014, 16, 2134-2137 |
| 1514210 | CIF | C24 H31 Br N2 O2 | P 1 21 1 | 11.0231; 6.0412; 17.742 90; 106.574; 90 | 1132.4 | Zhou, Jing; Yeung, Ying-Yeung N-Bromosuccinimide-Induced Aminocyclization-Aziridine Ring-Expansion Cascade: An Asymmetric and Highly Stereoselective Approach toward the Synthesis of Azepane. Organic letters, 2014, 16, 2134-2137 |
| 1514211 | CIF | C23 H35 N O5 | P 1 21 1 | 15.553; 9.326; 32.444 90; 94.255; 90 | 4693 | Zhang, Xiaofei; Cividino, Pascale; Poisson, Jean-François; Shpak-Kraievskyi, Pavlo; Laurent, Mathieu Y; Martel, Arnaud; Dujardin, Gilles; Py, Sandrine Asymmetric Synthesis of α,α-Disubstituted Amino Acids by Cycloaddition of (E)-Ketonitrones with Vinyl Ethers. Organic letters, 2014, 16, 1936-1939 |
| 1514212 | CIF | C18 H25 N O6 | P 1 | 6.5131; 7.9315; 9.954 90.89; 94.28; 112.44 | 473.4 | Zhang, Xiaofei; Cividino, Pascale; Poisson, Jean-François; Shpak-Kraievskyi, Pavlo; Laurent, Mathieu Y; Martel, Arnaud; Dujardin, Gilles; Py, Sandrine Asymmetric Synthesis of α,α-Disubstituted Amino Acids by Cycloaddition of (E)-Ketonitrones with Vinyl Ethers. Organic letters, 2014, 16, 1936-1939 |
| 1514213 | CIF | C28 H44 N O11 | C 1 2 1 | 26.5845; 9.3012; 14.1691 90; 112.536; 90 | 3236.03 | Zhang, Xiaofei; Cividino, Pascale; Poisson, Jean-François; Shpak-Kraievskyi, Pavlo; Laurent, Mathieu Y; Martel, Arnaud; Dujardin, Gilles; Py, Sandrine Asymmetric Synthesis of α,α-Disubstituted Amino Acids by Cycloaddition of (E)-Ketonitrones with Vinyl Ethers. Organic letters, 2014, 16, 1936-1939 |
| 1514214 | CIF | C14 H20 F3 N O7 | P 1 21 1 | 9.2339; 11.8223; 17.1508 90; 98.572; 90 | 1851.4 | Zhang, Xiaofei; Cividino, Pascale; Poisson, Jean-François; Shpak-Kraievskyi, Pavlo; Laurent, Mathieu Y; Martel, Arnaud; Dujardin, Gilles; Py, Sandrine Asymmetric Synthesis of α,α-Disubstituted Amino Acids by Cycloaddition of (E)-Ketonitrones with Vinyl Ethers. Organic letters, 2014, 16, 1936-1939 |
| 1514215 | CIF | C26 H21 N O2 S | P 1 21/n 1 | 13.4387; 11.3409; 13.8597 90; 97.954; 90 | 2092 | Tatton, Matthew R; Simpson, Iain; Donohoe, Timothy J De novo synthesis of multisubstituted aryl amines using alkene cross metathesis. Organic letters, 2014, 16, 1920-1923 |
| 1514216 | CIF | C26 H21 N O2 S | P -1 | 13.287; 11.2749; 13.4828 87.937; 97.022; 88.976 | 2002.9 | Tatton, Matthew R; Simpson, Iain; Donohoe, Timothy J De novo synthesis of multisubstituted aryl amines using alkene cross metathesis. Organic letters, 2014, 16, 1920-1923 |
| 1514217 | CIF | C16 H14 Br N S | C 1 2/c 1 | 20.1806; 9.8469; 16.1504 90; 116.648; 90 | 2868.45 | Lemercier, Bérénice C; Pierce, Joshua G Synthesis of thiazolines by copper catalyzed aminobromination of thiohydroximic acids. Organic letters, 2014, 16, 2074-2076 |
| 1514218 | CIF | C28 H28 O4 | P b c a | 16.8408; 14.2476; 19.6198 90; 90; 90 | 4707.6 | Zhu, Mengyun; Liu, Jinqian; Yu, Jianjun; Chen, Liangshun; Zhang, Chunmei; Wang, Limin AlCl3-Promoted Formal [2 + 3]-Cycloaddition of 1,1-Cyclopropane Diesters with N-Benzylic Sulfonamides To Construct Highly Stereoselective Indane Derivatives. Organic letters, 2014, 16, 1856-1859 |
| 1514219 | CIF | C29 H31 N O5 | P -1 | 10.8042; 11.3229; 12.0046 62.987; 77.86; 71.848 | 1239.1 | Pan, Bin; Lu, Xiaodong; Wang, Chunxiang; Hu, Yancheng; Wu, Fan; Wan, Boshun Gold(I)-Catalyzed Intra- and Intermolecular Alkenylations of β-Yne-pyrroles: Facile Formation of Fused Cycloheptapyrroles and Functionalized Pyrroles. Organic letters, 2014, 16, 2244-2247 |
| 1514220 | CIF | C17 H17 Br N2 O4 S | P 1 21 1 | 12.6698; 5.9884; 12.7916 90; 112.067; 90 | 899.43 | Pascual-Escudero, Ana; González-Esguevillas, María; Padilla, Silvia; Adrio, Javier; Carretero, Juan C Enantioselective Synthesis of α-Heteroarylpyrrolidines by Copper-Catalyzed 1,3-Dipolar Cycloaddition of α-Silylimines. Organic letters, 2014, 16, 2228-2231 |
| 1514221 | CIF | C17 H14 Br N3 O2 | P 1 21 1 | 6.0087; 17.4567; 15.2518 90; 91.114; 90 | 1599.49 | Pascual-Escudero, Ana; González-Esguevillas, María; Padilla, Silvia; Adrio, Javier; Carretero, Juan C Enantioselective Synthesis of α-Heteroarylpyrrolidines by Copper-Catalyzed 1,3-Dipolar Cycloaddition of α-Silylimines. Organic letters, 2014, 16, 2228-2231 |
| 1514222 | CIF | C29 H46 O3 | P 61 | 26.574; 26.574; 6.5612 90; 90; 120 | 4012.62 | Gong, Jun; Sun, Peng; Jiang, Nan; Riccio, Raffaele; Lauro, Gianluigi; Bifulco, Giuseppe; Li, Tie-Jun; Gerwick, William H; Zhang, Wen New Steroids with a Rearranged Skeleton as (h)P300 Inhibitors from the Sponge Theonella swinhoei. Organic letters, 2014, 16, 2224-2227 |
| 1514223 | CIF | C20 H24 O2 | P 21 21 21 | 10.1035; 10.4542; 15.8794 90; 90; 90 | 1677.25 | Li, Xu-Yang; Yang, Yuan-Feng; Peng, Xing-Rong; Li, Ming-Ming; Li, Liang-Qun; Deng, Xu; Qin, Hong-Bo; Liu, Jie-Qing; Qiu, Ming-Hua One-step semisynthesis method of spirocurcasone and pyracurcasone from curcusones a and B. Organic letters, 2014, 16, 2196-2199 |
| 1514224 | CIF | C20 H24 O2 | P 21 21 21 | 10.067; 10.4909; 15.8591 90; 90; 90 | 1674.91 | Li, Xu-Yang; Yang, Yuan-Feng; Peng, Xing-Rong; Li, Ming-Ming; Li, Liang-Qun; Deng, Xu; Qin, Hong-Bo; Liu, Jie-Qing; Qiu, Ming-Hua One-step semisynthesis method of spirocurcasone and pyracurcasone from curcusones a and B. Organic letters, 2014, 16, 2196-2199 |
| 1514225 | CIF | Mn2 Na4 O5 | F d d d :1 | 5.721; 9.425; 19.67 90; 90; 90 | 1060.61 | Brachtel, G.; Hoppe, R. Die Koordinationszahl 5 bei Mn(III): Na4 Mn2 O5 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1980, 468, 130-136 |
| 1514226 | CIF | Mn O | F m -3 m | 4.488; 4.488; 4.488 90; 90; 90 | 90.398 | Radler, M. J.; Cohen, J. B.; Sykora, G. P.; Mason, T.; Ellis, D. E.; Faber, Jr, J. The defect structures of Mn1-x O Journal of Physics and Chemistry of Solids, 1992, 53, 141-154 |
| 1514227 | CIF | Mn O2 | P n m a | 9.27; 2.866; 4.533 90; 90; 90 | 120.4 | Bystroem, A. M. The crystal structure of ramsdellite, an orthorhombic modification of Mn O2 Acta Chemica Scandinavica (1-27,1973-42,1988), 1949, 3, 163-173 |
| 1514228 | CIF | Mn O2 | P 42/m n m | 4.397; 4.397; 2.869 90; 90; 90 | 55.468 | Taylor, D. Thermal expansion data: II. Binary oxides with the fluorite and rutile structures, M O2, and the antifluorite structure, M2 O Transactions and Journal of the British Ceramic Society, 1984, 83, 32-37 |
| 1514229 | CIF | Mn O | F m -3 m | 4.444; 4.444; 4.444 90; 90; 90 | 87.765 | Taylor, D. Thermal expansion data: I. Binary oxides with the sodium chloride and wurtzite structure, M O Transactions and Journal of the British Ceramic Society, 1984, 83, 5-9 |
| 1514230 | CIF | Mn2 O3 | I a -3 | 9.41; 9.41; 9.41 90; 90; 90 | 833.2 | Zachariasen, W. H. Untersuchungen über die Kristallstrukturen von Sesquioxiden und Verbindungen ABO~3~ Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse, 1928, 1-165 |
| 1514231 | CIF | Mn O | F m -3 m | 4.44; 4.44; 4.44 90; 90; 90 | 87.528 | Goldschmidt, V. M.; Barth, T.; Holmsen, D.; Lunde, G.; Zachariasen, W. Geochemische Verteilungsgesetze VI. Ueber die Kristallstrukturen vom Rutiltypus, mit Bemerkungen zur Geochemie zweiwertiger und vierwertiger Elemente Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse, 1926, 1, 5-21 |
| 1514232 | CIF | Mn O2 | P 42/m n m | 4.395; 4.395; 2.86 90; 90; 90 | 55.244 | Brenet, J. Sur la structure cristalline des bioxydes de manganèse Comptes Rendus Hebdomadaires des Seances de l`Academie des Sciences (1884 - 1965), 1950, 230, 1360-1362 |
| 1514233 | CIF | Mn2.03 O4 | F d -3 m :2 | 8.0974; 8.0974; 8.0974 90; 90; 90 | 530.93 | Monge, M. A.; Angeles Monge, M.; Amarilla, J. M.; Gutierrez Puebla, E.; Campa, J. A.; Rasines, I. Atomic level study of Li Mn2 O4 as electrode in lithium batteries ChemPhysChem, 2002, 3, 367-370 |
| 1514234 | CIF | Mn O2 | P 42/m n m | 4.396; 4.396; 2.871 90; 90; 90 | 55.482 | Ohama, N.; Hamaguchi, Y. Determination of the exchange integrals in beta - Mn O2 Journal of the Physical Society of Japan, 1971, 30, 1311-1318 |
| 1514235 | CIF | Mn2 O3 | R -3 :H | 10.3043; 10.3043; 25.7688 90; 90; 120 | 2369.53 | Ovsyannikov, Sergey V.; Abakumov, Artem M.; Tsirlin, Alexander A.; Schnelle, Walter; Egoavil, Ricardo; Verbeeck, Jo; Van Tendeloo, Gustaaf; Glazyrin, Konstantin V.; Hanfland, Michael; Dubrovinsky, Leonid Perovskite-like Mn2 O3: a path to new manganites Angewandte Chemie. International Edition, 2013, 52, 1494-1498 |
| 1514236 | CIF | Mn3 O4 | I 41/a m d :1 | 5.759; 5.759; 9.46 90; 90; 90 | 313.751 | Jirak, Z.; Vratislav, S.; Zajicek, J. Oxygen parameters and Debye-Waller factors in Mnx Cr3-x O4 spinels Physica Status Solidi A - Applications and Materials, 1976, 37, K47-K51 |
| 1514237 | CIF | Mn O | F m -3 m | 4.451; 4.451; 4.451 90; 90; 90 | 88.2 | Trukhanov, S. V.; Troyanchuk, I. O.; Bobrikov, I. A.; Simkin, V. G.; Balagurov, A. M. Structure phase separation in the anion-deficient La0.70 Sr0.30 Mn O3- d manganite system Poverkhnostnye Fizika, Khimiya, Mekhanika, 2007, 12, 11-17 |
| 1514238 | CIF | Mn2 O3 | I a -3 | 9.4173; 9.4173; 9.4173 90; 90; 90 | 835.18 | Wang, Xiaofeng; Li, Guanghua; Chu, Qingxin; Liu, Xiaoyang; Feng, Shouhua Synthesis, structure characterization and magnetic properties of single crystal of dimanganese trioxide Gaodeng Xuexiao Huaxue Xuebao, 2007, 28, 821-823 |
| 1514239 | CIF | Mn O2 | C 1 2/m 1 | 13.7; 2.867; 4.46 90; 90.5; 90 | 175.173 | Hill, L. I.; Verbaere, A. On the structural defects in synthetic gamma-(Mn O2)s Journal of Solid State Chemistry, 2004, 177, 4706-4723 |
| 1514240 | CIF | Mn3 O4 | I 41/a m d :1 | 5.76; 5.76; 9.46 90; 90; 90 | 313.86 | Satomi, K. Oxygen positional parameters of tetragonal Mn3 O4 Journal of the Physical Society of Japan, 1961, 16, 258-265 |
| 1514241 | CIF | Mn3 O4 | P b c m | 2.896; 9.5081; 9.2587 90; 90; 90 | 254.9 | Moritomo, Y.; Ohishi, Y.; Kuriki, A.; Nishibori, E.; Takata, M.; Sakata, M. High-pressure structural analysis of Mn3 O4 Journal of the Physical Society of Japan, 2003, 72, 765-766 |
| 1514242 | CIF | C4 H N5 | P 1 21/c 1 | 6.0001; 11.0822; 7.5504 90; 94.0457; 90 | 500.81 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514243 | CIF | C16 H20 Li2 N10 O4 | P -1 | 7.3027; 12.0514; 13.4782 78.9079; 84.1793; 73.2896 | 1113.53 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514244 | CIF | C20 H28 Li2 N10 O6 | P -1 | 9.1877; 9.2708; 9.6723 104.991; 111.404; 103.684 | 688.94 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514245 | CIF | C6 H F3 N4 | P 21 21 21 | 6.327; 7.943; 14.558 90; 90; 90 | 731.6 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514246 | CIF | C14 H20 F3 Li N4 O4 | P -1 | 8.5394; 9.0672; 12.4686 84.359; 84.592; 86.347 | 955.03 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514247 | CIF | C18 H28 F3 Li N4 O6 | P b c a | 15.741; 16.454; 18.665 90; 90; 90 | 4834 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514248 | CIF | C14 H18 F3 Li N4 O4 | P 1 21/c 1 | 7.2884; 14.667; 17.635 90; 108.341; 90 | 1789.4 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514249 | CIF | C20 H12 F6 Li2 N12 | P -1 | 8.521; 8.659; 10.512 100.382; 101.817; 113.835 | 663.8 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514250 | CIF | C10 H8 F3 Li N4 O | P -1 | 8.128; 8.606; 8.614 73.415; 85.388; 88.509 | 575.6 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514251 | CIF | C9 H4 F3 Li N4 O3 | P 1 21/c 1 | 11.582; 8.604; 14.248 90; 125.08; 90 | 1161.9 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514252 | CIF | C10 H6 F3 Li N4 O3 | P 1 21/c 1 | 9.2612; 14.667; 11.5933 90; 127.825; 90 | 1243.9 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514253 | CIF | C15 H6 F6 Li2 N8 O3 | C 1 2/c 1 | 15.114; 8.782; 15.345 90; 95.378; 90 | 2027.8 | McOwen, Dennis W.; Delp, Samuel A.; Paillard, Elie; Herriot, Cristelle; Han, Sang-Don; Boyle, Paul D.; Sommer, Roger D.; Henderson, Wesley A. Anion Coordination Interactions in Solvates with the Lithium Salts LiDCTA and LiTDI The Journal of Physical Chemistry C, 2014, 118, 7781 |
| 1514254 | CIF | C21 H17 Cl I2 O3 | P -1 | 9.6504; 10.0633; 12.6865 73.782; 80.037; 62.461 | 1047.6 | Wang, Jia; Zhu, Hai-Tao; Li, Ying-Xiu; Wang, Li-Jing; Qiu, Yi-Feng; Qiu, Zi-Hang; Zhong, Mei-Jin; Liu, Xue-Yuan; Liang, Yong-Min Facile Synthesis of Halogenated Spiroketals via a Tandem Iodocyclization. Organic letters, 2014, 16, 2236-2239 |
| 1514255 | CIF | C21 H17 I3 O3 | P -1 | 9.5417; 10.255; 12.6145 73.414; 84.654; 68.761 | 1102.55 | Wang, Jia; Zhu, Hai-Tao; Li, Ying-Xiu; Wang, Li-Jing; Qiu, Yi-Feng; Qiu, Zi-Hang; Zhong, Mei-Jin; Liu, Xue-Yuan; Liang, Yong-Min Facile Synthesis of Halogenated Spiroketals via a Tandem Iodocyclization. Organic letters, 2014, 16, 2236-2239 |
| 1514256 | CIF | C20 H18 Cl N O4 S | P b c a | 9.8687; 12.9702; 29.514 90; 90; 90 | 3777.8 | He, Shuzhong; Hsung, Richard P; Presser, William R; Ma, Zhi-Xiong; Haugen, Bryan J An Approach to Cyclohepta[b]indoles through an Allenamide (4 + 3) Cycloaddition-Grignard Cyclization-Chugaev Elimination Sequence. Organic letters, 2014, 16, 2180-2183 |
| 1514257 | CIF | C29 H23 F N2 O2 | P 1 21/n 1 | 12.6816; 13.5032; 13.3486 90; 96.061; 90 | 2273.07 | Laouiti, Anouar; Couty, François; Marrot, Jérome; Boubaker, Taoufik; Rammah, Mohamed M; Rammah, Mohamed B; Evano, Gwilherm Exploring the anionic reactivity of ynimines, useful precursors of metalated ketenimines. Organic letters, 2014, 16, 2252-2255 |
| 1514258 | CIF | C26 H28 N2 O2 Si | P 1 21/c 1 | 19.789; 6.2044; 20.095 90; 100.538; 90 | 2425.6 | Laouiti, Anouar; Couty, François; Marrot, Jérome; Boubaker, Taoufik; Rammah, Mohamed M; Rammah, Mohamed B; Evano, Gwilherm Exploring the anionic reactivity of ynimines, useful precursors of metalated ketenimines. Organic letters, 2014, 16, 2252-2255 |
| 1514262 | CIF | C22 H34 O5 | P 21 21 21 | 10.48171; 13.11257; 30.7357 90; 90; 90 | 4224.38 | Li, Hui; Li, Man-Man; Su, Xiao-Qin; Sun, Jing; Gu, Yu-Fan; Zeng, Ke-Wu; Zhang, Qian; Zhao, Yun-Fang; Ferreira, Daneel; Zjawiony, Jordan K.; Li, Jun; Tu, Peng-Fei Anti-inflammatory Labdane Diterpenoids from Lagopsis supina. Journal of natural products, 2014, 77, 1047-1053 |
| 1514263 | CIF | C24 H12 N2 S2 | P -1 | 8.569; 9.647; 13.03 69.226; 72.615; 79.106 | 956.9 | Shi, Jianwu; Zhao, Wenling; Xu, Li; Kan, Yuhe; Li, Chunli; Song, Jinsheng; Wang, Hua Small Molecules of Cyclopentadithiophene Derivatives: Effect of Sulfur Atoms Position and Substituted Groups on Their UV-abs Properties. The journal of physical chemistry. A, 2014, 118, 7844 |
| 1514264 | CIF | C21 H12 O S2 | P 1 21/c 1 | 9.4678; 20.285; 9.5649 90; 116.62; 90 | 1642.3 | Shi, Jianwu; Zhao, Wenling; Xu, Li; Kan, Yuhe; Li, Chunli; Song, Jinsheng; Wang, Hua Small Molecules of Cyclopentadithiophene Derivatives: Effect of Sulfur Atoms Position and Substituted Groups on Their UV-abs Properties. The journal of physical chemistry. A, 2014, 118, 7844 |
| 1514265 | CIF | C18 H20 N2 O3 S | P 1 21/n 1 | 8.601; 22.967; 9.524 90; 104.23; 90 | 1823.6 | Jung, Da Jung; Jeon, Hyun Ji; Kim, Ju Hyun; Kim, Youngmee; Lee, Sang-Gi DMF as a Source of Oxygen and Aminomethine: Stereoselective 1,2-Insertion of Rhodium(II) Azavinyl Carbenes into the C═O Bond of Formamides for the Synthesis of cis-Diamino Enones. Organic letters, 2014, 16, 2208-2211 |
| 1514266 | CIF | C46 H56 N2 | P 1 21/c 1 | 15.6742; 5.4689; 21.5676 90; 90.055; 90 | 1848.8 | Levick, Matthew T; Grace, Iain; Dai, Sheng-Yao; Kasch, Nicholas; Muryn, Christopher; Lambert, Colin; Turner, Michael L; Procter, David J A Sm(II)-Mediated Cascade Approach to Dibenzoindolo[3,2-b]carbazoles: Synthesis and Evaluation. Organic letters, 2014, 16, 2292-2295 |
| 1514267 | CIF | C50 H64 N2 | P -1 | 5.9862; 16.452; 20.776 95.482; 94.572; 97.856 | 2008.7 | Levick, Matthew T; Grace, Iain; Dai, Sheng-Yao; Kasch, Nicholas; Muryn, Christopher; Lambert, Colin; Turner, Michael L; Procter, David J A Sm(II)-Mediated Cascade Approach to Dibenzoindolo[3,2-b]carbazoles: Synthesis and Evaluation. Organic letters, 2014, 16, 2292-2295 |
| 1514268 | CIF | C17 H14 O | P 1 21/c 1 | 16.0145; 6.92267; 22.8872 90; 90.15; 90 | 2537.34 | Barroso, Raquel; Valencia, Rocío A; Cabal, María-Paz; Valdés, Carlos Pd-Catalyzed Autotandem C-C/C-C Bond-Forming Reactions with Tosylhydrazones: Synthesis of Spirocycles with Extended π-Conjugation. Organic letters, 2014, 16, 2264-2267 |
| 1514269 | CIF | C34 H30 N2 O2 S | P 1 21/n 1 | 9.7709; 29.277; 10.1465 90; 98.78; 90 | 2868.5 | Liu, Xuliang; Gao, Ang; Ding, Lei; Xu, Juan; Zhao, Baoguo Aminative umpolung synthesis of aryl vicinal diamines from aromatic aldehydes. Organic letters, 2014, 16, 2118-2121 |
| 1514270 | CIF | C34 H30 N2 O2 S | P 1 21/c 1 | 12.504; 17.249; 26.231 90; 95.167; 90 | 5634.6 | Liu, Xuliang; Gao, Ang; Ding, Lei; Xu, Juan; Zhao, Baoguo Aminative umpolung synthesis of aryl vicinal diamines from aromatic aldehydes. Organic letters, 2014, 16, 2118-2121 |
| 1514271 | CIF | C15 H15 F N2 O2 | P -1 | 7.055; 8.528; 11.612 91.367; 107.144; 93.909 | 665.3 | Ghorai, Manas K; Talukdar, Ranadeep; Tiwari, Deo Prakash A Route to Highly Functionalized β-Enaminoesters via a Domino Ring-Opening Cyclization/Decarboxylative Tautomerization Sequence of Donor-Acceptor Cyclopropanes with Substituted Malononitriles. Organic letters, 2014, 16, 2204-2207 |
| 1514272 | CIF | C15 H15 F N2 O2 | P 1 21/n 1 | 9.2974; 9.5428; 15.3051 90; 90.768; 90 | 1357.8 | Ghorai, Manas K; Talukdar, Ranadeep; Tiwari, Deo Prakash A Route to Highly Functionalized β-Enaminoesters via a Domino Ring-Opening Cyclization/Decarboxylative Tautomerization Sequence of Donor-Acceptor Cyclopropanes with Substituted Malononitriles. Organic letters, 2014, 16, 2204-2207 |
| 1514273 | CIF | C55 H55 Cl2 N2 P Pd | P 1 21 1 | 12.669; 12.248; 31.45 90; 90.014; 90 | 4880 | Crawford, Katherine A.; Cowley, Alan H.; Humphrey, Simon M. Bis(imino)acenaphthene (BIAN)-supported palladium(ii) carbene complexes as effective C‒C coupling catalysts and solvent effects in organic and aqueous media Catalysis Science & Technology, 2014, 4, 1456 |
| 1514274 | CIF | C17 H40 Mo N2 O6 | P 1 21/n 1 | 14.997; 8.3386; 17.151 90; 99.979; 90 | 2112.4 | Knopf, Ioana; Ono, Takashi; Temprado, Manuel; Tofan, Daniel; Cummins, Christopher C. Uptake of one and two molecules of CO2 by the molybdate dianion: a soluble, molecular oxide model system for carbon dioxide fixation Chemical Science, 2014, 5, 1772 |
| 1514275 | CIF | C82 H72 Mo N6 O8 P4 | P 1 21 1 | 10.7577; 13.0244; 25.943 90; 90.884; 90 | 3634.5 | Knopf, Ioana; Ono, Takashi; Temprado, Manuel; Tofan, Daniel; Cummins, Christopher C. Uptake of one and two molecules of CO2 by the molybdate dianion: a soluble, molecular oxide model system for carbon dioxide fixation Chemical Science, 2014, 5, 1772 |
| 1514276 | CIF | C80 H80 Cl6 Mo N2 O7 P4 | P 1 21/c 1 | 21.931; 12.235; 26.654 90; 92.141; 90 | 7147 | Knopf, Ioana; Ono, Takashi; Temprado, Manuel; Tofan, Daniel; Cummins, Christopher C. Uptake of one and two molecules of CO2 by the molybdate dianion: a soluble, molecular oxide model system for carbon dioxide fixation Chemical Science, 2014, 5, 1772 |
| 1514277 | CIF | C19 H16 O4 | P 1 21/n 1 | 9.5528; 10.1091; 16.166 90; 104.844; 90 | 1509.05 | Rawling, Michael J.; Rowley, Julian H.; Campbell, Matthew; Kennedy, Alan R.; Parkinson, John A.; Tomkinson, Nicholas C. O. Mechanistic insights into the malonoyl peroxide syn-dihydroxylation of alkenes Chemical Science, 2014, 5, 1777 |
| 1514278 | CIF | C19 H18 O5 | P 1 21/c 1 | 10.7552; 10.1502; 14.9906 90; 93.447; 90 | 1633.52 | Rawling, Michael J.; Rowley, Julian H.; Campbell, Matthew; Kennedy, Alan R.; Parkinson, John A.; Tomkinson, Nicholas C. O. Mechanistic insights into the malonoyl peroxide syn-dihydroxylation of alkenes Chemical Science, 2014, 5, 1777 |
| 1514279 | CIF | C19 H18 O5 | P 21 21 21 | 5.6981; 8.6185; 32.841 90; 90; 90 | 1612.8 | Rawling, Michael J.; Rowley, Julian H.; Campbell, Matthew; Kennedy, Alan R.; Parkinson, John A.; Tomkinson, Nicholas C. O. Mechanistic insights into the malonoyl peroxide syn-dihydroxylation of alkenes Chemical Science, 2014, 5, 1777 |
| 1514280 | CIF | C19 H16 O4 | P 1 21/c 1 | 13.4714; 5.8443; 19.1637 90; 103.276; 90 | 1468.45 | Rawling, Michael J.; Rowley, Julian H.; Campbell, Matthew; Kennedy, Alan R.; Parkinson, John A.; Tomkinson, Nicholas C. O. Mechanistic insights into the malonoyl peroxide syn-dihydroxylation of alkenes Chemical Science, 2014, 5, 1777 |
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