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 |
| 1514281 | CIF | C27 H44 Cl2 N O4 P2 Re | P 1 21/c 1 | 13.2321; 15.7048; 16.7382 90; 114.833; 90 | 3156.7 | Vogt, Matthias; Nerush, Alexander; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David Reversible CO2 binding triggered by metal‒ligand cooperation in a rhenium(i) PNP pincer-type complex and the reaction with dihydrogen Chemical Science, 2014, 5, 2043 |
| 1514282 | CIF | C37 H27 N O3 Pt | P -1 | 7.554; 17.939; 21.6527 66.669; 87.131; 86.992 | 2689.18 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514283 | CIF | C32 H21 N O | P 1 21/a 1 | 8.5103; 30.003; 9.119 90; 112.41; 90 | 2152.6 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514284 | CIF | C41 H31 Cl4 N O2 Pt S | P 21 21 21 | 13.2528; 14.7365; 18.3823 90; 90; 90 | 3590.06 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514285 | CIF | C40 H30 Cl N O2 Pt S | P 1 21 1 | 7.7976; 13.3596; 15.247 90; 93.639; 90 | 1585.12 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514286 | CIF | C20 H14 N2 | P 1 21 1 | 7.5661; 12.3042; 7.9592 90; 105.511; 90 | 713.97 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514287 | CIF | C37 H33 Cl5 N2 O2 Pt2 S2 | P 21 21 21 | 17.2805; 17.2812; 12.5128 90; 90; 90 | 3736.67 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514288 | CIF | C30 H26 N2 O4 Pt2 | C 1 2/c 1 | 11.8533; 9.9205; 22.5187 90; 103.333; 90 | 2576.62 | Shen, Chengshuo; Anger, Emmanuel; Srebro, Monika; Vanthuyne, Nicolas; Deol, Kirandeep K.; Jefferson, Jr, Truman D; Muller, Gilles; Gareth Williams, J. A.; Toupet, Loïc; Roussel, Christian; Autschbach, Jochen; Réau, Régis; Crassous, Jeanne Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1915-1927 |
| 1514289 | CIF | C49 H78 F15 N8 O26 Re S5 | P 1 21/c 1 | 12.949; 17.658; 32.897 90; 90.081; 90 | 7522 | Amendola, Valeria; Bergamaschi, Greta; Boiocchi, Massimo; Alberto, Roger; Braband, Henrik Fluorescent sensing of 99Tc pertechnetate in water Chemical Science, 2014, 5, 1820 |
| 1514290 | CIF | C49 H78 F15 N8 O26 S5 Tc | P 1 21/c 1 | 13.0099; 17.557; 32.9333 90; 89.226; 90 | 7521.8 | Amendola, Valeria; Bergamaschi, Greta; Boiocchi, Massimo; Alberto, Roger; Braband, Henrik Fluorescent sensing of 99Tc pertechnetate in water Chemical Science, 2014, 5, 1820 |
| 1514291 | CIF | C11 H10 F2 O2 | P -1 | 4.865; 7.057; 15.151 88.73; 84.04; 82.71 | 513.15 | Lu, Wei; Gao, Juan; Yang, Jing-Kui; Liu, Lei; Zhao, Yuliang; Wu, Hai-Chen Regioselective alkyl transfer from phosphonium ylides to functionalized polyfluoroarenes Chemical Science, 2014, 5, 1934 |
| 1514292 | CIF | C20 H19 Cl N2 O4 | P 1 21 1 | 11.1925; 8.1206; 21.465 90; 101.402; 90 | 1912.4 | Xu, Biao; Shi, Li-Li; Zhang, Yu-Zu; Wu, Zhi-Jun; Fu, Li-Na; Luo, Chun-Qin; Zhang, Lan-Xi; Peng, Yun-Gui; Guo, Qi-Xiang Catalytic asymmetric direct α-alkylation of amino esters by aldehydes via imine activation Chemical Science, 2014, 5, 1988 |
| 1514293 | CIF | C66 H62 Al Co N2 O8 | P 21 21 21 | 11.5495; 21.268; 28.17 90; 90; 90 | 6919.5 | Mulzer, Michael; Ellis, W. Chadwick; Lobkovsky, Emil B.; Coates, Geoffrey W. Enantioenriched β-lactone and aldol-type products from regiodivergent carbonylation of racemic cis-epoxides Chemical Science, 2014, 5, 1928 |
| 1514294 | CIF | C19 H22 F3 N O2 S | P 1 21 1 | 5.7359; 17.005; 9.7453 90; 102.621; 90 | 927.58 | Buesking, Andrew W.; Ellman, Jonathan A. Convergent, asymmetric synthesis of vicinal amino alcohols via Rh-catalyzed addition of α-amido trifluoroborates to carbonyls Chemical Science, 2014, 5, 1983 |
| 1514295 | CIF | C37 H30 F3 N3 O3 Pt S | P b c a | 14.0939; 19.1285; 26.663 90; 90; 90 | 7188.2 | Juliá, Fabio; Bautista, Delia; Fernández-Hernández, Jesús M.; González-Herrero, Pablo Homoleptic tris-cyclometalated platinum(iv) complexes: a new class of long-lived, highly efficient 3LC emitters Chemical Science, 2014, 5, 1875 |
| 1514296 | CIF | C35 H20 Cl2 F9 N3 O3 Pt S | P -1 | 10.3618; 12.3271; 14.6981 81.352; 88.049; 80.752 | 1831.8 | Juliá, Fabio; Bautista, Delia; Fernández-Hernández, Jesús M.; González-Herrero, Pablo Homoleptic tris-cyclometalated platinum(iv) complexes: a new class of long-lived, highly efficient 3LC emitters Chemical Science, 2014, 5, 1875 |
| 1514297 | CIF | C25 H21 Br N2 O3 | P 1 21 1 | 9.7989; 9.7523; 22.829 90; 90.326; 90 | 2181.5 | Mori, Keiji; Wakazawa, Manari; Akiyama, Takahiko Stereoselective construction of all-carbon quaternary center by means of chiral phosphoric acid: highly enantioselective Friedel–Crafts reaction of indoles with β,β-disubstituted nitroalkenes Chemical Science, 2014, 5, 1799 |
| 1514298 | CIF | C11 H8 F3 N O4 | P 1 21/n 1 | 14.395; 10.661; 15.136 90; 95.588; 90 | 2311.8 | Mori, Keiji; Wakazawa, Manari; Akiyama, Takahiko Stereoselective construction of all-carbon quaternary center by means of chiral phosphoric acid: highly enantioselective Friedel–Crafts reaction of indoles with β,β-disubstituted nitroalkenes Chemical Science, 2014, 5, 1799 |
| 1514299 | CIF | C25 H22 N2 O2 | P -4 21 c | 21.2628; 21.2628; 9.0321 90; 90; 90 | 4083.5 | Mori, Keiji; Wakazawa, Manari; Akiyama, Takahiko Stereoselective construction of all-carbon quaternary center by means of chiral phosphoric acid: highly enantioselective Friedel‒Crafts reaction of indoles with β,β-disubstituted nitroalkenes Chemical Science, 2014, 5, 1799 |
| 1514300 | CIF | C21 H20 Br N O4 | P 1 21 1 | 10.3326; 6.3617; 14.1521 90; 96.731; 90 | 923.85 | Stiller, Julian; Poulsen, Pernille H.; Cruz, David Cruz; Dourado, Jorge; Davis, Rebecca L.; Jørgensen, Karl Anker Organocatalytic [4+2] addition reactions via tetraenamine intermediate Chemical Science, 2014, 5, 2052 |
| 1514301 | CIF | C30 H22 N10 O2.88 | P 1 21/n 1 | 4.188; 21.206; 30.008 90; 91.247; 90 | 2664 | Lewis, James E. M.; Elliott, Anastasia B. S.; McAdam, C. John; Gordon, Keith C.; Crowley, James D. ‘Click’ to functionalise: synthesis, characterisation and enhancement of the physical properties of a series of exo- and endo-functionalised Pd2L4 nanocages Chemical Science, 2014, 5, 1833 |
| 1514302 | CIF | C33 H23 Cl3 Fe N6 | P -1 | 11.4645; 16.4498; 16.6038 105.696; 102.138; 95.838 | 2904.99 | Lewis, James E. M.; Elliott, Anastasia B. S.; McAdam, C. John; Gordon, Keith C.; Crowley, James D. ‘Click’ to functionalise: synthesis, characterisation and enhancement of the physical properties of a series of exo- and endo-functionalised Pd2L4 nanocages Chemical Science, 2014, 5, 1833 |
| 1514303 | CIF | C62 H37 Cl2 N15 O6 Re2 | C 1 2/c 1 | 40; 7.73; 19.823 90; 97.713; 90 | 6074 | Lewis, James E. M.; Elliott, Anastasia B. S.; McAdam, C. John; Gordon, Keith C.; Crowley, James D. ‘Click’ to functionalise: synthesis, characterisation and enhancement of the physical properties of a series of exo- and endo-functionalised Pd2L4 nanocages Chemical Science, 2014, 5, 1833 |
| 1514304 | CIF | C28 H18 Ag F6 N6 Sb | P -1 | 11.1876; 12.2069; 12.521 112.398; 100.82; 90.607 | 1546.5 | Lewis, James E. M.; Elliott, Anastasia B. S.; McAdam, C. John; Gordon, Keith C.; Crowley, James D. ‘Click’ to functionalise: synthesis, characterisation and enhancement of the physical properties of a series of exo- and endo-functionalised Pd2L4 nanocages Chemical Science, 2014, 5, 1833 |
| 1514305 | CIF | C64 H52.5 B0 Cl F0 Fe2 N13 O2.75 Pd Pt0.5 | P -1 | 14.809; 21.668; 24.158 105.56; 94.22; 90.62 | 7444 | Lewis, James E. M.; Elliott, Anastasia B. S.; McAdam, C. John; Gordon, Keith C.; Crowley, James D. ‘Click’ to functionalise: synthesis, characterisation and enhancement of the physical properties of a series of exo- and endo-functionalised Pd2L4 nanocages Chemical Science, 2014, 5, 1833 |
| 1514306 | CIF | C15 H15 Br O4 | P 21 21 21 | 5.3717; 18.0674; 29.3071 90; 90; 90 | 2844.3 | Johnston, Ryne C.; Cohen, Daniel T.; Eichman, Chad C.; Scheidt, Karl A.; Cheong, Paul Ha-Yeon Catalytic Kinetic Resolution of a Dynamic Racemate: Highly Stereoselective β-Lactone Formation by N-Heterocyclic Carbene Catalysis. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1974-1982 |
| 1514307 | CIF | C15 H15 Br O4 | P 21 21 21 | 5.4193; 9.4004; 28.084 90; 90; 90 | 1430.7 | Johnston, Ryne C.; Cohen, Daniel T.; Eichman, Chad C.; Scheidt, Karl A.; Cheong, Paul Ha-Yeon Catalytic Kinetic Resolution of a Dynamic Racemate: Highly Stereoselective β-Lactone Formation by N-Heterocyclic Carbene Catalysis. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1974-1982 |
| 1514308 | CIF | C50.5 H87 Cl2 Co2 N2 P4 | C 1 2/c 1 | 29.522; 11.3531; 16.459 90; 102.536; 90 | 5385 | Semproni, Scott P.; Hojilla Atienza, Crisita Carmen; Chirik, Paul J. Oxidative addition and C‒H activation chemistry with a PNP pincer-ligated cobalt complex Chemical Science, 2014, 5, 1956 |
| 1514309 | CIF | C20 H38 Co I N P2 | P 1 21/c 1 | 15.6128; 9.7824; 16.1191 90; 106.659; 90 | 2358.55 | Semproni, Scott P.; Hojilla Atienza, Crisita Carmen; Chirik, Paul J. Oxidative addition and C‒H activation chemistry with a PNP pincer-ligated cobalt complex Chemical Science, 2014, 5, 1956 |
| 1514310 | CIF | C37 H49 Co N P2 | P -1 | 10.4893; 11.4272; 16.7767 75.494; 74.128; 64.032 | 1718.98 | Semproni, Scott P.; Hojilla Atienza, Crisita Carmen; Chirik, Paul J. Oxidative addition and C‒H activation chemistry with a PNP pincer-ligated cobalt complex Chemical Science, 2014, 5, 1956 |
| 1514311 | CIF | C22 H45 Co N P3 | P 1 21/c 1 | 13.885; 11.36; 16.179 90; 94.627; 90 | 2543.7 | Semproni, Scott P.; Hojilla Atienza, Crisita Carmen; Chirik, Paul J. Oxidative addition and C‒H activation chemistry with a PNP pincer-ligated cobalt complex Chemical Science, 2014, 5, 1956 |
| 1514312 | CIF | C25 H51 Co N P3 | P -1 | 10.0117; 10.3818; 15.817 95.298; 96.632; 116.746 | 1438.9 | Semproni, Scott P.; Hojilla Atienza, Crisita Carmen; Chirik, Paul J. Oxidative addition and C‒H activation chemistry with a PNP pincer-ligated cobalt complex Chemical Science, 2014, 5, 1956 |
| 1514313 | CIF | C19 H38 Co N P2 | C 1 2/c 1 | 19.236; 9.591; 11.786 90; 100.635; 90 | 2137.1 | Semproni, Scott P.; Hojilla Atienza, Crisita Carmen; Chirik, Paul J. Oxidative addition and C‒H activation chemistry with a PNP pincer-ligated cobalt complex Chemical Science, 2014, 5, 1956 |
| 1514314 | CIF | C24 H17 O2 Sb | P 1 21/c 1 | 9.8268; 14.9773; 13.5372 90; 111.255; 90 | 1856.9 | Hirai, Masato; Gabbaï, François P. Lewis acidic stiborafluorenes for the fluorescence turn-on sensing of fluoride in drinking water at ppm concentrations Chemical Science, 2014, 5, 1886 |
| 1514315 | CIF | C30 H31 Cl4 F N3 O2 S Sb | P 1 21/c 1 | 10.0011; 21.4018; 16.9437 90; 122.404; 90 | 3062 | Hirai, Masato; Gabbaï, François P. Lewis acidic stiborafluorenes for the fluorescence turn-on sensing of fluoride in drinking water at ppm concentrations Chemical Science, 2014, 5, 1886 |
| 1514316 | CIF | C38 H37 F N3 O4 S Sb | P 21 21 21 | 14.7131; 16.7493; 27.433 90; 90; 90 | 6760.4 | Hirai, Masato; Gabbaï, François P. Lewis acidic stiborafluorenes for the fluorescence turn-on sensing of fluoride in drinking water at ppm concentrations Chemical Science, 2014, 5, 1886 |
| 1514317 | CIF | C32 H42 N2 O6 S2 | P -1 | 14.942; 17.41; 20.949 68.999; 69.324; 75.701 | 4714.5 | Turnpenny, Benjamin W.; Chemler, Sherry R. Copper-Catalyzed Alkene Diamination: Synthesis of Chiral 2-Aminomethyl Indolines and Pyrrolidines. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1786-1793 |
| 1514318 | CIF | C22 H24 Mo N2 O4 | P b c a | 17.9132; 11.6738; 21.3034 90; 90; 90 | 4454.9 | Clark, Melissa L.; Grice, Kyle A.; Moore, Curtis E.; Rheingold, Arnold L.; Kubiak, Clifford P. Electrocatalytic CO2 reduction by M(bpy-R)(CO)4 (M = Mo, W; R = H, tBu) complexes. Electrochemical, spectroscopic, and computational studies and comparison with group 7 catalysts Chemical Science, 2014, 5, 1894 |
| 1514319 | CIF | C49 H80 K2 N2 O16 W | P n m a | 29.9821; 15.8708; 11.837 90; 90; 90 | 5632.5 | Clark, Melissa L.; Grice, Kyle A.; Moore, Curtis E.; Rheingold, Arnold L.; Kubiak, Clifford P. Electrocatalytic CO2 reduction by M(bpy-R)(CO)4 (M = Mo, W; R = H, tBu) complexes. Electrochemical, spectroscopic, and computational studies and comparison with group 7 catalysts Chemical Science, 2014, 5, 1894 |
| 1514320 | CIF | C22 H24 N2 O4 W | P b c a | 17.8251; 11.6986; 21.3193 90; 90; 90 | 4445.7 | Clark, Melissa L.; Grice, Kyle A.; Moore, Curtis E.; Rheingold, Arnold L.; Kubiak, Clifford P. Electrocatalytic CO2 reduction by M(bpy-R)(CO)4 (M = Mo, W; R = H, tBu) complexes. Electrochemical, spectroscopic, and computational studies and comparison with group 7 catalysts Chemical Science, 2014, 5, 1894 |
| 1514321 | CIF | C30 H40 K N2 O11 W | P 1 21/c 1 | 12.213; 18.7469; 15.488 90; 107.674; 90 | 3378.69 | Clark, Melissa L.; Grice, Kyle A.; Moore, Curtis E.; Rheingold, Arnold L.; Kubiak, Clifford P. Electrocatalytic CO2 reduction by M(bpy-R)(CO)4 (M = Mo, W; R = H, tBu) complexes. Electrochemical, spectroscopic, and computational studies and comparison with group 7 catalysts Chemical Science, 2014, 5, 1894 |
| 1514322 | CIF | C6 H8 Co O4 | P 1 2/c 1 | 16.1473; 4.7928; 9.2488 90; 90.212; 90 | 715.77 | Saines, Paul J.; Barton, Phillip T.; Jura, Marek; Knight, Kevin S.; Cheetham, Anthony K. Cobalt adipate, Co(C6H8O4): antiferromagnetic structure, unusual thermal expansion and magnetoelastic coupling Materials Horizons, 2014, 1, 332 |
| 1514323 | CIF | C5 H9 N5 | P n m a | 14.356; 6.3845; 7.889 90; 90; 90 | 723.1 | McCrary, Parker D.; Chatel, Gregory; Alaniz, Spencer A.; Cojocaru, O. Andreea; Beasley, Preston A.; Flores, Luis A.; Kelley, Steven P.; Barber, Patrick S.; Rogers, Robin D. Evaluating Ionic Liquids as Hypergolic Fuels: Exploring Reactivity from Molecular Structure Energy & Fuels, 2014, 28, 3460 |
| 1514324 | CIF | C6 H9 N5 O2 | P -1 | 7.268; 7.3848; 9.2509 88.28; 74.55; 64.429 | 429.64 | McCrary, Parker D.; Chatel, Gregory; Alaniz, Spencer A.; Cojocaru, O. Andreea; Beasley, Preston A.; Flores, Luis A.; Kelley, Steven P.; Barber, Patrick S.; Rogers, Robin D. Evaluating Ionic Liquids as Hypergolic Fuels: Exploring Reactivity from Molecular Structure Energy & Fuels, 2014, 28, 3460 |
| 1514325 | CIF | C3 H7 N7 | P 1 21/n 1 | 5.668; 20.59; 6.402 90; 114.27; 90 | 681 | McCrary, Parker D.; Chatel, Gregory; Alaniz, Spencer A.; Cojocaru, O. Andreea; Beasley, Preston A.; Flores, Luis A.; Kelley, Steven P.; Barber, Patrick S.; Rogers, Robin D. Evaluating Ionic Liquids as Hypergolic Fuels: Exploring Reactivity from Molecular Structure Energy & Fuels, 2014, 28, 3460 |
| 1514326 | CIF | C8 H9 N5 O2 | P -1 | 7.243; 8.2646; 9.8487 68.198; 70.224; 66.763 | 490.1 | McCrary, Parker D.; Chatel, Gregory; Alaniz, Spencer A.; Cojocaru, O. Andreea; Beasley, Preston A.; Flores, Luis A.; Kelley, Steven P.; Barber, Patrick S.; Rogers, Robin D. Evaluating Ionic Liquids as Hypergolic Fuels: Exploring Reactivity from Molecular Structure Energy & Fuels, 2014, 28, 3460 |
| 1514327 | CIF | C3 H7 I N4 | C 1 2/c 1 | 29.767; 7.814; 19.687 90; 111.016; 90 | 4275 | McCrary, Parker D.; Chatel, Gregory; Alaniz, Spencer A.; Cojocaru, O. Andreea; Beasley, Preston A.; Flores, Luis A.; Kelley, Steven P.; Barber, Patrick S.; Rogers, Robin D. Evaluating Ionic Liquids as Hypergolic Fuels: Exploring Reactivity from Molecular Structure Energy & Fuels, 2014, 28, 3460 |
| 1514328 | CIF | C30 H24 B Br F2 I N2 S2 | P 1 21/n 1 | 8.1859; 27.8367; 12.9701 90; 92.636; 90 | 2952.3 | Heyer, Elodie; Retailleau, Pascal; Ziessel, Raymond α-Fused Dithienyl BODIPYs Synthesized by Oxidative Ring Closure. Organic letters, 2014, 16, 2330-2333 |
| 1514329 | CIF | C15 H16 Cl2 O Pd S2 | P b c a | 8.117; 20.123; 20.541 90; 90; 90 | 3355 | Joshi, Hemant; Sharma, Kamal Nayan; Sharma, Alpesh K; Singh, Ajai Kumar Palladium-phosphorus/sulfur nanoparticles (NPs) decorated on graphene oxide: synthesis using the same precursor for NPs and catalytic applications in Suzuki-Miyaura coupling. Nanoscale, 2014, 6, 4588-4597 |
| 1514330 | CIF | C33 H30 N2 O2 | P 1 21/n 1 | 14.11; 11.504; 17.793 90; 111.155; 90 | 2693.5 | Wang, Lianke; Shen, Yanfang; Zhu, Qiuju; Xu, Weinan; Yang, Mingdi; Zhou, Hongping; Wu, Jieying; Tian, Yupeng Systematic Study and Imaging Application of Aggregation-Induced Emission of Ester-Isophorone Derivatives The Journal of Physical Chemistry C, 2014, 118, 8531 |
| 1514331 | CIF | C23 H24 N4 O2 | C 1 2/c 1 | 30.567; 7.925; 17.725 90; 98.37; 90 | 4248 | Wang, Lianke; Shen, Yanfang; Zhu, Qiuju; Xu, Weinan; Yang, Mingdi; Zhou, Hongping; Wu, Jieying; Tian, Yupeng Systematic Study and Imaging Application of Aggregation-Induced Emission of Ester-Isophorone Derivatives The Journal of Physical Chemistry C, 2014, 118, 8531 |
| 1514332 | CIF | C24 H25 N3 O2 | P -1 | 7.516; 8.738; 16.992 98.617; 97.284; 97.346 | 1082.1 | Wang, Lianke; Shen, Yanfang; Zhu, Qiuju; Xu, Weinan; Yang, Mingdi; Zhou, Hongping; Wu, Jieying; Tian, Yupeng Systematic Study and Imaging Application of Aggregation-Induced Emission of Ester-Isophorone Derivatives The Journal of Physical Chemistry C, 2014, 118, 8531 |
| 1514333 | CIF | C24 H25 N3 O2 | P n a 21 | 48.93; 5.783; 7.453 90; 90; 90 | 2108.9 | Wang, Lianke; Shen, Yanfang; Zhu, Qiuju; Xu, Weinan; Yang, Mingdi; Zhou, Hongping; Wu, Jieying; Tian, Yupeng Systematic Study and Imaging Application of Aggregation-Induced Emission of Ester-Isophorone Derivatives The Journal of Physical Chemistry C, 2014, 118, 8531 |
| 1514334 | CIF | C18 H34 I N O3 Si | P 21 21 21 | 13.5145; 22.4036; 22.9937 90; 90; 90 | 6961.9 | Echeverria, Pierre-Georges; Prévost, Sébastien; Cornil, Johan; Férard, Charlène; Reymond, Sébastien; Guérinot, Amandine; Cossy, Janine; Ratovelomanana-Vidal, Virginie; Phansavath, Phannarath Synthetic Strategy toward the C44-C65 Fragment of Mirabalin. Organic letters, 2014, 16, 2390-2393 |
| 1514335 | CIF | C18 H19 N3 O | C 1 2/m 1 | 19.276; 6.8223; 13.03 90; 104.354; 90 | 1660 | Fang, Tao; Tan, Qitao; Ding, Zhengwei; Liu, Bingxin; Xu, Bin Pd-Catalyzed Oxidative Annulation of Hydrazides with Isocyanides: Synthesis of 2-Amino-1,3,4-oxadiazoles. Organic letters, 2014, 16, 2342-2345 |
| 1514336 | CIF | C61.25 H74.5 N6 O16 | P -1 | 10.604; 23.472; 27.553 77.89; 83.86; 80.29 | 6591 | Sebaoun, Laure; Kauffmann, Brice; Delclos, Thomas; Maurizot, Victor; Huc, Ivan Assessing Stabilization through π-π Interactions in Aromatic Oligoamide β-Sheet Foldamers. Organic letters, 2014, 16, 2326-2329 |
| 1514337 | CIF | C121 H141 Cl3 N14 O28 | P -1 | 14.837; 18.674; 25.801 76.16; 89.61; 72.57 | 6606 | Sebaoun, Laure; Kauffmann, Brice; Delclos, Thomas; Maurizot, Victor; Huc, Ivan Assessing Stabilization through π-π Interactions in Aromatic Oligoamide β-Sheet Foldamers. Organic letters, 2014, 16, 2326-2329 |
| 1514338 | CIF | C16 H31 N O3 | P 21 21 21 | 10.1293; 10.9916; 16.069 90; 90; 90 | 1789.1 | Beveridge, Ramsay E.; Batey, Robert A. An Organotrifluoroborate-Based Convergent Total Synthesis of the Potent Cancer Cell Growth Inhibitory Depsipeptides Kitastatin and Respirantin. Organic letters, 2014, 16, 2322-2325 |
| 1514339 | CIF | C2.11 H2.39 N0.42 O0.7 | C 1 c 1 | 23.38; 6.969; 19.937 90; 110.851; 90 | 3035.7 | Subhasri, Annamalai; Anbuselvan, Chinnadurai Facile, cost effective synthesis and DFT-based studies of substituted aryl hydrazones of β-diketones: a new selective fluorescent chemosensor for Co2+ Analytical Methods, 2014, 6, 5596 |
| 1514340 | CIF | C8 H18 O4 Si2 | P 1 21/n 1 | 10.5425; 11.9183; 11.4221 90; 108.364; 90 | 1362.08 | Feghali, Elias; Jacquet, Olivier; Thuéry, Pierre; Cantat, Thibault Catalytic hydrosilylation of oxalic acid: chemoselective formation of functionalized C2-products Catalysis Science & Technology, 2014, 4, 2230 |
| 1514341 | CIF | C27 H50 N2 O8 S2 | P -1 | 6.53547; 9.4651; 26.193 83.956; 84.79; 89.716 | 1604.59 | Köstereli, Ziya; Scopelliti, Rosario; Severin, Kay Pattern-based sensing of aminoglycosides with fluorescent amphiphiles Chemical Science, 2014, 5, 2456 |
| 1514342 | CIF | C20 H33 O4.5 | P 21 21 21 | 10.4173; 12.2196; 29.6743 90; 90; 90 | 3777.4 | Liu, Cui-Ping; Xu, Jin-Biao; Zhao, Jin-Xin; Xu, Cheng-Hui; Dong, Lei; Ding, Jian; Yue, Jian-Min Diterpenoids from Croton laui and Their Cytotoxic and Antimicrobial Activities. Journal of natural products, 2014, 77, 1013-1020 |
| 1514343 | CIF | C28 H28 O2 | P 1 21/c 1 | 10.2369; 10.9853; 19.9009 90; 102.032; 90 | 2188.8 | Wu, Yen-Ku; West, F. G. Formal Homologous Aldol Reactions: Interrupting the Nazarov Cyclization via Carboalkoxylation of Alkynes. Organic letters, 2014, 16, 2534-2537 |
| 1514344 | CIF | C19 H19 Br O4 | P 1 21 1 | 6.05; 33.448; 8.747 90; 95.376; 90 | 1762.3 | Smith, Siobhan R.; Leckie, Stuart M.; Holmes, Reuben; Douglas, James; Fallan, Charlene; Shapland, Peter; Pryde, David; Slawin, Alexandra M. Z.; Smith, Andrew D. α-Ketophosphonates as Ester Surrogates: Isothiourea-Catalyzed Asymmetric Diester and Lactone Synthesis. Organic letters, 2014, 16, 2506-2509 |
| 1514345 | CIF | C24 H23 Br N2 O7 | P 21 21 21 | 9.6196; 14.4057; 17.108 90; 90; 90 | 2370.8 | Zhao, Yong-Long; Wang, Yao; Cao, Jian; Liang, Yong-Min; Xu, Peng-Fei Organocatalytic Asymmetric Michael-Michael Cascade for the Construction of Highly Functionalized N-Fused Piperidinoindoline Derivatives. Organic letters, 2014, 16, 2438-2441 |
| 1514346 | CIF | C16 H14 Br Cl2 N O | P 1 21/n 1 | 7.8952; 12.0717; 16.5793 90; 97.133; 90 | 1567.92 | Yao, Chuan-Zhi; Xiao, Zu-Feng; Liu, Jie; Ning, Xiao-Shan; Kang, Yan-Biao Ru-Catalyzed Rearrangement of N-Methyl Isoxazolidines to N-H 1,3-Oxazinanes: A Strategy of Self-Hydride Transferring Cleavage of N-O Bonds. Organic letters, 2014, 16, 2498-2501 |
| 1514347 | CIF | C23 H19 Cl N2 O3 S | P 1 21 1 | 8.7575; 22.141; 10.8356 90; 91.285; 90 | 2100.5 | Yin, Qin; You, Shu-Li Asymmetric Chlorocyclization of Indole-3-yl-benzamides for the Construction of Fused Indolines. Organic letters, 2014, 16, 2426-2429 |
| 1514348 | CIF | C56 H78 N2 O17 | P 21 21 21 | 12.1923; 18.8559; 24.0835 90; 90; 90 | 5536.7 | Yu, Guocan; Hua, Bin; Han, Chengyou Proton Transfer in Host-Guest Complexation between a Difunctional Pillar[5]arene and Alkyldiamines. Organic letters, 2014, 16, 2486-2489 |
| 1514349 | CIF | C54 H72 N2 O16 | P 1 21/n 1 | 20.3564; 12.7264; 20.9919 90; 108.03; 90 | 5171.2 | Yu, Guocan; Hua, Bin; Han, Chengyou Proton Transfer in Host-Guest Complexation between a Difunctional Pillar[5]arene and Alkyldiamines. Organic letters, 2014, 16, 2486-2489 |
| 1514350 | CIF | C21 H18 Br2 F N3 O | P 21 21 2 | 19.716; 23.201; 4.2513 90; 90; 90 | 1944.7 | Naidoo, Jacinth; De Jesus-Cortes, Hector; Huntington, Paula; Estill, Sandi; Morlock, Lorraine K.; Starwalt, Ruth; Mangano, Thomas J.; Williams, Noelle S.; Pieper, Andrew A.; Ready, Joseph M. Discovery of a Neuroprotective Chemical, (S)-N-(3-(3,6-Dibromo-9H-carbazol-9-yl)-2-fluoropropyl)-6-methoxypyridin-2-amine [(-)-P7C3-S243], with Improved Druglike Properties. Journal of medicinal chemistry, 2014, 57, 3746-3754 |
| 1514351 | CIF | C53 H68 O4 S2 Zr | C 1 2/c 1 | 23.924; 18.448; 12.936 90; 111.94; 90 | 5296 | Della Monica, Francesco; Luciano, Ermanno; Roviello, Giuseppina; Grassi, Alfonso; Milione, Stefano; Capacchione, Carmine Group 4 Metal Complexes Bearing Thioetherphenolate Ligands. Coordination Chemistry and Ring-Opening Polymerization Catalysis Macromolecules, 2014, 47, 2830 |
| 1514352 | CIF | C9 H8 N4 O | P 1 21/c 1 | 9.0114; 11.6358; 10.5021 90; 124.828; 90 | 903.94 | Yin, Hang; Wang, Teng; Jiao, Ning Copper-Catalyzed Oxoazidation and Alkoxyazidation of Indoles. Organic letters, 2014, 16, 2302-2305 |
| 1514353 | CIF | C34 H54 O4 | P 21 21 21 | 9.3781; 12.6568; 27.0482 90; 90; 90 | 3210.53 | Yang, Xing-Wei; Ding, Yuanqing; Zhang, Jing-Jing; Liu, Xia; Yang, Li-Xin; Li, Xiao-Nian; Ferreira, Daneel; Walker, Larry A.; Xu, Gang New Acylphloroglucinol Derivatives with Diverse Architectures from Hypericum henryi. Organic letters, 2014, 16, 2434-2437 |
| 1514354 | CIF | C36 H54 O5 | P 1 21 1 | 9.3216; 13.2025; 13.8291 90; 107.968; 90 | 1618.92 | Yang, Xing-Wei; Ding, Yuanqing; Zhang, Jing-Jing; Liu, Xia; Yang, Li-Xin; Li, Xiao-Nian; Ferreira, Daneel; Walker, Larry A.; Xu, Gang New Acylphloroglucinol Derivatives with Diverse Architectures from Hypericum henryi. Organic letters, 2014, 16, 2434-2437 |
| 1514355 | CIF | C44 H44 N24 O12 | P 1 21/n 1 | 24.5965; 18.9698; 30.9836 90; 93.447; 90 | 14430.5 | Gilberg, Laura; Khan, Muhammad S. A.; Enderesova, Marketa; Sindelar, Vladimir Cucurbiturils Substituted on the Methylene Bridge. Organic letters, 2014, 16, 2446-2449 |
| 1514356 | CIF | C42 H44 O4 | C 1 2/c 1 | 22.1827; 14.2629; 12.1482 90; 106.072; 90 | 3693.34 | Su, Yijin; Zhang, Yanwei; Akhmedov, Novruz G.; Petersen, Jeffrey L.; Shi, Xiaodong Ambient Intermolecular [2 + 2] Cycloaddition: An Example of Carbophilicity and Oxophilicity Competition in Au/Ag Catalysis. Organic letters, 2014, 16, 2478-2481 |
| 1514357 | CIF | C34 H28 O4 | P 1 21/c 1 | 9.3001; 17.6333; 16.8483 90; 96.205; 90 | 2746.8 | Su, Yijin; Zhang, Yanwei; Akhmedov, Novruz G.; Petersen, Jeffrey L.; Shi, Xiaodong Ambient Intermolecular [2 + 2] Cycloaddition: An Example of Carbophilicity and Oxophilicity Competition in Au/Ag Catalysis. Organic letters, 2014, 16, 2478-2481 |
| 1514358 | CIF | C42 H44 O4 | P -1 | 10.9837; 18.0724; 19.9386 68.9726; 81.9783; 89.7507 | 3653.7 | Su, Yijin; Zhang, Yanwei; Akhmedov, Novruz G.; Petersen, Jeffrey L.; Shi, Xiaodong Ambient Intermolecular [2 + 2] Cycloaddition: An Example of Carbophilicity and Oxophilicity Competition in Au/Ag Catalysis. Organic letters, 2014, 16, 2478-2481 |
| 1514359 | CIF | C217 H85 Cl23 Dy2 N24 O | P 1 21/c 1 | 16.6402; 27.6773; 39.7657 90; 90.466; 90 | 18313.7 | Wang, Hailong; Qian, Kang; Qi, Dongdong; Cao, Wei; Wang, Kang; Gao, Song; Jiang, Jianzhuang Co-crystallized fullerene and a mixed (phthalocyaninato)(porphyrinato) dysprosium double-decker SMM Chemical Science, 2014, 5, 3214 |
| 1514360 | CIF | C136 H40 Cl4 Dy N12 O0 | C 1 2/c 1 | 22.5698; 15.6246; 24.1908 90; 96.681; 90 | 8472.8 | Wang, Hailong; Qian, Kang; Qi, Dongdong; Cao, Wei; Wang, Kang; Gao, Song; Jiang, Jianzhuang Co-crystallized fullerene and a mixed (phthalocyaninato)(porphyrinato) dysprosium double-decker SMM Chemical Science, 2014, 5, 3214 |
| 1514361 | CIF | C220 H60 Cl8 Dy N12 O0 | P 1 21/c 1 | 19.3998; 28.3596; 24.7203 90; 90; 90 | 13600.4 | Wang, Hailong; Qian, Kang; Qi, Dongdong; Cao, Wei; Wang, Kang; Gao, Song; Jiang, Jianzhuang Co-crystallized fullerene and a mixed (phthalocyaninato)(porphyrinato) dysprosium double-decker SMM Chemical Science, 2014, 5, 3214 |
| 1514362 | CIF | C35 H24 F6 N2 O2 S2 | P 1 21/n 1 | 12.9786; 6.6198; 36.186 90; 94.888; 90 | 3097.6 | Kitagawa, Daichi; Kobatake, Seiya Crystal thickness dependence of the photoinduced crystal bending of 1-(5-methyl-2-(4-(p-vinylbenzoyloxymethyl)phenyl)-4-thiazolyl)-2-(5-methyl-2-phenyl-4-thiazolyl)perfluorocyclopentene. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 764-769 |
| 1514363 | CIF | C37 H55 N6 O8 | P 1 21 1 | 9.6584; 19.8105; 11.0401 90; 109.791; 90 | 1987.62 | Du, Feng-Yu; Zhang, Peng; Li, Xiao-Ming; Li, Chun-Shun; Cui, Chuan-Ming; Wang, Bin-Gui Cyclohexadepsipeptides of the Isaridin Class from the Marine-Derived Fungus Beauveria felina EN-135. Journal of natural products, 2014, 77, 1164 |
| 1514364 | CIF | C36 H57 N5 O9 | P 21 21 21 | 10.2134; 15.7979; 24.297 90; 90; 90 | 3920.3 | Du, Feng-Yu; Zhang, Peng; Li, Xiao-Ming; Li, Chun-Shun; Cui, Chuan-Ming; Wang, Bin-Gui Cyclohexadepsipeptides of the Isaridin Class from the Marine-Derived Fungus Beauveria felina EN-135. Journal of natural products, 2014, 77, 1164 |
| 1514365 | CIF | C35 H55 N5 O8 | P 21 21 21 | 9.3052; 17.0969; 23.5305 90; 90; 90 | 3743.5 | Du, Feng-Yu; Zhang, Peng; Li, Xiao-Ming; Li, Chun-Shun; Cui, Chuan-Ming; Wang, Bin-Gui Cyclohexadepsipeptides of the Isaridin Class from the Marine-Derived Fungus Beauveria felina EN-135. Journal of natural products, 2014, 77, 1164 |
| 1514366 | CIF | C21 H34 O4 Si | P -1 | 9.076; 10.7759; 11.1491 80.423; 84.426; 74.609 | 1035.04 | Sharma, Indrajeet; Wurst, Jacqueline M.; Tan, Derek S. Solvent-Dependent Divergent Functions of Sc(OTf)3 in Stereoselective Epoxide-Opening Spiroketalizations. Organic letters, 2014, 16, 2474-2477 |
| 1514367 | CIF | C37 H38 Cl2 N4 O3 | P 1 21/c 1 | 13.066; 9.757; 29.525 90; 116; 90 | 3383 | Men, Guangwen; Zhang, Guirong; Liang, Chunshuang; Liu, Huiling; Yang, Bing; Pan, Yuyu; Wang, Zhenyu; Jiang, Shimei A dual channel optical detector for trace water chemodosimetry and imaging of live cells. The Analyst, 2013, 138, 2847-2857 |
| 1514368 | CIF | C51 H48 O6 Si2 | P 1 21/c 1 | 16.849; 17.6362; 15.7254 90; 114.22; 90 | 4261.5 | Ghosh, Kumaresh; Kar, Debasis; Fröhlich, Roland; Chattopadhyay, Asoke P.; Samadder, Asmita; Khuda-Bukhsh, Anisur Rahman O-tert-butyldiphenylsilyl coumarin and dicoumarol: a case toward selective sensing of F- ions in organic and aqueous environments. The Analyst, 2013, 138, 3038-3045 |
| 1514369 | CIF | C62 H46 Cl N16 O14 Ru2 | C 1 2/c 1 | 19.9067; 20.3667; 18.4436 90; 117.057; 90 | 6659.3 | Kumar, Anup; Singh, Alok K.; Gupta, Tarkeshwar A stimuli-responsive "smart probe" for selective monitoring of multiple-cations via differential analyses. The Analyst, 2013, 138, 3356-3359 |
| 1514370 | CIF | C39 H31 N3 S2 | P 1 21/c 1 | 19.681; 8.3397; 21.489 90; 110.841; 90 | 3296.3 | Jin, Jiayu; Zhang, Junji; Zou, Lei; Tian, He Near-infrared photochromic behavior in a donor-acceptor type diarylethene modulated by the cyanide anion. The Analyst, 2013, 138, 1641-1644 |
| 1514371 | CIF | C29 H27 N3 S2 | P 1 21/c 1 | 24.443; 8.3483; 12.521 90; 99.817; 90 | 2517.6 | Jin, Jiayu; Zhang, Junji; Zou, Lei; Tian, He Near-infrared photochromic behavior in a donor-acceptor type diarylethene modulated by the cyanide anion. The Analyst, 2013, 138, 1641-1644 |
| 1514372 | CIF | C23 H27 B F2 N2 O | P 1 21/n 1 | 10.5132; 10.5783; 19.315 90; 97.647; 90 | 2129 | Hecht, Mandy; Kraus, Werner; Rurack, Knut A highly fluorescent pH sensing membrane for the alkaline pH range incorporating a BODIPY dye. The Analyst, 2013, 138, 325-332 |
| 1514373 | CIF | C39 H42 Cl F6 N3 O4 P2 Ru | P -1 | 10.2059; 12.2904; 16.59 88.423; 79.612; 67.58 | 1890.2 | Sharma, Hemant; Guadalupe, Hernández J.; Narayanan, Jayanthi; Hofeld, Herbert; Pandiyan, Thangarasu; Singh, Narinder Pyridyl- and benzimidazole-based ruthenium(iii) complex for selective chloride recognition through fluorescence spectroscopy Analytical Methods, 2013, 5, 3880 |
| 1514374 | CIF | C13 H12 N2 O4 Pd | P n a 21 | 10.919; 23.8725; 4.8372 90; 90; 90 | 1260.88 | Dornan, Laura M.; Clendenning, Gráinne M. A.; Pitak, Mateusz B.; Coles, Simon J.; Muldoon, Mark J. N,O-ligated Pd(ii) complexes for catalytic alcohol oxidation Catalysis Science & Technology, 2014, 4, 2526 |
| 1514375 | CIF | C12 H12 N2 O5 Pd S | P 1 21/c 1 | 19.681; 7.1866; 20.443 90; 107.332; 90 | 2760.2 | Dornan, Laura M.; Clendenning, Gráinne M. A.; Pitak, Mateusz B.; Coles, Simon J.; Muldoon, Mark J. N,O-ligated Pd(ii) complexes for catalytic alcohol oxidation Catalysis Science & Technology, 2014, 4, 2526 |
| 1514376 | CIF | C25 H27 F18 N O2 W | P -1 | 15.3435; 17.6683; 21.002 65.712; 71.109; 68.54 | 4728 | Mougel, V.; Copéret, C. Magnitude and consequences of OR ligand σ-donation on alkene metathesis activity in d0 silica supported (SiO)W(NAr)(CHtBu)(OR) catalysts Chemical Science, 2014, 5, 2475 |
| 1514377 | CIF | C110 H134 Cl13 N8 O6 P | C 1 2/c 1 | 43.4252; 8.333; 36.214 90; 113.942; 90 | 11977 | Furuyama, Taniyuki; Yoshida, Takuya; Hashizume, Daisuke; Kobayashi, Nagao Phosphorus(v) tetraazaporphyrins: porphyrinoids showing an exceptionally strong CT band between the Soret and Q bands Chemical Science, 2014, 5, 2466 |
| 1514378 | CIF | C55 H42 B F22 N P2 Pt | P 1 21/n 1 | 15.6555; 18.868; 18.2423 90; 98.761; 90 | 5325.7 | DeMott, Jessica C.; Bhuvanesh, Nattamai; Ozerov, Oleg V. Frustrated Lewis pair-like splitting of aromatic C‒H bonds and abstraction of halogen atoms by a cationic [(FPNP)Pt]+ species Chemical Science, 2013, 4, 642 |
| 1514379 | CIF | C54 H39 B F23 N P2 Pt | P 1 21/c 1 | 15.495; 18.673; 22.444 90; 125.955; 90 | 5256.7 | DeMott, Jessica C.; Bhuvanesh, Nattamai; Ozerov, Oleg V. Frustrated Lewis pair-like splitting of aromatic C‒H bonds and abstraction of halogen atoms by a cationic [(FPNP)Pt]+ species Chemical Science, 2013, 4, 642 |
| 1514380 | CIF | C25 H35 B11 Cl12 F2 N P2 Pt | P 1 21/c 1 | 19.446; 15.82; 15.256 90; 107.781; 90 | 4469 | DeMott, Jessica C.; Bhuvanesh, Nattamai; Ozerov, Oleg V. Frustrated Lewis pair-like splitting of aromatic C‒H bonds and abstraction of halogen atoms by a cationic [(FPNP)Pt]+ species Chemical Science, 2013, 4, 642 |
| 1514381 | CIF | C30 H22 B F2 N5 | P -1 | 11.9663; 12.5933; 19.2781 76.089; 85.2516; 62.9902 | 2511.2 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514382 | CIF | C30.5 H24 B Cl F2 N4 | C 1 2/c 1 | 33.428; 11.5134; 13.9925 90; 111.419; 90 | 5013.4 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514383 | CIF | C32 H27 B F2 N4 | P -1 | 12.0332; 14.8026; 15.5572 89.0111; 83.545; 72.8575 | 2630.8 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514384 | CIF | C40 H43 B F2 N4 | P -1 | 10.7533; 13.3999; 24.5025 91.7881; 95.0164; 100.258 | 3457 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514385 | CIF | C36 H35 B F2 N4 | P 1 21/n 1 | 15.7903; 11.9086; 15.8933 90; 94.469; 90 | 2979.5 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514386 | CIF | C28.5 H18 B Cl3 F2 N4 | I 1 2/a 1 | 14.0731; 11.5359; 31.2056 90; 93.7226; 90 | 5055.41 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514387 | CIF | C45 H68 Ca Cl2 F3 Fe N4 O15 S4 | P -1 | 14.2376; 14.5557; 16.0245 112.035; 96.1392; 107.982 | 2832.94 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514388 | CIF | C45 H68 Cl2 F3 Fe N4 O15 S4 Sr | P 1 21/c 1 | 8.7949; 28.7099; 22.444 90; 98.6131; 90 | 5603.2 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514389 | CIF | C50 H78 Ba F3 Fe N4 O17 S4 | P -1 | 12.9433; 14.8169; 18.2751 110.991; 91.9057; 105.868 | 3113.7 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514390 | CIF | C46 H70 Cl4 F3 Mn N4 O15 S4 Sr | P -1 | 13.9061; 15.1055; 16.262 68.7445; 75.3429; 74.3805 | 3019.7 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514391 | CIF | C45 H68 Ca Cl2 F3 Ga N4 O15 S4 | P -1 | 14.3885; 14.7196; 15.8403 112.801; 97.8526; 106.385 | 2850.07 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514392 | CIF | C42 H56 Cl N O5 | P 1 21/c 1 | 11.4992; 24.3436; 15.0944 90; 112.268; 90 | 3910.3 | Huang, Li; Zhao, Wenjun; Staples, Richard J.; Wulff, William D. Multifaceted interception of 2-chloro-2-oxoacetic anhydrides: a catalytic asymmetric synthesis of β-lactams Chemical Science, 2013, 4, 622 |
| 1514393 | CIF | C16 H20 Cl N O | P 21 21 21 | 5.1885; 14.53; 19.501 90; 90; 90 | 1470.2 | Huang, Li; Zhao, Wenjun; Staples, Richard J.; Wulff, William D. Multifaceted interception of 2-chloro-2-oxoacetic anhydrides: a catalytic asymmetric synthesis of β-lactams Chemical Science, 2013, 4, 622 |
| 1514394 | CIF | C24 H18 Cl N O4 | P 21 21 21 | 7.8652; 13.56; 19.207 90; 90; 90 | 2048.5 | Huang, Li; Zhao, Wenjun; Staples, Richard J.; Wulff, William D. Multifaceted interception of 2-chloro-2-oxoacetic anhydrides: a catalytic asymmetric synthesis of β-lactams Chemical Science, 2013, 4, 622 |
| 1514395 | CIF | C51 H33 N7 O20 Zn3 | P -3 1 c | 16.49; 16.49; 14.05 90; 90; 120 | 3308.6 | Park, Hye Jeong; Suh, Myunghyun Paik Enhanced isosteric heat, selectivity, and uptake capacity of CO2 adsorption in a metal-organic framework by impregnated metal ions Chemical Science, 2013, 4, 685 |
| 1514396 | CIF | C84 H90 N2 Pt | P 1 21/c 1 | 19.1854; 19.6691; 24.6274 90; 108.482; 90 | 8814.1 | Lohr, Tracy L.; Piers, Warren E.; Parvez, Masood Arene C‒H bond activation across Pt(ii)‒OH bonds: catalyzed vs. uncatalyzed pathways Chemical Science, 2013, 4, 770 |
| 1514397 | CIF | C102.5 H113 Cl N2 Pt | P -1 | 12.0941; 15.39; 25.2421 101.259; 98.6734; 111.101 | 4171.5 | Lohr, Tracy L.; Piers, Warren E.; Parvez, Masood Arene C‒H bond activation across Pt(ii)‒OH bonds: catalyzed vs. uncatalyzed pathways Chemical Science, 2013, 4, 770 |
| 1514398 | CIF | C75 H81 Cu3 N16 O3 Y | P -1 | 14.2953; 18.3037; 20.8565 75.534; 71.127; 74.087 | 4887.5 | Lionetti, Davide; Day, Michael W.; Agapie, Theodor Metal-Templated Ligand Architectures for Trinuclear Chemistry: Tricopper Complexes and Their O2 Reactivity. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 785-790 |
| 1514399 | CIF | C12 H20 O6 | P 1 21/c 1 | 6.0689; 11.699; 19.4385 90; 98.695; 90 | 1364.3 | Ley, David; Gerbig, Dennis; Schreiner, Peter R. Tunneling control of chemical reactions: C–H insertion versus H-tunneling in tert-butylhydroxycarbene Chemical Science, 2013, 4, 677 |
| 1514400 | CIF | C48 F40 N4 U | C 1 2/c 1 | 23.5319; 12.9011; 16.0719 90; 106.846; 90 | 4669.8 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514401 | CIF | C48 H20 F20 N4 U | C 1 2/c 1 | 38.651; 12.3736; 19.957 90; 99.992; 90 | 9399.7 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514402 | CIF | C44 H16 F30 N3 O2 U | P -1 | 11.0728; 11.7379; 20.3378 79.419; 80.189; 84.54 | 2554.81 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514403 | CIF | C88.5 H66 F18 N3 O2 P2 U | P -1 | 13.4814; 16.1925; 19.0979 76.559; 87.948; 84.674 | 4036.9 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514404 | CIF | C14 H9 F6 N | P c a 21 | 10.0174; 15.9406; 7.9776 90; 90; 90 | 1273.89 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514405 | CIF | C26 H32 F6 K N O3 | P -1 | 10.8866; 11.9211; 12.8559 111.365; 100.052; 109.196 | 1382.79 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514406 | CIF | C16 H10 F10 K N O | P -1 | 8.4008; 10.5747; 11.1333 77.131; 69.962; 75.663 | 889.84 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514407 | CIF | C66 H42 F25 K N6 U | P 1 21/c 1 | 24.2328; 12.7508; 24.1585 90; 109.123; 90 | 7052.8 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514408 | CIF | C34 H18 Ir0.11 N4 O8 Zn2 | P -1 | 14.0368; 15.1189; 15.1242 85.358; 85.555; 86.35 | 3184.2 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514409 | CIF | C26 H8 N10 O8 Rh Zn2 | P 4/m m m | 15.093; 15.093; 9.62 90; 90; 90 | 2191.4 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514410 | CIF | C36 H21 N4 O8 Rh0.15 Zn2 | P -1 | 14.0869; 15.1333; 15.1402 86.517; 87.286; 86.896 | 3213.8 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514411 | CIF | C24 H8 Ir0.29 N6 O8 Zn2 | P 4/m m m | 15.093; 15.093; 9.62 90; 90; 90 | 2191.4 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514412 | CIF | C25 H23 P Si | P -1 | 11.2823; 16.8988; 22.9869 81.236; 79.739; 81.615 | 4230.32 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal–amide dependent, catalytic C–H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514413 | CIF | C50 H70 Li2 N2 P2 Si4 | C 1 c 1 | 18.8666; 22.2888; 25.4992 90; 100.652; 90 | 10538 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514414 | CIF | C64 H86 Ca N2 P2 Si4 | C 1 2/c 1 | 30.6079; 12.39475; 22.0579 90; 128.948; 90 | 6508.1 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514415 | CIF | C31 H52 N2 P Si4 Y | P 1 21/c 1 | 11.1459; 20.7732; 16.6276 90; 100.782; 90 | 3781.92 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514416 | CIF | C159 H60 I2 N2 O20 | P -1 | 11.569; 12.623; 20.413 97.57; 102.49; 113.57 | 2587.1 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514417 | CIF | C71 H17 Cl6 N O8 | P -1 | 14.3061; 14.457; 15.4664 76.592; 66.58; 61.681 | 2580.3 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514418 | CIF | C65 H5 N O5 | P 1 2/c 1 | 18.742; 13.442; 18.553 90; 114.4; 90 | 4256.6 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514419 | CIF | C67 H6 Cl6 I N O5 | P -1 | 12.754; 12.843; 14.63 78.32; 82.27; 68.22 | 2174.6 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514420 | CIF | C68 H9 N O7 | P 1 2/c 1 | 19.163; 13.468; 18.553 90; 114.32; 90 | 4363 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514421 | CIF | C80 H114 N8 O8 S4 Yb2 | P 1 21/n 1 | 11.3252; 14.7748; 24.3057 90; 90.686; 90 | 4066.7 | Kwong, Wai-Lun; Wai-Yin Sun, Raymond; Lok, Chun-Nam; Siu, Fung-Ming; Wong, Suk-Yu; Low, Kam-Hung; Che, Chi-Ming An ytterbium(iii) porphyrin induces endoplasmic reticulum stress and apoptosis in cancer cells: cytotoxicity and transcriptomics studies Chemical Science, 2013, 4, 747 |
| 1514422 | CIF | C36 H40 Co K O4 | P 1 21/c 1 | 15.4085; 20.2602; 21.0264 90; 102.87; 90 | 6399.1 | Gülak, Samet; Stepanek, Ondrej; Malberg, Jennifer; Rad, Babak Rezaei; Kotora, Martin; Wolf, Robert; Jacobi von Wangelin, Axel Highly chemoselective cobalt-catalyzed biaryl coupling reactions Chemical Science, 2013, 4, 776 |
| 1514423 | CIF | C136 Cl16 Dy2 N8 O74 Si2 W20 | P 1 21/n 1 | 15.3062; 47.6192; 15.6327 90; 108.576; 90 | 10800.6 | Suzuki, Kosuke; Sato, Rinta; Mizuno, Noritaka Reversible switching of single-molecule magnet behaviors by transformation of dinuclear dysprosium cores in polyoxometalates Chemical Science, 2013, 4, 596 |
| 1514424 | CIF | C136 Cl16 Gd2 N8 O74 Si2 W20 | P 1 21/n 1 | 15.2981; 47.7123; 15.6288 90; 108.609; 90 | 10811.2 | Suzuki, Kosuke; Sato, Rinta; Mizuno, Noritaka Reversible switching of single-molecule magnet behaviors by transformation of dinuclear dysprosium cores in polyoxometalates Chemical Science, 2013, 4, 596 |
| 1514425 | CIF | C32 H41 Au Cl2 N2 O2 | P 1 21/n 1 | 12.2769; 12.2829; 22.2697 90; 91.868; 90 | 3356.4 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1514426 | CIF | C35 H46 Au Cl2 N3 O | P 1 21/n 1 | 10.2357; 12.3159; 28.5345 90; 96.224; 90 | 3575.91 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1514427 | CIF | C36.25 H47.5 Au Cl F3 N3 O4 S | P 41 | 27.6; 27.6; 21.2131 90; 90; 90 | 16159.3 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1514428 | CIF | C66 H74 F6 N6 O10 P2 | P -1 | 14.9639; 16.2074; 16.6904 68.074; 65.602; 86.227 | 3400.9 | Liu, Li; Liu, Yuanyuan; Liu, Pingying; Wu, Jie; Guan, Yangfan; Hu, Xiaoyu; Lin, Chen; Yang, Yang; Sun, Xiaoqiang; Ma, Jing; Wang, Leyong Phosphine oxide functional group based three-station molecular shuttle Chemical Science, 2013, 4, 1701 |
| 1514429 | CIF | C14 H10 Br N O4 | P 1 21 1 | 11.8419; 6.5568; 20.7441 90; 102.819; 90 | 1570.53 | Lathrop, Stephen P.; Rovis, Tomislav A photoisomerization-coupled asymmetric Stetter reaction: application to the total synthesis of three diastereomers of (-)-cephalimysin A. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 1668 |
| 1514430 | CIF | C66 H111 Cu3 N19 O35 | I 4/m | 30.926; 30.926; 45.103 90; 90; 90 | 43137 | Yan, Yong; Suyetin, Mikhail; Bichoutskaia, Elena; Blake, Alexander J.; Allan, David R.; Barnett, Sarah A.; Schröder, Martin Modulating the packing of [Cu24(isophthalate)24] cuboctahedra in a triazole-containing metal‒organic polyhedral framework Chemical Science, 2013, 4, 1731 |
| 1514431 | CIF | C62 H44 Br4 N8 O7 | P b c a | 19.744; 19.587; 32.31 90; 90; 90 | 12495 | Song, Na Ri; Moon, Jong Hun; Choi, Jiyoung; Jun, Eun Jin; Kim, Youngmee; Kim, Sung-Jin; Lee, Jin Yong; Yoon, Juyoung Cyclic benzobisimidazolium derivative for the selective fluorescent recognition of HSO4−via a combination of C‒H hydrogen bonds and charge interactions Chemical Science, 2013, 4, 1765 |
| 1514432 | CIF | C46 H48 F24 N8 O2 P4 | C 1 2/c 1 | 22.03; 27.145; 10.285 90; 116.38; 90 | 5510 | Song, Na Ri; Moon, Jong Hun; Choi, Jiyoung; Jun, Eun Jin; Kim, Youngmee; Kim, Sung-Jin; Lee, Jin Yong; Yoon, Juyoung Cyclic benzobisimidazolium derivative for the selective fluorescent recognition of HSO4−via a combination of C–H hydrogen bonds and charge interactions Chemical Science, 2013, 4, 1765 |
| 1514433 | CIF | C11 H16 Co N6 O3 | I 41/a :2 | 17.243; 17.243; 20.157 90; 90; 90 | 5993 | Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L. Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues Chemical Science, 2013, 4, 1746 |
| 1514434 | CIF | C9 H15 Co N5 O3 | I 41/a :2 | 15.7869; 15.7869; 22.328 90; 90; 90 | 5564.7 | Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L. Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues Chemical Science, 2013, 4, 1746 |
| 1514435 | CIF | C10 H14 Co N5 O2.5 | I 41/a :2 | 15.852; 15.852; 22.346 90; 90; 90 | 5615 | Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L. Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues Chemical Science, 2013, 4, 1746 |
| 1514436 | CIF | C37 H58 Mg N2 O | P -1 | 9.1792; 12.119; 15.8077 85.527; 77.912; 87.404 | 1713.51 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514437 | CIF | C38 H59 Mg N3 | P 1 21/n 1 | 9.0121; 20.1333; 19.8758 90; 91.504; 90 | 3605.09 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514438 | CIF | C40 H53 Mg N3 O2 | R 3 m :H | 32.394; 32.394; 11.017 90; 90; 120 | 10012 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514439 | CIF | C78 H104 Mg2 N6 S2 | P 1 21/n 1 | 13.5757; 14.4034; 18.932 90; 92.2137; 90 | 3699.1 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514440 | CIF | C48 H60 Mg N4 O1.25 S2 | P 1 21/n 1 | 18.964; 12.505; 38.624 90; 96.385; 90 | 9103 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514441 | CIF | C80 H110 Mg2 N8 | P 1 21/n 1 | 12.703; 21.654; 13.282 90; 90.01; 90 | 3653.5 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514442 | CIF | C42.5 H61.5 Mg N4 | P 1 21/n 1 | 14.0179; 13.5976; 21.7756 90; 96.842; 90 | 4121.08 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514443 | CIF | C72 H43 N6 Ni3 O13 | R -3 c :H | 29.36; 29.36; 20.776 90; 90; 120 | 15510 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514444 | CIF | C72 H43 N6 Ni3 O13 | R -3 c :H | 29.87; 29.87; 12.0337 90; 90; 120 | 9298 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514445 | CIF | C72 H43 N6 Ni3 O13 | R -3 c :H | 29.884; 29.884; 11.8868 90; 90; 120 | 9193 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514446 | CIF | C82 H83 N6 Ni3 O23 | R -3 c :H | 29.347; 29.347; 21.287 90; 90; 120 | 15877 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514447 | CIF | C90 H115 N6 Ni3 O31 | R -3 c :H | 29.368; 29.368; 20.868 90; 90; 120 | 15586.9 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514448 | CIF | C108 H127 N18 Ni3 O25 | R -3 c :H | 29.05; 29.05; 24.502 90; 90; 120 | 17907 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514449 | CIF | C108 H127 N18 Ni3 O25 | R -3 c :H | 29.106; 29.106; 23.417 90; 90; 120 | 17180 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514450 | CIF | C108 H127 N18 Ni3 O25 | R -3 c :H | 29.151; 29.151; 23.07 90; 90; 120 | 16978 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514451 | CIF | C109.5 H80.5 N13.5 Ni3 O13 | R -3 c :H | 28.548; 28.548; 26.592 90; 90; 120 | 18769 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514452 | CIF | C57 H34 Co3 N3 O13 | R -3 c :H | 19.4312; 19.4312; 45.631 90; 90; 120 | 14920.7 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514453 | CIF | C29 H30 O3 Si | P c a 21 | 25.2196; 11.8584; 8.5478 90; 90; 90 | 2556.34 | Zhao, Jinbo; Liu, Shasha; Marino, Nadia; Clark, Daniel A. Regio- and stereoselective trans-silylvinylation of internal alkynes catalyzed by RuHCl(CO)(PCy3)2 Chemical Science, 2013, 4, 1547 |
| 1514454 | CIF | C18 H32 Cl3 Gd N4 O10 | P -1 | 8.8714; 11.147; 14.5317 102.922; 93.887; 91.677 | 1395.96 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514455 | CIF | C19 H24 Er N7 O14 | P 1 21/c 1 | 13.0075; 14.8207; 13.9166 90; 102.653; 90 | 2617.7 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514456 | CIF | C9 H12 N5 O12 Y | P -1 | 7.4349; 10.63; 11.657 68.02; 88.31; 87.44 | 853.4 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514457 | CIF | C18 H32 Cl3 N4 O10 Tb | P -1 | 8.849; 11.157; 14.564 103.13; 93.56; 91.72 | 1396.1 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514458 | CIF | C18 H32 Cl3 Dy N4 O10 | P -1 | 8.846; 11.148; 14.527 102.85; 93.52; 91.86 | 1392.5 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514459 | CIF | C18 H32 Cl3 Ho N4 O10 | P -1 | 8.87; 11.12; 14.439 102.36; 93.95; 91.96 | 1386.1 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514460 | CIF | C18 H32 Cl3 Er N4 O10 | P -1 | 8.8067; 11.1745; 14.5412 103.075; 93.297; 91.942 | 1389.98 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514461 | CIF | C18 H32 Cl3 N4 O10 Y | P -1 | 8.819; 11.149; 14.491 102.91; 93.47; 91.88 | 1384.7 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514462 | CIF | C19 H24 N7 O14 Tb | P 1 21/c 1 | 13.0909; 14.851; 13.916 90; 102.875; 90 | 2637.4 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514463 | CIF | C19 H24 Dy N7 O14 | P 1 21/c 1 | 13.09; 14.792; 13.965 90; 102.88; 90 | 2636 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514464 | CIF | C19 H24 Ho N7 O14 | P 1 21/c 1 | 13.0407; 14.8401; 13.9335 90; 102.721; 90 | 2630.3 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514465 | CIF | C10 H24 Br2 Ni P2 | P 1 21/c 1 | 8.707; 13.3165; 13.7802 90; 100.665; 90 | 1570.17 | Bryan, Zachary J.; McNeil, Anne J. Evidence for a preferential intramolecular oxidative addition in Ni-catalyzed cross-coupling reactions and their impact on chain-growth polymerizations Chemical Science, 2013, 4, 1620 |
| 1514466 | CIF | C22 H24 Cl2 N2 O Os S | P 1 21/c 1 | 14.4797; 11.9305; 13.1126 90; 98.591; 90 | 2239.8 | Meier, Samuel M.; Hanif, Muhammad; Adhireksan, Zenita; Pichler, Verena; Novak, Maria; Jirkovsky, Elisabeth; Jakupec, Michael A.; Arion, Vladimir B.; Davey, Curt A.; Keppler, Bernhard K.; Hartinger, Christian G. Novel metal(ii) arene 2-pyridinecarbothioamides: a rationale to orally active organometallic anticancer agents Chemical Science, 2013, 4, 1837 |
| 1514467 | CIF | C25 H29 Cl2 F N2 O Ru S | P 1 21/n 1 | 14.0346; 8.6278; 22.7026 90; 90.353; 90 | 2749 | Meier, Samuel M.; Hanif, Muhammad; Adhireksan, Zenita; Pichler, Verena; Novak, Maria; Jirkovsky, Elisabeth; Jakupec, Michael A.; Arion, Vladimir B.; Davey, Curt A.; Keppler, Bernhard K.; Hartinger, Christian G. Novel metal(ii) arene 2-pyridinecarbothioamides: a rationale to orally active organometallic anticancer agents Chemical Science, 2013, 4, 1837 |
| 1514468 | CIF | C108 H116 Br6 Co4 N11 O16 | P 21 21 21 | 12.6611; 19.0777; 47.5848 90; 90; 90 | 11493.8 | Zhu, Yuan-Yuan; Cui, Chang; Zhang, Yi-Quan; Jia, Jun-Hua; Guo, Xiao; Gao, Chen; Qian, Kang; Jiang, Shang-Da; Wang, Bing-Wu; Wang, Zhe-Ming; Gao, Song Zero-field slow magnetic relaxation from single Co(ii) ion: a transition metal single-molecule magnet with high anisotropy barrier Chemical Science, 2013, 4, 1802 |
| 1514469 | CIF | C132 H136 B8 Cl28 Fe4 N32 O36 Re4 | P -1 | 16.163; 20.152; 20.252 93.07; 90.55; 110.44 | 6169 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514470 | CIF | C42 H48 B2 Fe N8 O6 | C 1 2/c 1 | 23.705; 9.3657; 20.454 90; 118.68; 90 | 3983.9 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514471 | CIF | C56 H70 B4 Cl10 Fe2 N14 O12 | P -1 | 10.235; 10.862; 16.008 97.163; 98.93; 93.02 | 1739.6 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514472 | CIF | C56 H48 B2 Fe N8 O14 Zn2 | C 1 2/m 1 | 24.166; 18.52; 21.805 90; 105.6; 90 | 9399 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514473 | CIF | C7 H5 Cu2 I N4 S | I a -3 d | 41.856; 41.856; 41.856 90; 90; 90 | 73329 | Shan, Xiao-chen; Jiang, Fei-long; Yuan, Da-qiang; Zhang, Hua-bin; Wu, Ming-yan; Chen, Lian; Wei, Jing; Zhang, Shu-quan; Pan, Jie; Hong, Mao-chun A multi-metal-cluster MOF with Cu4I4 and Cu6S6 as functional groups exhibiting dual emission with both thermochromic and near-IR character Chemical Science, 2013, 4, 1484 |
| 1514474 | CIF | C15 H18 O6 | C 1 2/c 1 | 13.7664; 9.367; 10.8858 90; 99.268; 90 | 1385.4 | Urabe, Daisuke; Nagatomo, Masanori; Hagiwara, Koji; Masuda, Kengo; Inoue, Masayuki Symmetry-driven synthesis of 9-demethyl-10,15-dideoxyryanodol Chemical Science, 2013, 4, 1615 |
| 1514475 | CIF | C19 H32 O7 | P 1 21/c 1 | 9.1857; 10.7306; 17.807 90; 94.071; 90 | 1750.8 | Urabe, Daisuke; Nagatomo, Masanori; Hagiwara, Koji; Masuda, Kengo; Inoue, Masayuki Symmetry-driven synthesis of 9-demethyl-10,15-dideoxyryanodol Chemical Science, 2013, 4, 1615 |
| 1514476 | CIF | C31 H28 Cl0 Co F12 N6 P2 | P -1 | 11.462; 12.501; 13.164 109.79; 108.38; 90.82 | 1668.73 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514477 | CIF | C53 H45 B Co N5 | P -1 | 10.9829; 13.7142; 17.0064 102.458; 107.971; 101.25 | 2282.8 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514478 | CIF | C33 H28 Cl0 Co F6 N5 O8 S2 | P -1 | 11.94; 12.822; 15.328 65.696; 78.915; 66.557 | 1960.99 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514479 | CIF | C144 H130 B4 Co4 F40 N30 O24 S8 | C 1 c 1 | 17.791; 16.341; 27.415 90; 97.47; 90 | 7902.52 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514480 | CIF | C55 H68 B4 F16 N16 O4 | P 1 21/n 1 | 15.7015; 12.8679; 18.0196 90; 105.064; 90 | 3515.66 | Cai, Jiajia; Hay, Benjamin P.; Young, Neil J.; Yang, Xiaoping; Sessler, Jonathan L. A pyrrole-based triazolium-phane with NH and cationic CH donor groups as a receptor for tetrahedral oxyanions that functions in polar media Chemical Science, 2013, 4, 1560 |
| 1514481 | CIF | C54 H64 B F4 N16 O7 P2 | P 1 21/c 1 | 19.726; 15.697; 22.564 90; 101.404; 90 | 6849 | Cai, Jiajia; Hay, Benjamin P.; Young, Neil J.; Yang, Xiaoping; Sessler, Jonathan L. A pyrrole-based triazolium-phane with NH and cationic CH donor groups as a receptor for tetrahedral oxyanions that functions in polar media Chemical Science, 2013, 4, 1560 |
| 1514482 | CIF | C162 H200 B8 F32 N48 O16 P4 | P 1 21/n 1 | 20.554; 16.552; 31.568 90; 93.445; 90 | 10720 | Cai, Jiajia; Hay, Benjamin P.; Young, Neil J.; Yang, Xiaoping; Sessler, Jonathan L. A pyrrole-based triazolium-phane with NH and cationic CH donor groups as a receptor for tetrahedral oxyanions that functions in polar media Chemical Science, 2013, 4, 1560 |
| 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 |
| 1514484 | CIF | C58 H76 Cl4 Cu2 N4 S2 | C 1 2/c 1 | 52.089; 8.9421; 35.545 90; 129.297; 90 | 12813 | Zhang, Shiyu; Warren, Timothy H. Three coordinate models for the binuclear CuA electron-transfer site Chemical Science, 2013, 4, 1786 |
| 1514485 | CIF | C35 H43 Cl2 Cu N2 S | P 1 21/c 1 | 9.26; 24.43; 15.506 90; 100.133; 90 | 3453 | Zhang, Shiyu; Warren, Timothy H. Three coordinate models for the binuclear CuA electron-transfer site Chemical Science, 2013, 4, 1786 |
| 1514486 | CIF | C18 H18 Cl D2 N3 O2 | P b c a | 18.9604; 9.3522; 19.2687 90; 90; 90 | 3416.8 | Collett, Christopher J.; Massey, Richard S.; Maguire, Oliver R.; Batsanov, Andrei S.; O'Donoghue, AnnMarie C.; Smith, Andrew D. Mechanistic insights into the triazolylidene-catalysed Stetter and benzoin reactions: role of the N-aryl substituent Chemical Science, 2013, 4, 1514 |
| 1514487 | CIF | C19 H20 Cl D2 N3 O2 | P b c a | 19.2697; 9.5129; 19.6896 90; 90; 90 | 3609.3 | Collett, Christopher J.; Massey, Richard S.; Maguire, Oliver R.; Batsanov, Andrei S.; O'Donoghue, AnnMarie C.; Smith, Andrew D. Mechanistic insights into the triazolylidene-catalysed Stetter and benzoin reactions: role of the N-aryl substituent Chemical Science, 2013, 4, 1514 |
| 1514488 | CIF | C18 H17 Cl D2 F N3 O2 | P b c a | 18.8845; 9.4266; 19.2915 90; 90; 90 | 3434.2 | Collett, Christopher J.; Massey, Richard S.; Maguire, Oliver R.; Batsanov, Andrei S.; O'Donoghue, AnnMarie C.; Smith, Andrew D. Mechanistic insights into the triazolylidene-catalysed Stetter and benzoin reactions: role of the N-aryl substituent Chemical Science, 2013, 4, 1514 |
| 1514489 | CIF | C35 H48 Cl2 Fe N O2 | P 1 21/n 1 | 10.1903; 12.5783; 27.2498 90; 96.4952; 90 | 3470.4 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514490 | CIF | C40 H76 Fe N3 O2 Si4 | P 1 21/c 1 | 11.9269; 17.5744; 24.1583 90; 111.583; 90 | 4708.7 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514491 | CIF | C75.5 H98 Cl8 Fe2 N2 O8 | P -1 | 14.8709; 15.747; 17.9214 94.0663; 111.428; 95.5142 | 3863 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514492 | CIF | C43 H55 Cl4 Fe N2 O5 | P 1 21/n 1 | 12.6068; 24.431; 16.6177 90; 111.803; 90 | 4752.1 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514493 | CIF | C66 H90 Fe2 N4 O4 | P 1 21/c 1 | 14.1943; 14.2798; 17.1104 90; 113.995; 90 | 3168.4 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514494 | CIF | C45 H58 Fe N5 O2 | P 1 21 1 | 14.0101; 15.7187; 19.934 90; 97.6912; 90 | 4350.4 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514495 | CIF | C26 H27 Cu3 N8 O0 | P -1 | 11.4287; 11.7031; 12.918 64.005; 89.783; 71.129 | 1450.1 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514496 | CIF | C20 H21 Cu3 N8 O0 | P -1 | 11.4262; 11.4509; 12.5243 66.62; 89.182; 69.908 | 1398.37 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514497 | CIF | C22 H26 Cu3 N8 O2 | P -1 | 11.4964; 11.3571; 12.9352 115.386; 91.133; 69.305 | 1409.92 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514498 | CIF | C22 H26 Cu3 N8 O2 | P -1 | 11.5152; 11.312; 12.6953 114.171; 91.497; 68.347 | 1386.93 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514499 | CIF | C24 H29 Cu3 N8 O2 | P -1 | 11.4723; 11.4569; 13.1199 64.295; 89.824; 110.147 | 1434.83 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514500 | CIF | C26 H33 Cu3 N8 | P -1 | 11.4507; 11.6026; 13.2025 65.36; 71.368; 71.461 | 1475.62 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514501 | CIF | C22 H24 Cu3 N9 O | P -1 | 11.37; 11.4274; 12.1912 67.952; 87.743; 69.803 | 1370.45 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514502 | CIF | C49 H38 N2 O6 | P -1 | 8.947; 14.538; 14.887 75.26; 78.85; 82.01 | 1829.06 | Cheriya, Rijo T.; Mallia, Ajith R.; Hariharan, Mahesh Light harvesting vesicular donor–acceptor scaffold limits the rate of charge recombination in the presence of an electron donor Energy & Environmental Science, 2014, 7, 1661 |
| 1514503 | CIF | C15 Cl2 N5 Ni O8 | P 4/n m m :2 | 9.2584; 9.2584; 14.1473 90; 90; 90 | 1212.68 | Cho, Jaeheung; Kang, Hye Yeon; Liu, Lei V.; Sarangi, Ritimukta; Solomon, Edward I.; Nam, Wonwoo Mononuclear nickel(II)-superoxo and nickel(III)-peroxo complexes bearing a common macrocyclic TMC ligand. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 1502-1508 |
| 1514504 | CIF | C15 H33 Cl N5 Ni O6 | P 1 c 1 | 7.7299; 7.7263; 17.8514 90; 100.673; 90 | 1047.7 | Cho, Jaeheung; Kang, Hye Yeon; Liu, Lei V.; Sarangi, Ritimukta; Solomon, Edward I.; Nam, Wonwoo Mononuclear nickel(II)-superoxo and nickel(III)-peroxo complexes bearing a common macrocyclic TMC ligand. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 1502-1508 |
| 1514505 | CIF | C42 H44 F6 Ir N2 O2 P2 | P 63 | 19.437; 19.437; 18.1371 90; 90; 120 | 5934.13 | Schramm, York; Barrios-Landeros, Fabiola; Pfaltz, Andreas Discovery of an iridacycle catalyst with improved reactivity and enantioselectivity in the hydrogenation of dialkyl ketimines Chemical Science, 2013, 4, 2760 |
| 1514506 | CIF | C26 H19 Br N2 O2 S | P 21 21 21 | 8.6182; 12.4254; 20.8694 90; 90; 90 | 2234.79 | Li, Meiling; Woods, Philip A.; Smith, Martin D. Cation-directed enantioselective synthesis of quaternary-substituted indolenines Chemical Science, 2013, 4, 2907 |
| 1514507 | CIF | C27 H19 N3 | P 1 21/c 1 | 12.6892; 9.9361; 16.3936 90; 102.515; 90 | 2017.81 | Li, Meiling; Woods, Philip A.; Smith, Martin D. Cation-directed enantioselective synthesis of quaternary-substituted indolenines Chemical Science, 2013, 4, 2907 |
| 1514508 | CIF | C72 H2 Cl16 | P -1 | 11.049; 13.43; 18.364 105.567; 91.091; 106.254 | 2507 | Tan, Yuan-Zhi; Li, Jia; Du, Ming-Yue; Lin, Shui-Chao; Xie, Su-Yuan; Lu, Xin; Huang, Rong-Bin; Zheng, Lan-Sun Exohedrally stabilized C70 isomer with adjacent pentagons characterized by crystallography Chemical Science, 2013, 4, 2967 |
| 1514509 | CIF | C368 H360 B16 Co8 F64 N72 O40 | C 1 2/c 1 | 27.658; 39.485; 42.581 90; 106.741; 90 | 44531 | Whitehead, Martina; Turega, Simon; Stephenson, Andrew; Hunter, Christopher A.; Ward, Michael D. Quantification of solvent effects on molecular recognition in polyhedral coordination cage hosts Chemical Science, 2013, 4, 2744 |
| 1514510 | CIF | C23 H21 N O6 | P 1 21 1 | 16.5029; 7.0004; 17.5337 90; 103.817; 90 | 1967 | Corbett, Michael T.; Johnson, Jeffrey S. Enantioselective synthesis of hindered cyclic dialkyl ethers via catalytic oxa-Michael/Michael desymmetrization. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2828-2832 |
| 1514511 | CIF | C28 H40 O6 | P 21 21 21 | 11.3881; 13.7611; 15.9461 90; 90; 90 | 2499 | Liffert, Raphael; Hoecker, Johannes; Jana, Chandan K.; Woods, Tom M.; Burch, Patrick; Jessen, Henning J.; Neuburger, Markus; Gademann, Karl Withanolide A: synthesis and structural requirements for neurite outgrowth Chemical Science, 2013, 4, 2851 |
| 1514512 | CIF | C27 H29 Br2 N O4 | P 21 21 21 | 6.4731; 9.867; 41.104 90; 90; 90 | 2625.3 | Wang, Hengbin; Guptill, David M.; Alvarez, Adrian Varela; Musaev, Djamaladdin G.; Davies, Huw M. L. Rhodium-catalyzed enantioselective cyclopropanation of electron deficient alkenes. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2844-2850 |
| 1514513 | CIF | C21 H21 Br O4 | P 21 21 21 | 6.0402; 15.4144; 20.729 90; 90; 90 | 1930 | Wang, Hengbin; Guptill, David M.; Alvarez, Adrian Varela; Musaev, Djamaladdin G.; Davies, Huw M. L. Rhodium-catalyzed enantioselective cyclopropanation of electron deficient alkenes. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2844-2850 |
| 1514514 | CIF | C40 H52 Cl4 F24 N3 O8 P4 Rh2 | P 1 21/n 1 | 12.7242; 20.3878; 23.2389 90; 97.497; 90 | 5977.1 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514515 | CIF | C25 H26 Cl2 F25 N3 O8 P4 Rh2 | P 1 | 10.1595; 10.386; 12.0283 73.962; 69.049; 71.477 | 1104.74 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514516 | CIF | C26 H29 Cl2 F24 N3 O9 P4 Rh2 | P 1 21/c 1 | 12.0403; 19.3984; 20.6248 90; 106.961; 90 | 4607.7 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514517 | CIF | C25 H26 Cl4 F25 N3 O8 P4 Rh2 | P 1 21/c 1 | 12.2025; 21.385; 20.398 90; 98.351; 90 | 5266.4 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514518 | CIF | C33 H37 Cl4 F24 N3 O9 P4 Rh2 | P -1 | 10.7825; 15.2029; 18.7253 87.983; 80.065; 73.223 | 2894.5 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514519 | CIF | C62 H135 Mn Mo6 N6 O26 | P c c a | 23.3192; 28.2; 30.215 90; 90; 90 | 19869 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514520 | CIF | C94 H152 Mn Mo6 N9 O26 | P -1 | 18.0136; 26.3164; 26.5199 113.089; 102.13; 100.729 | 10790.7 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514521 | CIF | C80 H153 Mn Mo6 N8 O28 | P 1 21/c 1 | 27.455; 29.007; 24.974 90; 94.45; 90 | 19829 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514522 | CIF | C80 H155 Mn Mo6 N8 O29 | P n m a | 28.257; 21.8128; 16.5796 90; 90; 90 | 10219.1 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514523 | CIF | C19 H25 N O4 | P 1 21 1 | 8.3357; 11.294; 9.9646 90; 103.551; 90 | 912 | Wasil, Zahida; Pahirulzaman, Khomaizon A. K.; Butts, Craig; Simpson, Thomas J.; Lazarus, Colin M.; Cox, Russell J. One pathway, many compounds: heterologous expression of a fungal biosynthetic pathway reveals its intrinsic potential for diversity Chemical Science, 2013, 4, 3845 |
| 1514524 | CIF | C19 H23 N O4 | P 1 21 1 | 7.3372; 22.647; 20.618 90; 90.112; 90 | 3426 | Wasil, Zahida; Pahirulzaman, Khomaizon A. K.; Butts, Craig; Simpson, Thomas J.; Lazarus, Colin M.; Cox, Russell J. One pathway, many compounds: heterologous expression of a fungal biosynthetic pathway reveals its intrinsic potential for diversity Chemical Science, 2013, 4, 3845 |
| 1514525 | CIF | C13 H19 N O3 | P 1 21 1 | 9.0939; 30.695; 9.139 90; 94.405; 90 | 2543.5 | Wasil, Zahida; Pahirulzaman, Khomaizon A. K.; Butts, Craig; Simpson, Thomas J.; Lazarus, Colin M.; Cox, Russell J. One pathway, many compounds: heterologous expression of a fungal biosynthetic pathway reveals its intrinsic potential for diversity Chemical Science, 2013, 4, 3845 |
| 1514526 | CIF | C17 H17 Cl3 N2 O3 | P -1 | 9.7614; 10.2988; 10.4722 80.745; 71.023; 89.009 | 981.91 | Cui, Sunliang; Zhang, Yan; Wang, Dahai; Wu, Qifan Rh(iii)-catalyzed C–H activation/[4 + 3] cycloaddition of benzamides and vinylcarbenoids: facile synthesis of azepinones Chemical Science, 2013, 4, 3912 |
| 1514527 | CIF | C35 H61 B11 Br6 F P Ru Si | P -1 | 11.8239; 14.7954; 15.4075 99.322; 110.839; 91.577 | 2475.17 | Fasulo, Meg E.; Lipke, Mark C.; Tilley, T. Don Structural and mechanistic investigation of a cationic hydrogen-substituted ruthenium silylene catalyst for alkene hydrosilation Chemical Science, 2013, 4, 3882 |
| 1514528 | CIF | C30.5 H23.25 Co F6 N5.75 O6 S2 | P -1 | 9.8107; 12.2952; 13.4212 93.235; 91.814; 91.35 | 1615.01 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514529 | CIF | C33 H30.5 B0.5 F11 N7 Ni O0.5 P1.5 | P 1 21/n 1 | 11.605; 26.456; 12.584 90; 114.443; 90 | 3517.3 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514530 | CIF | C33 H27 Cu F6 N7 O6 S2 | P -1 | 9.9247; 13.1783; 14.849 66.577; 80.638; 81.873 | 1752.01 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514531 | CIF | C31 H24 F6 N6 O6 S2 Zn | P -1 | 9.829; 12.2969; 13.4196 92.874; 91.805; 91.232 | 1618.7 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514532 | CIF | C32 H23 Co F9 N6 O6 S2 | P -1 | 10.1178; 10.1848; 18.5692 93.06; 101.838; 106.548 | 1782.45 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514533 | CIF | C27 H23 Br2 N O6 | P 21 21 21 | 6.939; 18.9; 19.529 90; 90; 90 | 2561 | Frazier, Charles P.; Sandoval, David; Palmer, Leoni I.; Read de Alaniz, Javier Electrophilic α-oxygenation reaction of β-ketoesters using N-hydroxycarbamates: control of the ambident reactivity of nitrosoformate intermediates Chemical Science, 2013, 4, 3857 |
| 1514534 | CIF | C16 H25 N O6 | P 1 21/c 1 | 9.8524; 15.9675; 10.5673 90; 92.813; 90 | 1660.43 | Frazier, Charles P.; Sandoval, David; Palmer, Leoni I.; Read de Alaniz, Javier Electrophilic α-oxygenation reaction of β-ketoesters using N-hydroxycarbamates: control of the ambident reactivity of nitrosoformate intermediates Chemical Science, 2013, 4, 3857 |
| 1514535 | CIF | C37 H60 O6 | P 21 21 21 | 10.4149; 13.7246; 24.603 90; 90; 90 | 3516.8 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514536 | CIF | C38 H62 O9 | P 1 | 8.7254; 9.5176; 12.415 89.65; 80.46; 70.65 | 958 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514537 | CIF | C41 H71 Cl O5 Si | P 21 21 21 | 9.3808; 13.5353; 32.994 90; 90; 90 | 4189.3 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514538 | CIF | C34.5 H57 Cl O5 | P 1 21 1 | 11.2356; 11.9742; 24.8296 90; 93.447; 90 | 3334.46 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514539 | CIF | C43 H57 N5 Ni | P -1 | 10.911; 12.339; 15.869 103.994; 97.621; 107.921 | 1922.2 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514540 | CIF | C56 H77 N5 Ni | P 21 21 21 | 13.207; 17.694; 21.9242 90; 90; 90 | 5123.3 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514541 | CIF | C146 H136 B2 F40 N10 Ni2 | P -1 | 14.779; 15.5; 16.733 92.788; 98.247; 100.522 | 3718.6 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514542 | CIF | C27 H44 N4 Ni | F d d 2 | 17.8294; 42.047; 17.6823 90; 90; 90 | 13256 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514543 | CIF | C31 H49 N7 Ni | P -1 | 12.174; 26.324; 31.697 112.359; 99.666; 92.719 | 9191.6 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514544 | CIF | C19 H20 Cl2 O4 | P 21 21 21 | 7.8057; 10.1854; 23.4262 90; 90; 90 | 1862.5 | Hussain, Nusrah; Hussain, Mahmud M.; Carroll, Patrick J.; Walsh, Patrick J. Chemo- and diastereoselective tandem dual oxidation of B(pin)-substituted allylic alcohols: synthesis of B(pin)-substituted epoxy alcohols, 2-keto-anti-1,3-diols and dihydroxy-tetrahydrofuran-3-ones Chemical Science, 2013, 4, 3946 |
| 1514545 | CIF | C70.65 H64.63 Mn4 N7 O14.09 | P 1 21/c 1 | 19.5671; 12.5184; 27.8828 90; 106.461; 90 | 6549.9 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514546 | CIF | C65.42 H49.25 F4.75 Mn4 N6 O15.58 S1.58 | P 1 21/n 1 | 12.305; 15.5248; 37.6815 90; 98.567; 90 | 7118.1 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514547 | CIF | C72 H69 Mn4 N9 O14 | P -1 | 12.6007; 13.0991; 20.5699 99.263; 95.161; 94.247 | 3323.8 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514548 | CIF | C78 H61 F3 Mn4 N10 O14 S | P 1 21/n 1 | 15.41; 24.64; 19.23 90; 103.16; 90 | 7110 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514549 | CIF | C24 H20 N4 O3 Pd | P -1 | 9.1886; 10.6165; 11.5601 81.563; 81.84; 72.521 | 1058.25 | Chen, Kai; Hu, Fang; Zhang, Shuo-Qing; Shi, Bing-Feng Pd(ii)-catalyzed alkylation of unactivated C(sp3)‒H bonds: efficient synthesis of optically active unnatural α-amino acids Chemical Science, 2013, 4, 3906 |
| 1514550 | CIF | C27 H32 O11 | P 1 | 9.4188; 9.7589; 15.1515 96.812; 97.849; 109.187 | 1282.95 | Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science, 2013, 4, 3979 |
| 1514551 | CIF | C45 H63 B O10 Si Sn | P -1 | 11.9576; 12.6539; 16.2477 96.233; 98.572; 100.371 | 2367.98 | Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science, 2013, 4, 3979 |
| 1514552 | CIF | C29 H40 O9 Si | P 21 21 21 | 10.7843; 14.0454; 19.3783 90; 90; 90 | 2935.23 | Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science, 2013, 4, 3979 |
| 1514553 | CIF | C118 H206 B2 Fe2 O P6 | C 1 2/c 1 | 28.3106; 21.7915; 22.8536 90; 126.572; 90 | 11323.1 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C–O cleavage versus C–C coupling Chemical Science, 2013, 4, 4042 |
| 1514554 | CIF | C124 H208 B2 Cl4 Fe2 N2 O2 P6 | P 1 21/c 1 | 22.7338; 15.5757; 17.6503 90; 110.288; 90 | 5862.1 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C–O cleavage versus C–C coupling Chemical Science, 2013, 4, 4042 |
| 1514555 | CIF | C54 H106 B2 Fe2 O P6 | P 1 21 1 | 14.199; 14.985; 14.939 90; 103.184; 90 | 3094.8 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C–O cleavage versus C–C coupling Chemical Science, 2013, 4, 4042 |
| 1514556 | CIF | C102 H94 B2 Fe2 O P6 | I -4 2 d | 33.2834; 33.2834; 16.7509 90; 90; 90 | 18556.4 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C–O cleavage versus C–C coupling Chemical Science, 2013, 4, 4042 |
| 1514557 | CIF | C67 H81 B Fe Na O7 P3 | P 31 | 13.1184; 13.1184; 31.059 90; 90; 120 | 4628.9 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C–O cleavage versus C–C coupling Chemical Science, 2013, 4, 4042 |
| 1514558 | CIF | C91 H82 B2 Fe2 O3 P6 | P -1 | 13.7605; 16.3419; 22.5111 96.665; 106.719; 103.489 | 4622.3 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C–O cleavage versus C–C coupling Chemical Science, 2013, 4, 4042 |
| 1514559 | CIF | C48 H62 O4 W | P -1 | 12.5307; 18.2485; 19.5913 91.056; 93.582; 109.527 | 4210.28 | McGowan, Kevin P.; O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Compelling mechanistic data and identification of the active species in tungsten-catalyzed alkyne polymerizations: conversion of a trianionic pincer into a new tetraanionic pincer-type ligand Chemical Science, 2013, 4, 1145 |
| 1514560 | CIF | C45 H56 O3.5 W | P -1 | 9.4199; 12.183; 17.6797 93.621; 100.409; 102.237 | 1939.34 | McGowan, Kevin P.; O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Compelling mechanistic data and identification of the active species in tungsten-catalyzed alkyne polymerizations: conversion of a trianionic pincer into a new tetraanionic pincer-type ligand Chemical Science, 2013, 4, 1145 |
| 1514561 | CIF | C50 H55 O2.5 W | P 1 21/c 1 | 9.6683; 40.736; 21.0306 90; 97.047; 90 | 8220.3 | McGowan, Kevin P.; O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Compelling mechanistic data and identification of the active species in tungsten-catalyzed alkyne polymerizations: conversion of a trianionic pincer into a new tetraanionic pincer-type ligand Chemical Science, 2013, 4, 1145 |
| 1514562 | CIF | C70.11 H51.07 Cl4.87 N8 O4.24 Zn2 | P -1 | 11.1564; 16.8638; 17.2397 94.315; 93.4125; 108.645 | 3052.51 | Maeda, Hiromitsu; Nishimura, Takuma; Akuta, Ryo; Takaishi, Kazuto; Uchiyama, Masanobu; Muranaka, Atsuya Two double helical modes of bidipyrrin‒ZnII complexes Chemical Science, 2013, 4, 1204 |
| 1514563 | CIF | C32 H24 Br2 N4 Ni | P 1 21/n 1 | 12.324; 8.833; 25.104 90; 94.105; 90 | 2725.8 | Maeda, Hiromitsu; Nishimura, Takuma; Akuta, Ryo; Takaishi, Kazuto; Uchiyama, Masanobu; Muranaka, Atsuya Two double helical modes of bidipyrrin–ZnII complexes Chemical Science, 2013, 4, 1204 |
| 1514564 | CIF | C34 H25 Eu F18 N4 O7 | P 1 21/c 1 | 12.4834; 18.5861; 20.5491 90; 117.547; 90 | 4227.24 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514565 | CIF | C69 H50 Eu2 F36 N8 O14 | P 1 21/c 1 | 21.9162; 18.3619; 24.8681 90; 122.872; 90 | 8405.1 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514566 | CIF | C119 H90.5 Eu3 F54 N18.5 O20 | P -1 | 17.6614; 19.7308; 23.4654 95.2886; 96.678; 114.691 | 7288.8 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514567 | CIF | C38 H31 F18 Lu N6 O7 | P -1 | 12.2354; 14.4044; 14.8029 77.3039; 72.1925; 68.6551 | 2296.17 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514568 | CIF | C66 H54 F30 La2 N10 O14 | P -1 | 11.6721; 15.7298; 22.3967 78.307; 87.1599; 87.3088 | 4018.88 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514569 | CIF | C23 H25 N O4 | P 1 21/c 1 | 18.485; 5.944; 18.057 90; 92.841; 90 | 1982 | Xie, Jin; Xue, Qicai; Jin, Hongming; Li, Huamin; Cheng, Yixiang; Zhu, Chengjian A visible-light-promoted aerobic C–H/C–N cleavage cascade to isoxazolidine skeletons Chemical Science, 2013, 4, 1281 |
| 1514570 | CIF | C47 H53 La O2 P3 Se6 | P 42/n m c :2 | 31.601; 31.601; 10.671 90; 90; 90 | 10656 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514571 | CIF | C44 H46 Ce O2 P3 Se6 | P -1 | 9.8457; 13.0684; 19.024 88.6; 85.615; 70.493 | 2300.5 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514572 | CIF | C47 H53 Nd O2 P3 Se6 | P 42/n m c :2 | 31.4695; 31.4695; 10.6442 90; 90; 90 | 10541.3 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514573 | CIF | C40 H36 La N2 P3 Se6 | P 1 21/c 1 | 13.5653; 9.0111; 35.576 90; 91.945; 90 | 4346.2 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514574 | CIF | C44 H46 N0 O2 P3 Pu Se6 | P -1 | 13.344; 18.862; 20.428 79.465; 89.356; 70.12 | 4746 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514575 | CIF | C60 H68 Ce N O P4 Se8 | P 21 21 21 | 12.6878; 21.9927; 22.9089 90; 90; 90 | 6392.5 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514576 | CIF | C60 H68 N O P4 Pu Se8 | P 21 21 21 | 12.7053; 21.997; 22.902 90; 90; 90 | 6400.6 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514577 | CIF | C48 H40 P4 Se8 U | P 1 21 1 | 13.8131; 9.7933; 18.8547 90; 91.597; 90 | 2549.6 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514578 | CIF | C48 H40 Np P4 Se8 | P 1 21 1 | 13.8899; 9.9688; 18.862 90; 91.609; 90 | 2610.7 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514579 | CIF | C54 H78 Cl Ir N2 O2 | P 21 21 2 | 25.5236; 13.7422; 14.3634 90; 90; 90 | 5038 | Barnard, Jonathan H.; Wang, Chao; Berry, Neil G.; Xiao, Jianliang Long-range metal‒ligand bifunctional catalysis: cyclometallated iridium catalysts for the mild and rapid dehydrogenation of formic acid Chemical Science, 2013, 4, 1234 |
| 1514580 | CIF | C20 H26 Cl3 N2 Rh | P -1 | 10.499; 10.5404; 11.0455 63.986; 85.787; 69.884 | 1027.14 | Barnard, Jonathan H.; Wang, Chao; Berry, Neil G.; Xiao, Jianliang Long-range metal‒ligand bifunctional catalysis: cyclometallated iridium catalysts for the mild and rapid dehydrogenation of formic acid Chemical Science, 2013, 4, 1234 |
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