Crystallography Open Database
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Searching space group like 'P 63'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1001683 | CIF | O19 P5 Si V3 | P 63 | 14.4671; 14.4671; 7.4605 90; 90; 120 | 1352.3 | Leclaire, A; Chahboun, H; Groult, D; Raveau, B V3 P5 Si O19, a vanadosilicophospahte built up from V2 O9 octahedra clusters Journal of Solid State Chemistry, 1986, 65, 168-177 |
| 1004012 | CIF | Cu Ge La3 S7 | P 63 | 10.2935; 10.2935; 5.8619 90; 90; 120 | 537.89 | Poduska, K. M.; DiSalvo, F. J.; Min, K.; Halasyamani, P. S. Structure determination of La~3~CuGeS~7~ and La~3~CuGeSe~7~ Journal of Alloys and Compounds, 2002, 335, L5-L9 |
| 1005055 | CIF | Ge2 La6 Mg S14 | P 63 | 10.367; 10.367; 5.814 90; 90; 120 | 541.1 | Gitzendanner, R L; Spencer, C M; DiSalvo, F J; Pell, M A; Ibers, J A Synthesis and structure of a new quaternary rare-earth sulfide, La6 Mg Ge2 S14, and the related compound La6 Mg Si2 S14 Journal of Solid State Chemistry, 1997, 131, 399-404 |
| 1005056 | CIF | La6 Mg S14 Si2 | P 63 | 10.363; 10.363; 5.742 90; 90; 120 | 534 | Gitzendanner, R L; Spencer, C M; DiSalvo, F J; Pell, M A; Ibers, J A Synthesis and structure of a new quaternary rare-earth sulfide, La6 Mg Ge2 S14, and the related compound La6 Mg Si2 S14 Journal of Solid State Chemistry, 1997, 131, 399-404 |
| 1007038 | CIF | H9 Na2 O11 P Te | P 63 | 5.908; 5.908; 15.09 90; 90; 120 | 456.1 | Durif, A; Averbuch-Pouchot, M T; Guitel, J C Structures de deux phosphotellurates. Te (O H)~6~ ((N H~4~)~2~ H P O~4~)~2~ et Te (O H)~6~ (Na~2~ H P O~4~) (H~2~ O) Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1444-1447 |
| 1008710 | CIF | C12 H84 N36 O42 P12 | P 63 | 15.904; 15.904; 16.67 90; 90; 120 | 3651.6 | Schuelke, U; Averbuch-Pouchot, M T Preparation and crystal structure of guanidinium cyclododecaphosphate hexahydrate: (C (N H2)3)12 P12 O36 . 6(H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1995, 621, 1232-1236 |
| 1008753 | CIF | Al4 K Na3 O16 Si4 | P 63 | 10.01; 10.01; 8.405 90; 90; 120 | 729.4 | Buerger, M J; Klein, G E; Donnay, G Determination of the crystal structure of nepheline American Mineralogist, 1954, 39, 805-818 |
| 1008754 | CIF | Al4 K Na3 O16 Si4 | P 63 | 10.05; 10.05; 8.38 90; 90; 120 | 733 | Buerger, M J; Klein, G E; Hamburger, G The structure of nepheline American Mineralogist, 1947, 32, 197-197 |
| 1008761 | CIF | Al Na O4 Si | P 63 | 10.05; 10.05; 8.38 90; 90; 120 | 733 | Buerger, M J; Klein, G E; Hamburger, G Structure of Nepheline Geological Society of America, Bulletin, 1946, 57, 1182-1183 |
| 1010549 | CIF | C Al3 Ca Na3 O15 Si3 | P 63 | 12.72; 12.72; 5.18 90; 90; 120 | 725.8 | Kôzu, Shukusuké; Takané, Katsutoshi Crystal structure of Cancrinite from Dôdô, Korea, II Proceedings of the Imperial Academy (Tokyo), 1933, 9, 105-108 |
| 1011053 | CIF | C Si | P 63 | 3.095; 3.095; 15.17 90; 90; 120 | 125.8 | Ott, H Die Gitterstruktur des Karborunds ( Si C ) I. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1925, 61, 515-531 |
| 1100062 | CIF | Fe0.333 I2 Li O6 | P 63 | 5.4632; 5.4632; 5.0859 90; 90; 120 | 131.5 | Lan, Y; Chen, X; Tao, Z; Xie, A; Jiang, P; Xu, T; Xu, Y X-ray powder diffraction data and Rietveld refinement for a new iodate: (LiFe~1/3~)(IO~3~)~2~ Power Diffraction, 2002, 17, 132-134 |
| 1101055 | CIF | C20 H14 O2 | P 63 | 27.864; 27.864; 12.983 90; 90; 120 | 8729.7 | Yamamura, Kimiaki; Kawashima Taiga; Eda, Kazuo; Tajima, Fukue; Hashimoto, Masao Solid solution of triptycenequinone and triptycenehydroquinone as a non-stoichiometric quinhydrone. Bathochromic changes in color caused by local intermolecular interaction between p-benzoquinone and hydroquinone moieties Journal of Molecular Structure, 2005, 737, 1-6 |
| 1501943 | CIF | C20 H20 | P 63 | 17.959; 17.959; 7.9998 90; 90; 120 | 2234.5 | Krämer, Katja; Leong, Paul; Lautens, Mark Enantioselective palladium-catalyzed carbozincation of cyclopropenes. Organic letters, 2011, 13, 819-821 |
| 1503374 | CIF | C93 H81 Au Cl O9 P | P 63 | 15.923; 15.923; 18.741 90; 90; 120 | 4115 | González, Ana Z; Toste, F. Dean Gold(I)-catalyzed enantioselective [4 + 2]-cycloaddition of allene-dienes. Organic letters, 2010, 12, 200-203 |
| 1504395 | CIF | C H Cl3 | P 63 | 5.8868; 5.8868; 6.6541 90; 90; 120 | 199.7 | Dziubek, Kamil F.; Katrusiak, Andrzej Polar symmetry in new high-pressure phases of chloroform and bromoform. The journal of physical chemistry. B, 2008, 112, 12001-12009 |
| 1504396 | CIF | C H Br3 | P 63 | 6.3229; 6.3229; 7.285 90; 90; 120 | 252.2 | Dziubek, Kamil F.; Katrusiak, Andrzej Polar symmetry in new high-pressure phases of chloroform and bromoform. The journal of physical chemistry. B, 2008, 112, 12001-12009 |
| 1504397 | CIF | C H Br3 | P 63 | 6.3119; 6.3119; 7.151 90; 90; 120 | 246.7 | Dziubek, Kamil F.; Katrusiak, Andrzej Polar symmetry in new high-pressure phases of chloroform and bromoform. The journal of physical chemistry. B, 2008, 112, 12001-12009 |
| 1505482 | CIF | C84 H84 La Na3 O12 | P 63 | 15.2265; 15.2265; 18.1119 90; 90; 120 | 3636.6 | Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J. Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts. Organic letters, 2007, 9, 3359-3362 |
| 1505483 | CIF | C84 H84 Eu Na3 O12 | P 63 | 15.152; 15.152; 18.2 90; 90; 120 | 3619 | Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J. Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts. Organic letters, 2007, 9, 3359-3362 |
| 1505890 | CIF | C51 H54 N3 O4 P | P 63 | 16.645; 16.645; 9.0395 90; 90; 120 | 2168.9 | Du, Da-Ming; Fang, Tao; Xu, Jiaxi; Zhang, Shi-Wei Structurally well-defined, recoverable C3-symmetric tris(beta-hydroxy phosphoramide)-catalyzed enantioselective borane reduction of ketones. Organic letters, 2006, 8, 1327-1330 |
| 1509010 | CIF | Ag0.627 Ce3 Cl0.37 S6.63 Si | P 63 | 10.2898; 10.2898; 5.7334 90; 90; 120 | 525.723 | Schleid, T.; Hartenbach, I.; Nilges, T. Thiosilicates of the rare-earth elements. IV. The quasi-isostructural compounds Na Sm3 S3 [Si S4], Cu Ce3 S3 [Si S4], Ag0.63 Ce3 S2.63 Cl0.37 [Si S4] and Sm3 S2 Cl [Si S4] - synthesis, crystal structure and investigations of the silver-cation motion Zeitschrift fuer Anorganische und Allgemeine Chemie, 2007, 633, 2445-2452 |
| 1509439 | CIF | Ag La3 Se7 Si | P 63 | 10.576; 10.576; 5.987 90; 90; 120 | 579.94 | Lin, S.-H.; Huang, J.-S.; Guo, G.-C.; Mao, J.-G. Synthesis and crystal structure of a new quaternary compound: La3 Ag Se7 Si Journal of Alloys Compd., 1997, 252, 8-11 |
| 1509499 | CIF | Ag O4 P Zn | P 63 | 10.218; 10.218; 7.848 90; 90; 120 | 709.613 | Barbier, J.; Hammond, R.P.; Gallardo, C. Crystal structures and crystal chemistry of Ag X P O4 (X= Be, Zn) Journal of Solid State Chemistry, 1998, 141, 177-185 |
| 1509625 | CIF | Ag12 K2 Se7.11 | P 63 | 18.955; 18.955; 4.406 90; 90; 120 | 1370.95 | Emirdag, M.; Pennington, W.T.; Kolis, J.W.; Schimek, G.L. Synthesis of two new metallic alkali metal silver selenides, K2 Ag12 Se7.11 and Rb Ag5 Se3, from supercritical ethylenediamine Journal of Solid State Chemistry, 1999, 144, 287-296 |
| 1511212 | CIF | B La3 O9 W | P 63 | 8.869; 8.869; 5.447 90; 90; 120 | 371.054 | Gokhman, L.Z.; Dzhurinskii, B.F.; Efremov, V.A.; Ilyukhin, A.B.; Chistova, V.I. Synthesis and structure of boratotungstates Ln3BWO9 (Ln=La,Pr,Nd,Sm-Ho) Zhurnal Neorganicheskoi Khimii, 1994, 39, 1075-1079 |
| 1511248 | CIF | B Na O4 Si | P 63 | 8.035; 8.035; 7.703 90; 90; 120 | 430.688 | Sokolova, E.V.; Khomyakov, A.P. Crystal structure of a new natural Na-borosilicate with the framework of tridymite type. Doklady Akademii Nauk SSSR, 1991, 319, 879-883 |
| 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 |
| 1514971 | CIF | C90 H84 Ag3 B3 F12 N18 O6 | P 63 | 17.3366; 17.3366; 18.9739 90; 90; 120 | 4938.73 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514972 | CIF | C90 H84 Ag3 B3 F12 N18 O6 | P 63 | 17.3399; 17.3399; 18.6738 90; 90; 120 | 4862.47 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514973 | CIF | C90 H84 Ag3 N18 O6 | P 63 | 17.2761; 17.2761; 18.7097 90; 90; 120 | 4836.03 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514974 | CIF | C90 H84 Au3 B3 F12 N18 O6 | P 63 | 17.4164; 17.4164; 18.8187 90; 90; 120 | 4943.53 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1515606 | CIF | C37 H113 B4 N9 O Si12 | P 63 | 29.3467; 29.3467; 14.9405 90; 90; 120 | 11143.3 | Hansmann, Max M.; Melen, Rebecca L.; Wright, Dominic S. Group 13 BN dehydrocoupling reagents, similar to transition metal catalysts but with unique reactivity Chemical Science, 2011, 2, 1554 |
| 1520800 | CIF | H4 N O12 P3 Sn4 | P 63 | 9.6975; 9.6975; 8.0938 90; 90; 120 | 659.178 | Ayyappan, S.; Stock, N.; Chang, J.-S.; Hatfield, R.; Cheetham, A.K.; Rao, C.N.R. Synthesis, characterization and acid-base catalytic properties of ammonium-containing tin(II) phopshates: (N H4) (Sn4 P3 O12) and (N H4) (Sn P O4) International Journal of Inorganic Materials, 2000, 2, 21-27 |
| 1520920 | CIF | C0.932 Al6 Na7.262 O26.796 Si6 | P 63 | 12.6595; 12.6595; 5.1527 90; 90; 120 | 715.152 | Burton, A.; Feuerstein, M.; Lobo, R.F.; Chan, J.C.C. Characterization of cancrinite synthesized in 1,3-butanediol by Rietveld analysis of powder neutron diffraction data and solid state (23)Na NMR spectroscopy Microporous and Mesoporous Materials, 1999, 30, 293-305 |
| 1521953 | CIF | K Li O4 S | P 63 | 5.1421; 5.1421; 8.634 90; 90; 120 | 197.708 | Solans, X.; Calvet, M.T.; Bocanegra, E.H.; Martinez-Sarrion, M.L.; Mestres, L.; Bakkali, A.; Herraiz, M.; Mata, J. Thermal analysis and X-ray diffraction study on Li K S O4: a new phase transition Journal of Solid State Chemistry, 1999, 148, 316-324 |
| 1522874 | CIF | Al5 Mo | P 63 | 4.912; 4.912; 8.86 90; 90; 120 | 185.132 | Schuster, J.C.; Ipser, H. The Al - Al8 Mo3 section of the binary system aluminum- molybdenum Metallurgical Transactions A: Physical Metallurgy and Materials Science, 1991, 22, 1729-1738 |
| 1524245 | CIF | K0.13 Mo0.87 O3 V0.13 | P 63 | 10.481; 10.481; 3.701 90; 90; 120 | 352.091 | Darriet, B.; Galy, J. Une nouvelle structure a tunnels: Kx Vx Mo1-x O3 (x= 0.13) Journal of Solid State Chemistry, 1973, 8, 189-194 |
| 1524456 | CIF | N4 Si3 | P 63 | 7.595; 7.595; 2.9023 90; 90; 120 | 144.987 | Gruen, R. Neubestimmung der Struktur von beta Si3 N4 aus Einkristalldaten Fortschritte der Mineralogie, Beiheft, 1977, 55, 38-39 |
| 1524484 | CIF | Al0.5 Ba Fe1.5 O4 | P 63 | 10.81; 10.81; 8.707 90; 90; 120 | 881.151 | Harder, M. Zur Kristallstruktur von Ba Fex Al2-x O4 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 448, 135-142 |
| 1524697 | CIF | Al18 H15.64 K9 Na15 O88.82 S2 Si18 | P 63 | 22.13799; 22.13799; 5.248 90; 90; 120 | 2227.41 | Klaska, R.; Jarchow, O. Synthetischer Sulfat-hydrocancrinit vom Mikrosommit-Typ Naturwissenschaften, 1977, 64, 93-93 |
| 1525852 | CIF | Cd4 H9 O11.5 S | P 63 | 9.145; 9.145; 15.099 90; 90; 120 | 1093.57 | Louer, D.; Rius, J.; Louer, M.; Bennard-Rocherulle, P. Structural study of cadmium hydroxide sulfates. VI. The layer structure of Cd4 S O4 (O H)6 * 1.5(H2 O) studied from X-ray powder and single-crystal diffraction data Powder Diffraction, 2001, 16, 86-91 |
| 1526155 | CIF | B0.16 Ca4.79 Ce2.185 F1.77 H0.23 La1.134 Nd0.583 O24.23 P0.25 Pr0.218 Si5.57 Th0.72 U0.12 Y0.25 | P 63 | 9.547; 9.547; 6.991 90; 90; 120 | 551.828 | Oberti, R.; della Ventura, G.; Ottolini, L.; Parodi, G.C. On the symmetry and crystal chemistry of britholite: new structural and microanalytical data American Mineralogist, 2001, 86, 1066-1075 |
| 1526156 | CIF | Ca2.01 Ce3.378 F1.47 H0.53 La2.959 Na0.98 Nd0.429 O24.53 P0.75 Pr0.204 Si5.07 | P 63 | 9.682; 9.682; 7.066 90; 90; 120 | 573.633 | Oberti, R.; Ottolini, L.; Parodi, G.C.; della Ventura, G. On the symmetry and crystal chemistry of britholite: new structural and microanalytical data American Mineralogist, 2001, 86, 1066-1075 |
| 1526513 | CIF | Ba Ga2 O4 | P 63 | 18.64029; 18.64029; 8.6801 90; 90; 120 | 2611.93 | Kahlenberg, V.; Parise, J.B.; Fischer, R.X. The stuffed framework structure of Ba Ga2 O4 Journal of Solid State Chemistry, 2000, 154, 612-618 |
| 1526849 | CIF | Al6 Cs2 Ge7 H6 Na6 O30 | P 63 | 12.968; 12.968; 5.132 90; 90; 120 | 747.418 | Lee, Y.-J.; Parise, J.B.; Tripathi, A.; Kim, S.-J.; Vogt, T. Synthesis and crystal structures of gallium and germanium variants of cancrinite Microporous and Mesoporous Materials, 2000, 39, 445-455 |
| 1526988 | CIF | Cs0.273 Fe0.16 H2.1 K0.06 Na0.18 O5.05 P Zn | P 63 | 12.492; 12.492; 4.999 90; 90; 120 | 675.581 | Yakubovich, O.V.; Karimova, O.V.; Mel'nikov, O.K. A new representative of the cancrinite family (Cs, K)0.33 (Na0.18 Fe0.16 (H2 O)1.05) (Zn P O4): preparation and crystal structure Kristallografiya, 1994, 39, 630-634 |
| 1527010 | CIF | Al0.44 La3 S7 Si0.93 | P 63 | 10.277; 10.277; 5.793 90; 90; 120 | 529.867 | Yang, Y.-T.; Ibers, J.A. Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm) Journal of Solid State Chemistry, 2000, 155, 433-440 |
| 1528881 | CIF | Al6 B Ca H4 Na7 O29 Si6 | P 63 | 12.745; 12.745; 5.18 90; 90; 120 | 728.685 | Shirinova, A.F.; Samedov, H.R.; Khrustalev, V.N.; Chiragov, M.I. Hydrothermal synthesis and the crystal structure of borate cancrinite (Na, Ca) (Na6 (Al Si O4)6) (B O3) . 2H2 O Kristallografiya, 2006, 51, 44-47 |
| 1529813 | CIF | Al6.24 Na7.26 O31.98 Si9.76 | P 63 | 9.968; 9.968; 8.356 90; 90; 120 | 719.027 | Dollase, W.A.; Thomas, W.M. The crystal chemistry of silica-rich, alkali-deficient nepheline Contributions to Mineralogy and Petrology (23,1969-), 1978, 66, 311-318 |
| 1530697 | CIF | H3 O5 P Zn | P 63 | 10.689; 10.689; 8.708 90; 90; 120 | 861.635 | Sandomirskii, P.A.; Klientova, G.P.; Simonov, M.A.; Belov, N.V. The crystal structure of Zn H P O4 * H2 O = (H3 O) Zn P O4 Doklady Akademii Nauk SSSR, 1977, 236, 597-600 |
| 1530796 | CIF | C H4 Al6 Na8 O29 Si6 | P 63 | 12.635; 12.635; 5.114 90; 90; 120 | 707.037 | Smolin, Yu.I.; Shepelev, Yu.F.; Kobyakov, I.B.; Butikova, I.K. The crystal structure of cancrinite Kristallografiya, 1981, 26, 63-66 |
| 1530849 | CIF | Ca10 O24 P6 S0.95 | P 63 | 9.4554; 9.4554; 6.8405 90; 90; 120 | 529.637 | Sutich, P.R.; Taitai, A.; Lacout, J.L.; Young, R.A. Structural consequences of the coupled substitution of Eu, S in calcium sulfoapatite Journal of Solid State Chemistry, 1986, 63, 267-277 |
| 1530850 | CIF | Ca9.65 Eu0.35 O24 P6 S | P 63 | 9.5112; 9.5112; 6.803 90; 90; 120 | 532.969 | Sutich, P.R.; Taitai, A.; Lacout, J.L.; Young, R.A. Structural consequences of the coupled substitution of Eu, S in calcium sulfoapatite Journal of Solid State Chemistry, 1986, 63, 267-277 |
| 1530851 | CIF | Ca9.1 Eu0.9 O24 P6 S1.41 | P 63 | 9.5977; 9.5977; 6.7416 90; 90; 120 | 537.809 | Sutich, P.R.; Taitai, A.; Lacout, J.L.; Young, R.A. Structural consequences of the coupled substitution of Eu, S in calcium sulfoapatite Journal of Solid State Chemistry, 1986, 63, 267-277 |
| 1530852 | CIF | Ca8.63 Eu1.37 O24 P6 S1.55 | P 63 | 9.6285; 9.6285; 6.7325 90; 90; 120 | 540.536 | Sutich, P.R.; Taitai, A.; Lacout, J.L.; Young, R.A. Structural consequences of the coupled substitution of Eu, S in calcium sulfoapatite Journal of Solid State Chemistry, 1986, 63, 267-277 |
| 1530972 | CIF | Mo3 O19 P5 Si | P 63 | 14.692; 14.692; 7.394 90; 90; 120 | 1382.2 | Wang, S.-L.; Lii, K.-H.; Wang, C.-C. Mo3 P5 Si O19: A Molybdenum Phosphate Containing a Confacial Bioctahedral Molybdenum(III) Dimer with a Mo-Mo Bond Journal of Solid State Chemistry, 1988, 74, 409-413 |
| 1531556 | CIF | Fe3.56 H4 O9 Si1.44 | P 63 | 5.5; 5.5; 14.163 90; 90; 120 | 371.032 | Hybler, J.; Durovic, S.; Fabry, J.; Petricek, V. Refinement of the crystal structure of cronstedtite - 2H2 Clays and Clay Minerals (29,1981-), 2002, 50, 601-613 |
| 1531621 | CIF | Ba Ga4 O8 Sr | P 63 | 9.196; 9.196; 8.646 90; 90; 120 | 633.204 | Kubota, S.; Takahashi, T.; Yamane, H.; Shimada, M. A powder X-ray diffraction study of a new compound, Ba Sr Ga4 O8 Journal of Alloys Compd., 2002, 345, 105-109 |
| 1531771 | CIF | H0.12 K0.97 Li N0.03 O4 S | P 63 | 5.1412; 5.1412; 8.644 90; 90; 120 | 197.867 | Mata, J.; Molera, J.; Solans, X. Structural and vibrational studies of Li (Kx (N H4)1-x) S O4 and Li2 K N H4 (S O4)2 mixed crystals Journal of Solid State Chemistry, 2003, 173, 69-77 |
| 1531774 | CIF | H0.28 K0.93 Li N0.07 O4 S | P 63 | 5.152; 5.152; 8.642 90; 90; 120 | 198.654 | Mata, J.; Solans, X.; Molera, J. Structural and vibrational studies of Li (Kx (N H4)1-x) S O4 and Li2 K N H4 (S O4)2 mixed crystals Journal of Solid State Chemistry, 2003, 173, 69-77 |
| 1531777 | CIF | H4 K Li2 N O8 S2 | P 63 | 18.178; 18.178; 8.595 90; 90; 120 | 2459.62 | Mata, J.; Solans, X.; Molera, J. Structural and vibrational studies of Li (Kx (N H4)1-x) S O4 and Li2 K N H4 (S O4)2 mixed crystals Journal of Solid State Chemistry, 2003, 173, 69-77 |
| 1531927 | CIF | La0.025 Mn O3 Sr0.975 | P 63 | 5.447; 5.447; 9.089 90; 90; 120 | 233.54 | Nakano, H.; Mori, T.; Kamegashira, N. Structural analysis of La0.025 Sr0.975 Mn O3 with a new layered structure Journal of Alloys Compd., 2002, 343, 179-185 |
| 1531982 | CIF | Cu Ge La3 Se7 | P 63 | 10.725; 10.725; 6.133 90; 90; 120 | 610.939 | Poduska, K.M.; DiSalvo, F.J.; Min, K.; Halasyamani, P.S. Structure determination of La3 Cu Ge S7 and La3 Cu Ge Se7 Journal of Alloys Compd., 2002, 335, 5-9 |
| 1532521 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.756; 7.756; 9.469 90; 90; 120 | 493.299 | Kudoh, Y.; Kuribayashi, T.; Kagi, H.; Sasaki, S.; Tanaka, M. High-pressure structural study of phase-A, Mg7 Si2 H6 O14 using synchrotron radiation Journal of Physics: Condensed Matter, 2002, 14, 10491-10495 |
| 1532814 | CIF | I2 Mg O6 | P 63 | 5.4777; 5.4777; 5.1282 90; 90; 120 | 133.258 | Liang Jingkui; Yu Yu-De; Ding Shiling The structure and phase transitions of magnesium iodate crystals Wu Li Hsueh Pao (= Acta Physica Sinica), 1978, 27, 710-722 |
| 1534967 | CIF | Ga O9 P2 | P 63 | 9.048; 9.048; 16.718 90; 90; 120 | 1185.28 | Mamedov, N.D.; Gasymov, V.A.; Mustafaev, N.M.; Tagiev, D.B.; Mamedov, H.S. Hydrothermal synthesis and crystal structure of gallium and iron hydridophosphates Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy, 1991, 27, 84-87 |
| 1535044 | CIF | Na S7 Si Y3 | P 63 | 9.7657; 9.7657; 5.7061 90; 90; 120 | 471.278 | Hartenbach, I.; Schleid, T. Na Y3 S3 (Si S4): a sodium-containing yttrium sulfide thiosilicate with channel structure Journal of Solid State Chemistry, 2003, 171, 382-386 |
| 1535098 | CIF | Cd5 H O13 P3 | P 63 | 16.199; 16.199; 6.6485 90; 90; 120 | 1510.88 | Hata, M.; Marumo, F. Syntheses and superstructures of (Cd, M)5(PO4)3OH (M= Mn, Fe, Co, Ni, Cu, Hg) Mineralogical Journal (Japan), 1983, 11, 317-330 |
| 1535740 | CIF | Ba Ge O4 Zn | P 63 | 9.32; 9.32; 8.866 90; 90; 120 | 666.945 | Iijima, K.; Marumo, F.; Takei, H. Structural Changes of a Piezoelectric Crystal BaZnGeO~4~ on Thermal Phase Transition Journal of the Ceramic Association, Japan, 1983, 91, 67-72 |
| 1535818 | CIF | Al6.24 K0.25 Na6 O32 Si9.76 | P 63 | 9.974; 9.974; 8.36 90; 90; 120 | 720.237 | Dollase, W.A.; Thomas, W.M. The crystal chemistry of silica-rich, alkali-deficient nepheline Contributions to Mineralogy and Petrology (23,1969-), 1978, 66, 311-318 |
| 1536167 | CIF | Al3.33 Ce6 S14 | P 63 | 10.05; 10.05; 6.08 90; 90; 120 | 531.822 | de Saint-Giniez, D.; Laruelle, P.; Flahaut, J. Structure cristalline du sulfure double de cerium et d'aluminium Ce6 Al3.33 S14 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-), 1968, 267, 1029-1032 |
| 1536407 | CIF | C1.44 H4.88 Al6 Na8 O30.32 Si6 | P 63 | 12.644; 12.644; 5.146 90; 90; 120 | 712.475 | Kanepit, V.N.; Rider, E.E. The neutron diffraction study of cancrinite Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 1995, 36, 763-765 |
| 1536575 | CIF | Bi37 Br48 In | P 63 | 22.626; 22.626; 13.056 90; 90; 120 | 5788.37 | Dubenskiy, V.; Ruck, M. Br37 In Br48: ein polares Subhalogenid mit (Bi9)(5+)-Polykationen, komplexen Bromobismutat(III)-Anionen (Bi3 Br13)(4-) und (Bi7 Br30)(9-) sowie Pentabromoindat(III)-Anionen (In Br5)(2-) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 375-380 |
| 1536587 | CIF | Al N7 O Si5 | P 63 | 7.6072; 7.6072; 2.9274 90; 90; 120 | 146.711 | Khvatinskaya, D.Ya.; Loryan, V.E.; Em, V.T.; Smirnov, K.L. Neutronographic study of beta'-sialon structure Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy, 1991, 27, 2124-2126 |
| 1537077 | CIF | Ga2 La6 Mn2 S14 | P 63 | 10.215; 10.215; 6.024 90; 90; 120 | 544.368 | Rodier, N.; Flahaut, J.; Guittard, M. Structure cristalline de La6 Mn2 Ga2 S14 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (-1983), 1983, 296, 65-70 |
| 1539826 | CIF | Al6 Fe0.03 H9.57 Mg6.49 O38 P0.05 Si7.95 Ti0.6 Zr0.02 | P 63 | 12.24; 12.24; 4.925 90; 90; 120 | 638.998 | Comodi, P.; Zanazzi, P.F. Structural study of ellenbergerite. Part II: Effects of high pressure European Journal of Mineralogy (1,1989-), 1993, 5, 831-838 |
| 1539943 | CIF | C H28 Ca3 O24 S Si | P 63 | 10.95; 10.95; 10.3 90; 90; 120 | 1069.54 | Welin, E. The crystal structure of thaumasite Ca3 H2 (C O3 S O4) Si O4 (H2 O)13 Arkiv foer Mineralogi och Geologi, 1957, 2, 137-147 |
| 1539970 | CIF | C B3 Ca4 Mn3 O15 | P 63 | 10.606; 10.606; 5.879 90; 90; 120 | 572.713 | Yakubovich, O.V.; Simonov, M.A.; Belov, N.V. Structure refinement for Gaudefroyite Kristallografiya, 1975, 20, 152-155 |
| 1541221 | CIF | Al H4.66 O6.33 P | P 63 | 18.9752; 18.9752; 8.1044 90; 90; 120 | 2527.11 | McCusker, L.B.; Baerlocher, C.; Jahn, E.; Buelow, M. The triple helix inside the large-pore aluminophosphate molecular sieve VPI-5 Zeolites, 1991, 11, 308-313 |
| 1541228 | CIF | Al6 H4 K2 Na6 O30 S Si6 | P 63 | 22.121; 22.121; 5.221 90; 90; 120 | 2212.55 | Merlino, S.; Leoni, L.; Bonaccorsi, E.; Pasero, M.; Mellini, M.; Orlandi, P. Pitiglianoite, a new feldspathoid from southern Tuscany, Italy: Chemical composition and crystal structure American Mineralogist, 1991, 76, 2003-2008 |
| 1541317 | CIF | Al6 Cs1.5 H11.16 Li4.56 O29.58 Si6 | P 63 | 12.4328; 12.4328; 4.9692 90; 90; 120 | 665.204 | Norby, P.; Krogh Andersen, I.G.; Colella, C.; Krogh Andersen, E.; de'Gennaro, M. Synthesis and structure of lithium cesium and lithium thallium cancrinites Zeolites, 1991, 11, 248-253 |
| 1541501 | CIF | C42 H126 Ga6 Si18 | P 63 | 24.849; 24.849; 12.214 90; 90; 120 | 6531.4 | Linti, G.; Dutta, D.; Coban, S. Das Hexagallan (Ga6 (Si Me (Si Me3)2)6) und das closo-hexagallanat (Ga6 (Si (C Me3)3)4 (C H2 C6 H5)2)(2-) - der Uebergang zu einem ungewoehnlichen precloso-cluster Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 319-323 |
| 1541810 | CIF | Al6 Na8.16 O29.02 Si6 | P 63 | 12.67; 12.67; 5.19 90; 90; 120 | 721.525 | Barrer, R.M.; Cole, J.F.; Villiger, H. Chemistry of soil minerals. part VII. Synthesis, properties, and crystal structures of salt-filled cancrinites Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971), 1970, 1970, 1523-1531 |
| 1542106 | CIF | Al6 Na7.14 Si6 | P 63 | 12.72; 12.72; 5.19 90; 90; 120 | 727.231 | Barrer, R.M.; Cole, J.F.; Villiger, H. Chemistry of soil minerals. part VII. Synthesis, properties, and crystal structures of salt-filled cancrinites Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971), 1970, 1970, 1523-1531 |
| 1543281 | CIF | C126.5 H171 Cl13 N6 O6 S2 U2 | P 63 | 20.258; 20.258; 18.302 90; 90; 120 | 6505 | Rosenzweig, Michael W.; Scheurer, Andreas; Lamsfus, Carlos A.; Heinemann, Frank W.; Maron, Laurent; Andrez, Julie; Mazzanti, Marinella; Meyer, Karsten Uranium(iv) terminal hydrosulfido and sulfido complexes: insights into the nature of the uranium‒sulfur bond Chem. Sci., 2016, 7, 5857 |
| 1543283 | CIF | C78 H114 K N5 O9 S U | P 63 | 14.9009; 14.9009; 19.249 90; 90; 120 | 3701.4 | Rosenzweig, Michael W.; Scheurer, Andreas; Lamsfus, Carlos A.; Heinemann, Frank W.; Maron, Laurent; Andrez, Julie; Mazzanti, Marinella; Meyer, Karsten Uranium(iv) terminal hydrosulfido and sulfido complexes: insights into the nature of the uranium‒sulfur bond Chem. Sci., 2016, 7, 5857 |
| 1544364 | CIF | O7 P2 Si | P 63 | 4.7158; 4.7158; 11.917 90; 90; 120 | 229.51 | Poojary, D.M.; Borade, R.B.; Campbell, III, F.L.; Clearfield, A. Crystal structure of silicon pyrophosphate (form I) from powder diffraction data Journal of Solid State Chemistry, 1994, 112, 106-112 |
| 1544570 | CIF | La9.33 O26 Si6 | P 63 | 9.72; 9.72; 7.1859 90; 90; 120 | 587.96 | Ueda, K. Effect of Al-doping on crystal structure and ionic conductivity of apatite-type La9.33+x/3Si6-xAlxO26 solid electrolytes Journal of the Ceramic Society of Japan, 2012, 120, 74-76 |
| 1544571 | CIF | Al2 La10 O26 Si4 | P 63 | 9.715; 9.715; 7.233 90; 90; 120 | 591.2 | Ueda, K. Effect of Al-doping on crystal structure and ionic conductivity of apatite-type La9.33+x/3Si6-xAlxO26 solid electrolytes Journal of the Ceramic Society of Japan, 2012, 120, 74-76 |
| 1544572 | CIF | Al La9.67 O26 Si5 | P 63 | 9.716; 9.716; 7.213 90; 90; 120 | 589.69 | Ueda, K. Effect of Al-doping on crystal structure and ionic conductivity of apatite-type La9.33+x/3Si6-xAlxO26 solid electrolytes Journal of the Ceramic Society of Japan, 2012, 120, 74-76 |
| 1544573 | CIF | Al0.5 La9.5 O26 Si5.5 | P 63 | 9.723; 9.723; 7.205 90; 90; 120 | 589.88 | Ueda, K. Effect of Al-doping on crystal structure and ionic conductivity of apatite-type La9.33+x/3Si6-xAlxO26 solid electrolytes Journal of the Ceramic Society of Japan, 2012, 120, 74-76 |
| 1544574 | CIF | Al1.5 La9.8 O26 Si4.5 | P 63 | 9.717; 9.717; 7.227 90; 90; 120 | 590.95 | Ueda, K. Effect of Al-doping on crystal structure and ionic conductivity of apatite-type La9.33+x/3Si6-xAlxO26 solid electrolytes Journal of the Ceramic Society of Japan, 2012, 120, 74-76 |
| 1544593 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.8604; 7.8604; 9.5702 90; 90; 120 | 512.08 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 1 atm Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544594 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.768; 7.768; 9.496 90; 90; 120 | 496.2 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 3.6 GPa Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544595 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.751; 7.751; 9.475 90; 90; 120 | 492.98 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 4.4 GPa Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544596 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.708; 7.708; 9.435 90; 90; 120 | 485.5 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 6.2 GPa Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544597 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.649; 7.649; 9.381 90; 90; 120 | 475.3 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 9.1 GPa Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544598 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.644; 7.644; 9.372 90; 90; 120 | 474.25 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 9.4 GPa Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544599 | CIF | H6 Mg7 O14 Si2 | P 63 | 7.624; 7.624; 9.347 90; 90; 120 | 470.5 | Kuribayashi, T.; Kudoh, Y.; Kagi, H. Compressibility of phase A, Mg7Si2H6O14 up to 11.2 GPa : Sample at 10.8 GPa Journal of Mineralogical and Petrological Sciences, 2003, 98, 215-234 |
| 1544617 | CIF | C1.21 Al5.71 Ca0.95 Na6.84 O24 S0.15 Si6.3 | P 63 | 12.604; 12.604; 5.1144 90; 90; 120 | 703.6 | Isupova, D.; Ida, A.; Kihara, K.; Morishita, T.; Bulka, G. Asymmetric thermal vibrations of atoms and pyroelectricity in cancrinite : Sample at 173 K Journal of Mineralogical and Petrological Sciences, 2010, 105, 29-41 |
| 1544618 | CIF | C1.21 Al5.71 Ca0.95 Na6.84 O24 S0.15 Si6.3 | P 63 | 12.631; 12.631; 5.132 90; 90; 120 | 709.1 | Isupova, D.; Ida, A.; Kihara, K.; Morishita, T.; Bulka, G. Asymmetric thermal vibrations of atoms and pyroelectricity in cancrinite : Sample at 293 K Journal of Mineralogical and Petrological Sciences, 2010, 105, 29-41 |
| 1544619 | CIF | C1.21 Al5.71 Ca0.95 Na6.84 O24 S0.15 Si6.3 | P 63 | 12.659; 12.659; 5.1676 90; 90; 120 | 717.2 | Isupova, D.; Ida, A.; Kihara, K.; Morishita, T.; Bulka, G. Asymmetric thermal vibrations of atoms and pyroelectricity in cancrinite : Sample at 473 K Journal of Mineralogical and Petrological Sciences, 2010, 105, 29-41 |
| 1544620 | CIF | C1.21 Al5.71 Ca0.95 Na6.84 O24 S0.15 Si6.3 | P 63 | 12.681; 12.681; 5.1827 90; 90; 120 | 721.8 | Isupova, D.; Ida, A.; Kihara, K.; Morishita, T.; Bulka, G. Asymmetric thermal vibrations of atoms and pyroelectricity in cancrinite : Sample at 673 K Journal of Mineralogical and Petrological Sciences, 2010, 105, 29-41 |
| 1545484 | CIF HKL Paper | C15 H26 O | P 63 | 16.2421; 16.2421; 8.9182 90; 90; 120 | 2037.5 | Inoue, Yutaka Patchouli alcohol: 4α,8aβ,9,9-tetramethyl-3,4,4aβ,5,6β,7,8,8a-octahydro-1,6-methanonaphthalen-1β(2<i>H</i>)-ol IUCrData, 2017, 2, x170189 |
| 1546122 | CIF | C151 H214 Cl2 N24 O10 | P 63 | 17.5938; 17.5938; 32.2344 90; 90; 120 | 8641.1 | Hasell, T.; Little, M. A.; Chong, S. Y.; Schmidtmann, M.; Briggs, M. E.; Santolini, V.; Jelfs, K. E.; Cooper, A. I. Chirality as a tool for function in porous organic cages. Nanoscale, 2017, 9, 6783-6790 |
| 1549262 | CIF | C24 H106 Ca Cu6 N6 O66 | P 63 | 17.8904; 17.8904; 12.7999 90; 90; 120 | 3547.9 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549263 | CIF | C48.4 H80.2 Ca Cu6 N11 O37.6 | P 63 | 17.9504; 17.9504; 12.5603 90; 90; 120 | 3504.9 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549264 | CIF | C42 H83 Ca Cu6 N9 O54 | P 63 | 17.9607; 17.9607; 12.6765 90; 90; 120 | 3541.4 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549265 | CIF | C42 H89 Ca Cu6 N9 O51 | P 63 | 17.9035; 17.9035; 12.6421 90; 90; 120 | 3509.3 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549266 | CIF | C37 H90 Ca Cl Cu6 N7 O50 | P 63 | 17.997; 17.997; 12.861 90; 90; 120 | 3607.5 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549423 | CIF | C18 H17 N Na O5 | P 63 | 20.8091; 20.8091; 6.5883 90; 90; 120 | 2470.6 | Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M. Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs). Chemical science, 2018, 9, 5233-5241 |
| 1549424 | CIF | C18 H17 N Na O5 | P 63 | 20.7637; 20.7637; 6.5915 90; 90; 120 | 2461.07 | Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M. Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs). Chemical science, 2018, 9, 5233-5241 |
| 1550288 | CIF | Al3.96 K0.48 Na3.48 O16 Si4.04 | P 63 | 9.989; 9.989; 8.38 90; 90; 120 | 724.1 | Gregorkiewitz Michael Crystal Structure and Al/Si-ordering of a synthetic nepheline Bulletin de Mineralogie, 1984, 107, 499-507 |
| 1550579 | CIF | C26 H24 Br N3 O3 S | P 63 | 17.66; 17.66; 13.5994 90; 90; 120 | 3673.1 | JARRIGE , Lucie; Glavač, Danijel; Levitre, Guillaume; Retailleau, Pascal; Bernadat, Guillaume; Neuville, luc; Masson, Geraldine Chiral Phosphoric Acid-Catalyzed Enantioselective Construction of Structurally Diverse Benzothiazolopyrimidines Chemical Science, 2019 |
| 1550865 | CIF | Al2 O4 Sr | P 63 | 8.926; 8.926; 8.4985 90; 90; 120 | 586.39 | Fukuda, K.; Fukushima, K. Crystal structure of hexagonal SrAl2O4 at 1073 K Journal of Sold State Chemistry, 2005, 178, 2709-2714 |
| 1552440 | CIF | I6 Li2 Mg2 O18 | P 63 | 9.4139; 9.4139; 5.1807 90; 90; 120 | 397.611 | Chen, Jin; Hu, Chun-Li; Mao, Fei Fei; Zhang, Xiao-Han; Yang, Bing-Ping; Mao, Jiang-Gao LiMg(IO3)3: An excellent SHG material designed by single-site aliovalent substitution Chemical Science, 2019 |
| 1557437 | CIF | C172 H168 Ca F21 N24 O30 Rh6 S7 | P 63 | 23.302; 23.302; 21.347 90; 90; 120 | 10038 | Dang, Li-Long; Gao, Xiang; Lin, Yue-Jian; Jin, Guo-Xin s-Block metal ions induce structural transformations between figure-eight and double trefoil knots Chemical Science, 2020, 11, 1226-1232 |
| 1557439 | CIF | C170 H185 F24 N24 O34.5 Rh6 S8 Sr | P 63 | 22.673; 22.673; 20.482 90; 90; 120 | 9118 | Dang, Li-Long; Gao, Xiang; Lin, Yue-Jian; Jin, Guo-Xin s-Block metal ions induce structural transformations between figure-eight and double trefoil knots Chemical Science, 2020, 11, 1226-1232 |
| 1557440 | CIF | C173 H189 F24 N24 O37.5 Rh6 S8 Sr | P 63 | 22.564; 22.564; 20.375 90; 90; 120 | 8984 | Dang, Li-Long; Gao, Xiang; Lin, Yue-Jian; Jin, Guo-Xin s-Block metal ions induce structural transformations between figure-eight and double trefoil knots Chemical Science, 2020, 11, 1226-1232 |
| 1557894 | CIF | C20 H25 Cl O6 | P 63 | 21.5791; 21.5791; 8.5971 90; 90; 120 | 3466.96 | Zhou, Jia; Gao, Ying; Chang, Jin-Ling; Yu, Heng-Yi; Chen, Juan; Zhou, Ming; Meng, Xiang-Gao; Ruan, Han-Li Resorcylic Acid Lactones from an Ilyonectria sp. Journal of Natural Products, 2020 |
| 1560462 | CIF | Co0.5 Ge La3 S7 | P 63 | 10.3179; 10.3179; 5.8107 90; 90; 120 | 535.72 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560463 | CIF | Ce3 Co0.5 Ge S7 | P 63 | 10.206; 10.206; 5.7906 90; 90; 120 | 522.4 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560464 | CIF | Co0.5 Ge Pr3 S7 | P 63 | 10.1306; 10.1306; 5.7785 90; 90; 120 | 513.59 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560465 | CIF | Co0.5 Ge Nd3 S7 | P 63 | 10.0775; 10.0775; 5.7704 90; 90; 120 | 507.51 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560466 | CIF | Co0.5 Ge S7 Sm3 | P 63 | 9.9742; 9.9742; 5.7393 90; 90; 120 | 494.48 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560467 | CIF | Ge La3 Ni0.5 S7 | P 63 | 10.2983; 10.2983; 5.8078 90; 90; 120 | 533.42 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560468 | CIF | Ce3 Ge Ni0.5 S7 | P 63 | 10.2052; 10.2052; 5.7921 90; 90; 120 | 522.41 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560469 | CIF | Ge Ni0.5 Pr3 S7 | P 63 | 10.1303; 10.1303; 5.7752 90; 90; 120 | 513.27 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560470 | CIF | Ge Nd3 Ni0.5 S7 | P 63 | 10.076; 10.076; 5.7605 90; 90; 120 | 506.49 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560471 | CIF | Ge Ni0.5 S7 Sm3 | P 63 | 9.9642; 9.9642; 5.7436 90; 90; 120 | 493.86 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1560472 | CIF | Pd0.5 S7 Si Y3 | P 63 | 9.7891; 9.7891; 5.684 90; 90; 120 | 471.7 | Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7 Journal of Solid State Chemistry, 2017, 250, 14-23 |
| 1561360 | CIF | Ga1.67 La3 S7 | P 63 | 10.1772; 10.1772; 6.0648 90; 90; 120 | 544.01 | Iyer, Abishek K.; Yin, Wenlong; Rudyk, Brent W.; Lin, Xinsong; Nilges, Tom; Mar, Arthur Metal ion displacements in noncentrosymmetric chalcogenides La3Ga1.67S7, La3Ag0.6GaCh7 (Ch=S, Se), and La3MGaSe7 (M=Zn, Cd) Journal of Solid State Chemistry, 2016, 243, 221-231 |
| 1561361 | CIF | Ag0.6 Ga La3 S7 | P 63 | 10.229; 10.229; 6.0529 90; 90; 120 | 548.48 | Iyer, Abishek K.; Yin, Wenlong; Rudyk, Brent W.; Lin, Xinsong; Nilges, Tom; Mar, Arthur Metal ion displacements in noncentrosymmetric chalcogenides La3Ga1.67S7, La3Ag0.6GaCh7 (Ch=S, Se), and La3MGaSe7 (M=Zn, Cd) Journal of Solid State Chemistry, 2016, 243, 221-231 |
| 1561362 | CIF | Ag0.6 Ga La3 Se7 | P 63 | 10.5879; 10.5879; 6.3766 90; 90; 120 | 619.07 | Iyer, Abishek K.; Yin, Wenlong; Rudyk, Brent W.; Lin, Xinsong; Nilges, Tom; Mar, Arthur Metal ion displacements in noncentrosymmetric chalcogenides La3Ga1.67S7, La3Ag0.6GaCh7 (Ch=S, Se), and La3MGaSe7 (M=Zn, Cd) Journal of Solid State Chemistry, 2016, 243, 221-231 |
| 1561363 | CIF | Ga La3 Se7 Zn | P 63 | 10.63; 10.63; 6.374 90; 90; 120 | 623.7 | Iyer, Abishek K.; Yin, Wenlong; Rudyk, Brent W.; Lin, Xinsong; Nilges, Tom; Mar, Arthur Metal ion displacements in noncentrosymmetric chalcogenides La3Ga1.67S7, La3Ag0.6GaCh7 (Ch=S, Se), and La3MGaSe7 (M=Zn, Cd) Journal of Solid State Chemistry, 2016, 243, 221-231 |
| 1561364 | CIF | Cd Ga La3 Se7 | P 63 | 10.606; 10.606; 6.38 90; 90; 120 | 621.5 | Iyer, Abishek K.; Yin, Wenlong; Rudyk, Brent W.; Lin, Xinsong; Nilges, Tom; Mar, Arthur Metal ion displacements in noncentrosymmetric chalcogenides La3Ga1.67S7, La3Ag0.6GaCh7 (Ch=S, Se), and La3MGaSe7 (M=Zn, Cd) Journal of Solid State Chemistry, 2016, 243, 221-231 |
| 1561845 | CIF | Cu Ga La3 Se7 | P 63 | 10.626; 10.626; 6.392 90; 90; 120 | 625 | Iyer, Abishek K.; Rudyk, Brent W.; Lin, Xinsong; Singh, Harpreet; Sharma, Arzoo Z.; Wiebe, Christopher R.; Mar, Arthur Noncentrosymmetric rare-earth copper gallium chalcogenides RE3CuGaCh7 (RE=La‒Nd; Ch=S, Se): An unexpected combination Journal of Solid State Chemistry, 2015, 229, 150-159 |
| 1561846 | CIF | Ce3 Cu Ga Se7 | P 63 | 10.6007; 10.6007; 6.3775 90; 90; 120 | 620.65 | Iyer, Abishek K.; Rudyk, Brent W.; Lin, Xinsong; Singh, Harpreet; Sharma, Arzoo Z.; Wiebe, Christopher R.; Mar, Arthur Noncentrosymmetric rare-earth copper gallium chalcogenides RE3CuGaCh7 (RE=La‒Nd; Ch=S, Se): An unexpected combination Journal of Solid State Chemistry, 2015, 229, 150-159 |
| 1561847 | CIF | Cu Ga Pr3 Se7 | P 63 | 10.4181; 10.4181; 6.3743 90; 90; 120 | 599.16 | Iyer, Abishek K.; Rudyk, Brent W.; Lin, Xinsong; Singh, Harpreet; Sharma, Arzoo Z.; Wiebe, Christopher R.; Mar, Arthur Noncentrosymmetric rare-earth copper gallium chalcogenides RE3CuGaCh7 (RE=La‒Nd; Ch=S, Se): An unexpected combination Journal of Solid State Chemistry, 2015, 229, 150-159 |
| 1561848 | CIF | Cu Ga Nd3 Se7 | P 63 | 10.3426; 10.3426; 6.3869 90; 90; 120 | 591.67 | Iyer, Abishek K.; Rudyk, Brent W.; Lin, Xinsong; Singh, Harpreet; Sharma, Arzoo Z.; Wiebe, Christopher R.; Mar, Arthur Noncentrosymmetric rare-earth copper gallium chalcogenides RE3CuGaCh7 (RE=La‒Nd; Ch=S, Se): An unexpected combination Journal of Solid State Chemistry, 2015, 229, 150-159 |
| 1561907 | CIF | La3 S7 Sb0.33 Si | P 63 | 10.37; 10.37; 5.7549 90; 90; 120 | 536 | Zhao, Hua-Jun Syntheses, crystal structures, and NLO properties of the quaternary sulfides RE3Sb0.33SiS7 (RE=La, Pr) Journal of Solid State Chemistry, 2015, 227, 5-9 |
| 1561908 | CIF | Pr3 S7 Sb0.33 Si | P 63 | 10.224; 10.224; 5.711 90; 90; 120 | 517 | Zhao, Hua-Jun Syntheses, crystal structures, and NLO properties of the quaternary sulfides RE3Sb0.33SiS7 (RE=La, Pr) Journal of Solid State Chemistry, 2015, 227, 5-9 |
| 1562477 | CIF | Fe Ga La3 S7 | P 63 | 10.1795; 10.1795; 6.0217 90; 90; 120 | 540.38 | Rudyk, Brent W.; Stoyko, Stanislav S.; Oliynyk, Anton O.; Mar, Arthur Rare-earth transition-metal gallium chalcogenides RE3MGaCh7 (M=Fe, Co, Ni; Ch=S, Se) Journal of Solid State Chemistry, 2014, 210, 79-88 |
| 1562478 | CIF | Fe Ga Pr3 S7 | P 63 | 9.9846; 9.9846; 6.0303 90; 90; 120 | 520.63 | Rudyk, Brent W.; Stoyko, Stanislav S.; Oliynyk, Anton O.; Mar, Arthur Rare-earth transition-metal gallium chalcogenides RE3MGaCh7 (M=Fe, Co, Ni; Ch=S, Se) Journal of Solid State Chemistry, 2014, 210, 79-88 |
| 1562479 | CIF | Fe Ga S7 Tb3 | P 63 | 9.6411; 9.6411; 6.1024 90; 90; 120 | 491.23 | Rudyk, Brent W.; Stoyko, Stanislav S.; Oliynyk, Anton O.; Mar, Arthur Rare-earth transition-metal gallium chalcogenides RE3MGaCh7 (M=Fe, Co, Ni; Ch=S, Se) Journal of Solid State Chemistry, 2014, 210, 79-88 |
| 1562480 | CIF | Co Ga La3 S7 | P 63 | 10.1691; 10.1691; 6.008 90; 90; 120 | 538.05 | Rudyk, Brent W.; Stoyko, Stanislav S.; Oliynyk, Anton O.; Mar, Arthur Rare-earth transition-metal gallium chalcogenides RE3MGaCh7 (M=Fe, Co, Ni; Ch=S, Se) Journal of Solid State Chemistry, 2014, 210, 79-88 |
| 1562481 | CIF | Co Ga S7 Tb3 | P 63 | 9.6216; 9.6216; 6.0972 90; 90; 120 | 488.83 | Rudyk, Brent W.; Stoyko, Stanislav S.; Oliynyk, Anton O.; Mar, Arthur Rare-earth transition-metal gallium chalcogenides RE3MGaCh7 (M=Fe, Co, Ni; Ch=S, Se) Journal of Solid State Chemistry, 2014, 210, 79-88 |
| 1562499 | CIF | Fe In La3 S7 | P 63 | 10.1276; 10.1276; 6.2864 90; 90; 120 | 558.4 | Rudyk, Brent W.; Stoyko, Stanislav S.; Mar, Arthur Rare-earth transition-metal indium sulphides RE3FeInS7 (RE=La‒Pr), RE3CoInS7 (RE=La, Ce), and La3NiInS7 Journal of Solid State Chemistry, 2013, 208, 78-85 |
| 1562500 | CIF | Ce3 Fe In S7 | P 63 | 10.028; 10.028; 6.272 90; 90; 120 | 546.22 | Rudyk, Brent W.; Stoyko, Stanislav S.; Mar, Arthur Rare-earth transition-metal indium sulphides RE3FeInS7 (RE=La‒Pr), RE3CoInS7 (RE=La, Ce), and La3NiInS7 Journal of Solid State Chemistry, 2013, 208, 78-85 |
| 1562501 | CIF | Fe In Pr3 S7 | P 63 | 9.951; 9.951; 6.2593 90; 90; 120 | 536.77 | Rudyk, Brent W.; Stoyko, Stanislav S.; Mar, Arthur Rare-earth transition-metal indium sulphides RE3FeInS7 (RE=La‒Pr), RE3CoInS7 (RE=La, Ce), and La3NiInS7 Journal of Solid State Chemistry, 2013, 208, 78-85 |
| 1562502 | CIF | Co In La3 S7 | P 63 | 10.1307; 10.1307; 6.2762 90; 90; 120 | 557.84 | Rudyk, Brent W.; Stoyko, Stanislav S.; Mar, Arthur Rare-earth transition-metal indium sulphides RE3FeInS7 (RE=La‒Pr), RE3CoInS7 (RE=La, Ce), and La3NiInS7 Journal of Solid State Chemistry, 2013, 208, 78-85 |
| 1562503 | CIF | In La3 Ni S7 | P 63 | 10.147; 10.147; 6.2827 90; 90; 120 | 560.21 | Rudyk, Brent W.; Stoyko, Stanislav S.; Mar, Arthur Rare-earth transition-metal indium sulphides RE3FeInS7 (RE=La‒Pr), RE3CoInS7 (RE=La, Ce), and La3NiInS7 Journal of Solid State Chemistry, 2013, 208, 78-85 |
| 1562645 | CIF | Fe Ga S7 Sm3 | P 63 | 9.7876; 9.7876; 6.0989 90; 90; 120 | 505.98 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1562646 | CIF | Fe Ga Gd3 S7 | P 63 | 9.6933; 9.6933; 6.1281 90; 90; 120 | 498.65 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1562647 | CIF | Fe Ga Nd3 S7 | P 63 | 9.9041; 9.9041; 6.0722 90; 90; 120 | 515.83 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1562648 | CIF | Dy3 Fe Ga S7 | P 63 | 9.5946; 9.5946; 6.1114 90; 90; 120 | 487.22 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1562649 | CIF | Dy3 Fe Ga Se7 | P 63 | 9.9956; 9.9956; 6.398 90; 90; 120 | 553.6 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1562650 | CIF | Fe Ga Nd3 Se7 | P 63 | 10.2453; 10.2453; 6.4076 90; 90; 120 | 582.47 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1562651 | CIF | Fe Ga Gd3 Se7 | P 63 | 10.0762; 10.0762; 6.4265 90; 90; 120 | 565.07 | Yin, Wenlong; Wang, Wendong; Kang, Lei; Lin, Zheshuai; Feng, Kai; Shi, Youguo; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng Ln3FeGaQ7: A new series of transition-metal rare-earth chalcogenides Journal of Solid State Chemistry, 2013, 202, 269-275 |
| 1563308 | CIF | B3.33 Dy6 S14 | P 63 | 9.4044; 9.4044; 5.8855 90; 90; 120 | 450.79 | Borna, Marija; Hunger, Jens; Ormeci, Alim; Zahn, Dirk; Burkhardt, Ulrich; Carrillo-Cabrera, Wilder; Cardoso-Gil, Raul; Kniep, Rüdiger High-pressure high-temperature synthesis and crystal structure of the isotypic rare earth (RE)‒thioborate‒sulfides RE9[BS3]2[BS4]3S3, (RE=Dy‒Lu) Journal of Solid State Chemistry, 2011, 184, 296-303 |
| 1563309 | CIF | B3.33 Er6 S14 | P 63 | 9.3279; 9.3279; 5.8793 90; 90; 120 | 443.02 | Borna, Marija; Hunger, Jens; Ormeci, Alim; Zahn, Dirk; Burkhardt, Ulrich; Carrillo-Cabrera, Wilder; Cardoso-Gil, Raul; Kniep, Rüdiger High-pressure high-temperature synthesis and crystal structure of the isotypic rare earth (RE)‒thioborate‒sulfides RE9[BS3]2[BS4]3S3, (RE=Dy‒Lu) Journal of Solid State Chemistry, 2011, 184, 296-303 |
| 1563310 | CIF | B3.33 Ho6 S14 | P 63 | 9.3703; 9.3703; 5.8826 90; 90; 120 | 447.308 | Borna, Marija; Hunger, Jens; Ormeci, Alim; Zahn, Dirk; Burkhardt, Ulrich; Carrillo-Cabrera, Wilder; Cardoso-Gil, Raul; Kniep, Rüdiger High-pressure high-temperature synthesis and crystal structure of the isotypic rare earth (RE)‒thioborate‒sulfides RE9[BS3]2[BS4]3S3, (RE=Dy‒Lu) Journal of Solid State Chemistry, 2011, 184, 296-303 |
| 1563311 | CIF | B3.33 Lu6 S14 | P 63 | 9.2162; 9.2162; 5.8911 90; 90; 120 | 433.34 | Borna, Marija; Hunger, Jens; Ormeci, Alim; Zahn, Dirk; Burkhardt, Ulrich; Carrillo-Cabrera, Wilder; Cardoso-Gil, Raul; Kniep, Rüdiger High-pressure high-temperature synthesis and crystal structure of the isotypic rare earth (RE)‒thioborate‒sulfides RE9[BS3]2[BS4]3S3, (RE=Dy‒Lu) Journal of Solid State Chemistry, 2011, 184, 296-303 |
| 1563312 | CIF | B3.33 S14 Tm6 | P 63 | 9.2869; 9.2869; 5.8781 90; 90; 120 | 439.05 | Borna, Marija; Hunger, Jens; Ormeci, Alim; Zahn, Dirk; Burkhardt, Ulrich; Carrillo-Cabrera, Wilder; Cardoso-Gil, Raul; Kniep, Rüdiger High-pressure high-temperature synthesis and crystal structure of the isotypic rare earth (RE)‒thioborate‒sulfides RE9[BS3]2[BS4]3S3, (RE=Dy‒Lu) Journal of Solid State Chemistry, 2011, 184, 296-303 |
| 1563313 | CIF | B3.33 S14 Yb6 | P 63 | 9.2514; 9.2514; 5.8805 90; 90; 120 | 435.87 | Borna, Marija; Hunger, Jens; Ormeci, Alim; Zahn, Dirk; Burkhardt, Ulrich; Carrillo-Cabrera, Wilder; Cardoso-Gil, Raul; Kniep, Rüdiger High-pressure high-temperature synthesis and crystal structure of the isotypic rare earth (RE)‒thioborate‒sulfides RE9[BS3]2[BS4]3S3, (RE=Dy‒Lu) Journal of Solid State Chemistry, 2011, 184, 296-303 |
| 1563384 | CIF | Al3 B4 Bi Cd3 O15 | P 63 | 10.3919; 10.3919; 5.7215 90; 90; 120 | 535.09 | Chen, Xuean; Yin, Hui; Chang, Xinan; Zang, Hegui; Xiao, Weiqiang Synthesis, crystal structure, spectrum properties, and electronic structure of a novel non-centrosymmetric borate, BiCd3(AlO)3(BO3)4 Journal of Solid State Chemistry, 2010, 183, 2910-2916 |
| 1564997 | CIF | La6 S14 Si2 Ti0.62 | P 63 | 10.297; 10.297; 5.772 90; 90; 120 | 530 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1564998 | CIF | Co La6 S14 Si2 | P 63 | 10.3141; 10.3141; 5.7313 90; 90; 120 | 528.02 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1564999 | CIF | Au0.97 La3 S7 Sn | P 63 | 10.4001; 10.4001; 6.0178 90; 90; 120 | 563.7 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565000 | CIF | Cr0.66 La6 S14 Si2 | P 63 | 10.2888; 10.2888; 5.7503 90; 90; 120 | 527.17 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565001 | CIF | La6 S14 Si2 Zr0.52 | P 63 | 10.3189; 10.3189; 5.7543 90; 90; 120 | 530.63 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565002 | CIF | Fe1.05 La6 S14 Si2 | P 63 | 10.2991; 10.2991; 5.7389 90; 90; 120 | 527.18 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565003 | CIF | La6 Ni S14 Si2 | P 63 | 10.2725; 10.2725; 5.7287 90; 90; 120 | 523.53 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565004 | CIF | Hf0.48 La6 S14 Si2 | P 63 | 10.3188; 10.3188; 5.7612 90; 90; 120 | 531.25 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565005 | CIF | Au0.96 La3 S7 Si | P 63 | 10.3804; 10.3804; 5.825 90; 90; 120 | 543.57 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565006 | CIF | Cu0.99 La3 S7 Si | P 63 | 10.3231; 10.3231; 5.7991 90; 90; 120 | 535.19 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565007 | CIF | La6 S14 Si2 V0.77 | P 63 | 10.296; 10.296; 5.7356 90; 90; 120 | 526.56 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565008 | CIF | Au0.99 Ge La3 S7 | P 63 | 10.3905; 10.3905; 5.8848 90; 90; 120 | 550.22 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565009 | CIF | La6 Mn0.98 S14 Si2 | P 63 | 10.3337; 10.3337; 5.7285 90; 90; 120 | 529.76 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565010 | CIF | La6 Pt0.53 S14 Si2 | P 63 | 10.253; 10.253; 5.7717 90; 90; 120 | 525.46 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565011 | CIF | La6 S14 Sc0.64 Si2 | P 63 | 10.3383; 10.3383; 5.7459 90; 90; 120 | 531.85 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565012 | CIF | La6 Rh0.69 S14 Si2 | P 63 | 10.2507; 10.2507; 5.749 90; 90; 120 | 523.15 | Akopov, Georgiy; Hewage, Nethmi; Yox, Philip; Viswanathan , Gayatri; Lee, Shannon; Hulsebosch, Liam; Cady, Sarah; Paterson, Alexander L.; Perras, Frédéric A.; Xu, Wenqian; Wu, Kui; Mudryk, Yaroslav; Kovnir, Kirill Synthesis-Enabled Exploration of Chiral and Polar Multivalent Quaternary Sulfides Chemical Science, 2021 |
| 1565813 | CIF | Fe7 O38 P11 | P 63 | 14.4504; 14.4504; 7.42607 90; 90; 120 | 1342.9 | Goj, Pawel; Wajda, Aleksandra; Blachowski, Artur; Stoch, Pawel A new iron-phosphate compound (Fe7P11O38) obtained by pyrophosphate stoichiometric glass devitrification Scientific Reports, 2021, 11, 22957 |
| 1567910 | CIF | Al3.71 K0.842 Na2.868 O16 Si4.29 | P 63 | 10.002; 10.002; 8.3831 90; 90; 120 | 726.29 | Mikhailova, Julia A.; Aksenov, Sergey M.; Pakhomovsky, Yakov A.; Moine, Bertrand N.; Dusséaux, Camille; Vaitieva, Yulia A.; Voronin, Mikhail Iron in Nepheline: Crystal Chemical Features and Petrological Applications Minerals, 2022, 12, 1257 |
| 1567911 | CIF | Al3.585 K0.71 Na2.875 O16 Si4.415 | P 63 | 9.9965; 9.9965; 8.3796 90; 90; 120 | 725.19 | Mikhailova, Julia A.; Aksenov, Sergey M.; Pakhomovsky, Yakov A.; Moine, Bertrand N.; Dusséaux, Camille; Vaitieva, Yulia A.; Voronin, Mikhail Iron in Nepheline: Crystal Chemical Features and Petrological Applications Minerals, 2022, 12, 1257 |
| 2002222 | CIF | Ca2 O18 Sr Yb10 | P 63 | 17.452; 17.452; 3.33 90; 90; 120 | 878.3 | Muschick, M; Mueller-Buschbaum, Hk Zur Verbindungsbildung von Me O : Me2 O3, II. Ueber Sr Ca2 Yb10 O18 und Sr Ca2 Lu10 O18 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977), 1976, 31, 1064-1066 |
| 2002223 | CIF | Ca2 Lu10 O18 Sr | P 63 | 17.40399; 17.40399; 3.307 90; 90; 120 | 867.5 | Muschick, M; Mueller-Buschbaum, Hk Zur Verbindungsbildung von Me O : Me2 O3, II. Ueber Sr Ca2 Yb10 O18 und Sr Ca2 Lu10 O18 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977), 1976, 31, 1064-1066 |
| 2002225 | CIF | Al2 Ba O4 | P 63 | 10.47; 10.47; 8.819 90; 90; 120 | 837.2 | Hoerkner, W; Mueller-Buschbaum, Hk Zur Kristallstruktur von Ba Al2 O4 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 451, 40-44 |
| 2002268 | CIF | Ba5 Cr3 H O13 | P 63 | 10.428; 10.428; 7.89 90; 90; 120 | 743 | Mattausch, H J; Mueller-Buschbaum, Hk Zur Kristallstruktur von Ba5 (Cr O4)3 (O H) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1973, 400, 1-9 |
| 2002272 | CIF | Ba Ga2 O4 | P 63 | 10.74; 10.74; 8.675 90; 90; 120 | 866.6 | Deiseroth, H J; Mueller-Buschbaum, Hk Ueber Erdalkalimetalloxogallate - IV(1) Untersuchung der Ueberstruktur von Ba Ga2 O4 Journal of Inorganic and Nuclear Chemistry, 1973, 35, 3177-3182 |
| 2002274 | CIF | Al1.88 Ba Mn0.12 O4 | P 63 | 10.434; 10.434; 8.794 90; 90; 120 | 829.1 | Sander, K; Mueller-Buschbaum, Hk Ein Mn3+ -dotiertes Bariumaluminat: Ba Al1.88 Mn0.12 O4. Ein Beitrag zur Kristallstruktur von Ba Al2 O4 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1980, 468, 197-201 |
| 2002315 | CIF | Cl Cr3 O12 Sr5 | P 63 | 10.125; 10.125; 7.328 90; 90; 120 | 650.6 | Mueller-Buschbaum, Hk; Sander, K Zur Kristallstruktur von Sr5 (Cr O4)3 Cl Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986), 1978, 33, 708-710 |
| 2002375 | CIF | Ba Ca2 Er10 O18 | P 63 | 17.655; 17.655; 3.3478 90; 90; 120 | 903.7 | Mueller-Buschbaum, Hk; Mevs, H Weitere metastabile Verbindungen mit Tunnelstruktur Ba Ca2 Er10 O18 und Ba Ca2 Yb10 O18 Journal of the Less-Common Metals, 1987, 136, 193-199 |
| 2002376 | CIF | Ba Ca2 O18 Yb10 | P 63 | 17.51549; 17.51549; 3.3098 90; 90; 120 | 879.4 | Mueller-Buschbaum, K; Mevs, H Weitere metastabile Verbindungen mit Tunnelstruktur Ba Ca2 Er10 O18 und Ba Ca2 Yb10 O18 Journal of the Less-Common Metals, 1987, 136, 193-199 |
| 2002463 | CIF | Ba Ca2 O18 Tm10 | P 63 | 17.5616; 17.5616; 3.332 90; 90; 120 | 889.9 | Mueller-Buschbaum, Hk; Lenz, A Neue Verbindungen vom Typ M3 Ln10 O18: Ba Ca2 Tm10 O18 und Ba Ca2 Tm5 Sc5 O18. Ein Beitrag zur Besetzung der Tunnelstrukturen Journal of the Less-Common Metals, 1989, 156, 173-179 |
| 2002464 | CIF | Ba Ca2 O18 Sc5 Tm5 | P 63 | 17.17169; 17.17169; 3.2292 90; 90; 120 | 824.6 | Mueller-Buschbaum, Hk; Lenz, A Neue Verbindungen vom Typ M3 Ln10 O18: Ba Ca2 Tm10 O18 und Ba Ca2 Tm5 Sc5 O18. Ein Beitrag zur Besetzung der Tunnelstrukturen Journal of the Less-Common Metals, 1989, 156, 173-179 |
| 2002474 | CIF | Ba Ca2 O18 Sc5 Yb5 | P 63 | 17.13789; 17.13789; 3.2171 90; 90; 120 | 818.3 | Mueller-Buschbaum, Hk; Vogt, R Neue Verbindungen vom Typ M3 Ln10 O18 (M= Ba + Ca; Ln= Sc + Yb, Ho + Y, La + Y). Ein Beitrag zur Besetzung von Oktaedergeruest und Tunnelstruktur Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 589, 89-95 |
| 2002475 | CIF | Ba Ca2 Ho5 O18 Y5 | P 63 | 17.7645; 17.7645; 3.3768 90; 90; 120 | 922.9 | Mueller-Buschbaum, Hk; Vogt, R Neue Verbindungen vom Typ M3 Ln10 O18 (M= Ba + Ca; Ln= Sc + Yb, Ho + Y, La + Y). Ein Beitrag zur Besetzung von Oktaedergeruest und Tunnelstruktur. Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 589, 89-95 |
| 2002476 | CIF | Ba Ca2 La5 O18 Y5 | P 63 | 18; 18; 3.4458 90; 90; 120 | 966.9 | Mueller-Buschbaum, Hk; Vogt, R Neue Verbindungen vom Typ M3 Ln10 O18 (M= Ba + Ca; Ln= Sc + Yb, Ho + Y, La + Y). Ein Beitrag zur Besetzung von Oktaedergeruest und Tunnelstruktur. Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 589, 89-95 |
| 2002503 | CIF | Ba2 Ca5 Dy18 O36 Zr | P 63 | 17.69469; 17.69469; 3.3658 90; 90; 120 | 912.7 | Mueller-Buschbaum, Hk; Vogt, R Ein Beitrag zum Sr Ca2 Lu10 O18-Typ. Zur Elementverteilung in Ba2 Ca5 Dy18 Zr O36 Journal of the Less-Common Metals, 1990, 163, 347-351 |
| 2004218 | CIF Paper | K O12 Se2 V3 | P 63 | 7.121; 7.121; 11.4 90; 90; 120 | 500.6 | Harrison, W. T. A.; Dussack, L. L.; Jacobson, A. J. Potassium Vanadium Selenite, K(VO~2~)~3~(SeO~3~)~2~ Acta Crystallographica Section C, 1995, 51, 2473-2476 |
| 2005178 | CIF Paper | C40 H38 Br2 N3 Nb O | P 63 | 13.671; 13.671; 11.4 90; 90; 120 | 1845.2 | Hoffman, D. M.; Rangarajan, S. P. A Diphenylamido‒Bromide Complex of Niobium: Dibromo[tris(diphenylamido)]niobium(V) Tetrahydrofuran Solvate Acta Crystallographica Section C, 1996, 52, 1616-1618 |
| 2006645 | CIF Paper | Al14.4 Cr3.4 Ni1.1 | P 63 | 17.674; 17.674; 12.516 90; 90; 120 | 3385.8 | Sato, A.; Yamamoto, A.; Li, X. Z.; Hiraga, K.; Haibach, T.; Steurer, W. A New Hexagonal κ Phase of Al‒Cr‒Ni Acta Crystallographica Section C, 1997, 53, 1531-1533 |
| 2008722 | CIF Paper | Fe Ge K O4 | P 63 | 18.749; 18.749; 8.684 90; 90; 120 | 2643.7 | Robert Hammond; Jacques Barbier Low-temperature KFeGeO~4~ Acta Crystallographica Section C, 1999, 55, IUC9900074 |
| 2008759 | CIF Paper | Cu Dy3 Ge Se7 | P 63 | 10.2499; 10.2499; 6.0322 90; 90; 120 | 548.84 | Huang, Fu Qiang; Ibers, James A. Dy~3~CuGeSe~7~ Acta Crystallographica Section C, 1999, 55, 1210-1212 |
| 2011286 | CIF HKL Paper | C15 H12 Cl5 Fe2 N12 S3 | P 63 | 10.3499; 10.3499; 14.6652 90; 90; 120 | 1360.48 | Schmalle, Helmut W.; Gyr, Ernst; Dubler, Erich A mixed-valence iron complex of the antitumour drug 6-mercaptopurine: tris(6-mercaptopurine)iron(II) tetrachloroferrate(III) chloride Acta Crystallographica Section C, 2000, 56, 957-959 |
| 2011468 | CIF HKL Paper | Cs O12 Se2 V3 | P 63 | 7.1613; 7.1613; 11.6184 90; 90; 120 | 516.01 | Harrison, William T. A. Caesium vanadium selenite, Cs(VO~2~)~3~(SeO~3~)~2~ Acta Crystallographica Section C, 2000, 56, e422-e422 |
| 2011970 | CIF HKL Paper | H4 N O4 P Zn | P 63 | 10.702; 10.702; 8.703 90; 90; 120 | 863.2 | Harrison, William T. A.; Sobolev, Alexandr N.; Phillips, Mark L. F. Hexagonal ammonium zinc phosphate, (NH~4~)ZnPO~4~, at 10K Acta Crystallographica Section C, 2001, 57, 508-509 |
| 2014099 | CIF HKL Paper | Ce3 Fe1.94 S7 | P 63 | 10.096; 10.096; 5.961 90; 90; 120 | 526.2 | Mills, Allison M.; Ruck, Michael Cerium iron sulfide, Ce~3~Fe~1.94~S~7~ Acta Crystallographica Section C, 2004, 60, i71-i72 |
| 2014653 | CIF Paper | C9 H21 Br4 N3 O6 Zn2 | P 63 | 11.337; 11.337; 9.91 90; 90; 120 | 1103.1 | Bekaert, Alain; Lemoine, Pascale; Brion, Jean Daniel; Viossat, Bernard Tris[(<i>R</i>)-lactamide-κ^2^<i>O</i>,<i>O</i>']zinc(II) tetrabromozincate Acta Crystallographica Section C, 2005, 61, m76-m77 |
| 2015120 | CIF Paper | Ga I3 O9 | P 63 | 9.0924; 9.0924; 5.2862 90; 90; 120 | 378.47 | Chen, Xuean; Xue, Hai-Ping; Chang, Xi-Nan; Zang, He-Gui; Xiao, Wei-Qiang Gallium tris(iodate), Ga(IO~3~)~3~ Acta Crystallographica Section C, 2005, 61, i109-i110 |
| 2019502 | CIF Paper | Al K O4 Si | P 63 | 5.19817; 5.19817; 8.5865 90; 90; 120 | 200.931 | Kremenović, Aleksandar; Vulić, Predrag Disordered kalsilite KAlSiO~4~ Acta Crystallographica Section C, 2014, 70, 256-259 |
| 2019520 | CIF HKL Paper | C8 H20 Cl4 Fe N | P 63 | 24.513; 24.513; 13.0356 90; 90; 120 | 6783.5 | Lutz, Martin; Huang, Yuxing; Moret, Marc-Etienne; Klein Gebbink, Robertus J. M. Phase transitions and twinned low-temperature structures of tetraethylammonium tetrachloridoferrate(III) Acta Crystallographica Section C, 2014, 70, 470-476 |
| 2021973 | CIF HKL Paper | C8 H20 N Re S4 | P 63 | 24.17; 24.17; 12.916 90; 90; 120 | 6534.5 | Bernhardt, Eduard; Herbst-Irmer, Regine Phase transition and structures of the twinned low-temperature phases of (Et~4~N)[ReS~4~] Acta Crystallographica Section C, 2020, 76 |
| 2100834 | CIF Paper | C18 H48 Cr N9 O12 | P 63 | 13.029; 13.029; 10.04 90; 90; 120 | 1476 | Morooka, M.; Ohba, S.; Miyamae, H. Electron-density distribution in crystals of <i>lel</i>~3~-[<i>M</i>(chxn)~3~](NO~3~)~3~.3H~2~O (<i>M</i> = Cr, Rh; chxn = <i>trans</i>-1,2-diaminocyclohexane) at 120 K Acta Crystallographica Section B, 1992, 48, 667-672 |
| 2100835 | CIF Paper | C18 H48 N9 O12 Rh | P 63 | 13.101; 13.101; 9.984 90; 90; 120 | 1484 | Morooka, M.; Ohba, S.; Miyamae, H. Electron-density distribution in crystals of <i>lel</i>~3~-[<i>M</i>(chxn)~3~](NO~3~)~3~.3H~2~O (<i>M</i> = Cr, Rh; chxn = <i>trans</i>-1,2-diaminocyclohexane) at 120 K Acta Crystallographica Section B, 1992, 48, 667-672 |
| 2100906 | CIF Paper | Cr Li O4 Rb | P 63 | 5.463; 5.463; 9.147 90; 90; 120 | 236.41 | Makarova, I. P.; Verin, I. A.; Aleksandrov, K. S. Structure and twinning of RbLiCrO~4~ crystals Acta Crystallographica Section B, 1993, 49, 19-28 |
| 2100907 | CIF Paper | Cr Li O4 Rb | P 63 | 5.471; 5.471; 9.14 90; 90; 120 | 236.92 | Makarova, I. P.; Verin, I. A.; Aleksandrov, K. S. Structure and twinning of RbLiCrO~4~ crystals Acta Crystallographica Section B, 1993, 49, 19-28 |
| 2102090 | CIF Paper | K Li O4 S | P 63 | 5.202; 5.202; 8.647 90; 90; 120 | 202.65 | Pinheiro, Carlos Basílio; Pimenta, Marcos Assunção; Chapuis, Gervais; Speziali, Nivaldo Lúcio Analysis of LiKSO~4~ crystals in the temperature range from 573 to 943K Acta Crystallographica Section B, 2000, 56, 607-617 |
| 2102183 | CIF Paper | C27 H15 Br3 Cl3 N3 O3 | P 63 | 15.25; 15.25; 6.8149 90; 90; 120 | 1372.6 | Broder, Charlotte K.; Howard, Judith A. K.; Keen, David A.; Wilson, Chick C.; Allen, Frank H.; Jetti, Ram K. R.; Nangia, Ashwini; Desiraju, Gautam R. Halogen trimer synthons in crystal engineering: low-temperature X-ray and neutron diffraction study of the 1:1 complex of 2,4,6-tris(4-chlorophenoxy)-1,3,5-triazine with tribromobenzene Acta Crystallographica Section B, 2000, 56, 1080-1084 |
| 2102184 | CIF Paper | C27 H15 Br3 Cl3 N3 O3 | P 63 | 15.166; 15.166; 6.743 90; 90; 120 | 1343.2 | Broder, Charlotte K.; Howard, Judith A. K.; Keen, David A.; Wilson, Chick C.; Allen, Frank H.; Jetti, Ram K. R.; Nangia, Ashwini; Desiraju, Gautam R. Halogen trimer synthons in crystal engineering: low-temperature X-ray and neutron diffraction study of the 1:1 complex of 2,4,6-tris(4-chlorophenoxy)-1,3,5-triazine with tribromobenzene Acta Crystallographica Section B, 2000, 56, 1080-1084 |
| 2102551 | CIF Paper | N4 Si3 | P 63 | 7.6044; 7.6044; 2.9063 90; 90; 120 | 145.546 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102553 | CIF Paper | N4 Si3 | P 63 | 7.6015; 7.6015; 2.9061 90; 90; 120 | 145.425 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2102555 | CIF Paper | N4 Si3 | P 63 | 7.602; 7.602; 2.906 90; 90; 120 | 145.439 | du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F. Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~ Acta Crystallographica Section B, 2004, 60, 388-405 |
| 2104303 | CIF HKL Paper | Ag0.82 Ge La3 S7 | P 63 | 10.4056; 10.4056; 5.828 90; 90; 120 | 546.49 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104304 | CIF HKL Paper | Ag0.88 Ce3 Ge S7 | P 63 | 10.3902; 10.3902; 5.8425 90; 90; 120 | 546.23 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104305 | CIF Paper | Ag0.89 Ge Pr3 S7 | P 63 | 10.229; 10.229; 5.776 90; 90; 120 | 523.39 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104306 | CIF HKL Paper | Ag0.84 Ge Nd3 S7 | P 63 | 10.193; 10.193; 5.7693 90; 90; 120 | 519.11 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104307 | CIF HKL Paper | Ag0.74 Ge S7 Sm3 | P 63 | 10.0809; 10.0809; 5.7604 90; 90; 120 | 506.97 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104308 | CIF HKL Paper | Ag0.63 Gd3 Ge S7 | P 63 | 9.9637; 9.9637; 5.766 90; 90; 120 | 495.73 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104309 | CIF HKL Paper | Ag0.59 Ge S7 Tb3 | P 63 | 9.9003; 9.9003; 5.7654 90; 90; 120 | 489.39 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104310 | CIF HKL Paper | Ag0.51 Dy3 Ge S7 | P 63 | 9.8003; 9.8003; 5.7879 90; 90; 120 | 481.43 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104311 | CIF HKL Paper | Ag0.5 Ge Ho3 S7 | P 63 | 9.7401; 9.7401; 5.7994 90; 90; 120 | 476.48 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104312 | CIF HKL Paper | Ag0.5 Er3 Ge S7 | P 63 | 9.6921; 9.6921; 5.8308 90; 90; 120 | 474.35 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2104313 | CIF HKL Paper | Ag0.5 Ge S7 Y3 | P 63 | 9.809; 9.809; 5.8059 90; 90; 120 | 483.78 | Daszkiewicz, Marek; Gulay, Lubomir D.; Lychmanyuk, Olga S. Ln~3~<i>M</i>~1{-~δ}<i>TX</i>~7~ ‒ quasi-isostructural compounds: stereochemistry and silver-ion motion in the Ln~3~Ag~1{-~δ}GeS~7~ (Ln = La‒Nd, Sm, Gd‒Er and Y; δ = 0.11‒0.50) compounds Acta Crystallographica Section B, 2009, 65, 126-133 |
| 2105551 | CIF Paper | Al0.97 Ge1.03 K0.19 Na0.78 O4 | P 63 | 10.164; 10.164; 8.54 90; 90; 120 | 764 | Hammond, R. P.; Barbier, J. Monoclinic and Hexagonal Nepheline Structures of (Na~3/4~/K~1/4~)AlGeO~4~ Acta Crystallographica Section B, 1998, 54, 211-220 |
| 2106488 | CIF | Cu20 Sn6 | P 63 | 7.33; 7.33; 7.864 90; 90; 120 | 365.917 | Brandon, J.K.; Pearson, W.B.; Tozer, D.J.N. A single-crystal X-ray diffraction of the zeta bronze structure, Cu20 Sn6 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 774-779 |
| 2106678 | CIF | F10 Na Sb3 | P 63 | 8.285; 8.285; 7.6 90; 90; 120 | 451.782 | Fourcade, R.; Mascherpa, G.; Philippot, E. Structure cristalline et moleculaire de Na Sb3 F10 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2322-2326 |
| 2106883 | CIF | Bi6.333 Br S9 | P 63 | 15.545; 15.545; 4.019 90; 90; 120 | 841.066 | Mariolacos, K. The crystal structure of Bi (Bi2 S3)9 Br3 Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1947-1949 |
| 2106987 | CIF | Ba Ge O4 Zn | P 63 | 9.2905; 9.2905; 8.728 90; 90; 120 | 652.414 | Iijima, K.; Marumo, F. The room-temperature structure of Ba Zn Ge O4 Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1112-1116 |
| 2200066 | CIF HKL Paper | C24 H42 N3 S6 Sb | P 63 | 13.8948; 13.8948; 9.4868 90; 90; 120 | 1586.19 | Baba, Ibrahim; Ibrahim, Sukeria; Farina, Yang; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng Tris(<i>N</i>-cyclohexyl-<i>N</i>-methyldithiocarbamato-<i>S</i>)antimony(III) Acta Crystallographica Section E, 2001, 57, m39-m40 |
| 2216155 | CIF HKL Paper | Ce3 Ge Mg0.5 S7 | P 63 | 10.2626; 10.2626; 5.7679 90; 90; 120 | 526.09 | Gulay, L. D.; Daszkiewicz, M.; Huch, M. R.; Pietraszko, A. Ce~3~Mg~0.5~GeS~7~ from single-crystal data Acta Crystallographica Section E, 2007, 63, i187-i187 |
| 2220383 | CIF HKL Paper | B18 H20 Mn6 N2 Na10 O75 P12 | P 63 | 11.9331; 11.9331; 12.129 90; 90; 120 | 1495.76 | Lin, Zhi-Sheng; Huang, Ya-Xi; Prots, Yurii; Zhao, Jing-Tai; Kniep, Rüdiger Na~5~(NH~4~)Mn~3~[B~9~P~6~O~33~(OH)~3~]·1.5H~2~O Acta Crystallographica Section E, 2008, 64, i82-i83 |
| 2234124 | CIF HKL Paper | C88 H65.33 Cu2 I2 O0.67 P4 | P 63 | 25.573; 25.573; 18.593 90; 90; 120 | 10530 | Volz, Daniel; Nieger, Martin; Bräse, Stefan Di-μ-iodido-bis{[(<i>R</i>)-(+)-2,2'-bis(diphenylphosphanyl)-1,1'-binaphthyl-κ^2^<i>P</i>,<i>P</i>']copper(I)} 0.67-hydrate Acta Crystallographica Section E, 2012, 68, m466-m467 |
| 2236973 | CIF HKL Paper | C14 H23 N O2 | P 63 | 19.5845; 19.5845; 6.6307 90; 90; 120 | 2202.5 | Wood, Mary H.; Clarke, Stuart M. (<i>S</i>)-({-})-1-Phenylethanaminium hexanoate Acta Crystallographica Section E, 2012, 68, o3335 |
| 2240185 | CIF HKL Paper | Cl2 H6 O11 Sn | P 63 | 7.0701; 7.0701; 9.7631 90; 90; 120 | 422.64 | Hennings, Erik; Schmidt, Horst; Köhler, Martin; Voigt, Wolfgang Crystal structure of tin(II) perchlorate trihydrate Acta Crystallographica Section E, 2014, 70, 474-476 |
| 2244123 | CIF HKL Paper | Ba3 H12 O17 Se2 Sn | P 63 | 9.255; 9.255; 11.4441 90; 90; 120 | 848.92 | Reuter, Hans; Kamaha, Shouassi Ba~3~[Sn(OH)~6~][SeO~4~]~2~·3H~2~O, a hydrated 1:2 double salt of barium hexahydroxidostannate(IV) and barium selenate(VI) Acta Crystallographica Section E, 2022, 78 |
| 2300689 | CIF HKL | Al63.643 Cr10 Cu18.381 | P 63 | 10.9995; 10.9995; 12.698 90; 90; 120 | 1330.5 | Samuha, Shmuel; Tamari, Rimon; Grushko, Benjamin; Meshi, Louisa Structure solution of the Al~69.2~Cu~20~Cr~10.8~ {πhi} phase Journal of Applied Crystallography, 2022, 55, 74-79 |
| 2310421 | CIF | I Li O3 | P 63 | 5.478; 5.478; 5.17 90; 90; 120 | 134.359 | de Boer, J.L.; van Bolhuis, F.; Olthof-Hazekamp, R.; Vos, A. Reinvestigation of the crystal structure of lithium iodate Acta Crystallographica (1,1948-23,1967), 1966, 21, 841-843 |
| 2310680 | CIF | H4 Mg2 O9 Si2 | P 63 | 5.31; 5.31; 14.04 90; 90; 120 | 342.836 | Steinfink, H.; Brunton, G. The crystal structure of amesite Acta Crystallographica (1,1948-23,1967), 1956, 9, 487-492 |
| 2310864 | CIF | H3 N Na O3 P | P 63 | 5.773; 5.773; 6.031 90; 90; 120 | 174.07 | Hobbs, E.; Corbridge, D.E.C.; Raistrick, B. The Crystal Structure of Monosodium Phosphoramidate, Na H P O3 N H2 Acta Crystallographica (1,1948-23,1967), 1953, 6, 621-626 |
| 4000031 | CIF | Ba3 O3 S4 V2 | P 63 | 10.1661; 10.1661; 5.9306 90; 90; 120 | 530.81 | Calvagna, Frank; Zhang, Jianhua; Li, Shoujian; Zheng, Chong Synthesis and Structural Analysis of Ba3V2O3S4 Chemistry of Materials, 2001, 13, 304-307 |
| 4001015 | CIF | O12 Rb Se2 V3 | P 63 | 7.1364; 7.1364; 11.4687 90; 90; 120 | 505.83 | Chang, Hong Young; Kim, Sang-Hwan; Ok, Kang Min; Halasyamani, P. Shiv New Polar Oxides: Synthesis, Characterization, Calculations, and Structure−Property Relationships in RbSe2V3O12and TlSe2V3O12 Chemistry of Materials, 2009, 21, 1654 |
| 4001016 | CIF | O12 Se2 Tl V3 | P 63 | 7.1248; 7.1248; 11.4287 90; 90; 120 | 502.43 | Chang, Hong Young; Kim, Sang-Hwan; Ok, Kang Min; Halasyamani, P. Shiv New Polar Oxides: Synthesis, Characterization, Calculations, and Structure−Property Relationships in RbSe2V3O12and TlSe2V3O12 Chemistry of Materials, 2009, 21, 1654 |
| 4001366 | CIF | C12 H27 S3 Sb | P 63 | 10.343; 10.343; 9.756 90; 90; 120 | 903.85 | Castro, Jorge Rodriguez-; Dale, Phillip; Mahon, Mary F.; Molloy, Kieran C.; Peter, Laurie M. Deposition of Antimony Sulfide Thin Films from Single-Source Antimony Thiolate Precursors Chemistry of Materials, 2007, 19, 3219 |
| 4002417 | CIF | I9 Mo6 S0.063 | P 63 | 16.41; 16.41; 11.9154 90; 90; 120 | 2778.79 | Paglia, G.; Bozin, E.S.; Vengust, D.; Mihailovic, D.; Billinge, S.J.L. Accurate structure determination of Mo6 S(y) I(z) nanowires from atomic pair distribution function (PDF) analysis Chemistry of Materials (1,1989-), 2006, 18, 100-106 |
| 4002671 | CIF | C24 H92 Ca Cu6 N6 O53 | P 63 | 17.6943; 17.6943; 13.2921 90; 90; 120 | 3604.1 | Grancha, Thais; Ferrando-Soria, Jesús; Cano, Joan; Amorós, Pedro; Seoane, Beatriz; Gascon, Jorge; Bazaga-García, Montse; Losilla, Enrique R.; Cabeza, Aurelio; Armentano, Donatella; Pardo, Emilio Insights into the Dynamics of Grotthuss Mechanism in a Proton-Conducting ChiralbioMOF Chemistry of Materials, 2016, 28, 4608 |
| 4002832 | CIF | Bi12.67 I2 S18 | P 63 | 15.612; 15.612; 4.0168 90; 90; 120 | 847.9 | Groom, Ryan; Jacobs, Allison; Cepeda, Marisa; Drummey, Rachel; Latturner, Susan E. Bi13S18I2: (Re)discovery of a Subvalent Bismuth Compound Featuring [Bi2]4+ Dimers Grown in Sulfur/Iodine Flux Mixtures Chemistry of Materials, 2017 |
| 4002835 | CIF | Al4 Na3.49 O16 Si4 | P 63 | 9.9762; 9.9762; 8.34957 90; 90; 120 | 719.66 | Ming Zhao; Zhiguo Xia; Maxim S. Molokeev; Lixin Ning; Quanlin Liu Temperature and Eu2+ Doping induced Phase Selection in NaAlSiO4 Polymorphs and the Controlled Yellow/Blue Emission Chemistry of Materials, 2017, 29, 6552-6559 |
| 4002979 | CIF | C3 H0 Br Cs0 Lu8 N0 O25 Zn0 | P 63 | 9.344; 9.344; 14.498 90; 90; 120 | 1096.2 | Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials Chemistry of Materials, 2019, 31, 2130 |
| 4002980 | CIF | C3 H0 Br Cs0 N0 O25 Y8 Zn0 | P 63 | 9.4927; 9.4927; 14.752 90; 90; 120 | 1151.2 | Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials Chemistry of Materials, 2019, 31, 2130 |
| 4002981 | CIF | C3 Cl Lu8 O25 | P 63 | 9.354; 9.354; 14.415 90; 90; 120 | 1092.3 | Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials Chemistry of Materials, 2019, 31, 2130 |
| 4002982 | CIF | C3 H15 Cl O25 Y8 | P 63 | 9.5353; 9.5353; 14.729 90; 90; 120 | 1159.8 | Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials Chemistry of Materials, 2019, 31, 2130 |
| 4003330 | CIF | B Ba Be2 F3 O3 | P 63 | 7.6279; 7.6279; 13.99 90; 90; 120 | 705 | Guo, Shu; Jiang, Xingxing; Liu, Lijuan; Xia, Mingjun; Fang, Zhi; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian BaBe2BO3F3: A KBBF-Type Deep-Ultraviolet Nonlinear Optical Material with Reinforced [Be2BO3F2]∞Layers and Short Phase-Matching Wavelength Chemistry of Materials, 2016, 28, 8871 |
| 4003448 | CIF | C10 H18 Cd N4 S3 | P 63 | 9.3596; 9.3596; 10.7347 90; 90; 120 | 814.4 | He, Lei; Zhou, Lin; Shi, Ping-Ping; Ye, Qiong; Fu, Da-Wei One-Dimensional Cadmium Thiocyanate Perovskite Ferroelastics Tuned by Halogen Substitution Chemistry of Materials, 2019 |
| 4003452 | CIF | C81 H180 Br19 N9 Pb3 Zn2 | P 63 | 14.9238; 14.9238; 30.6972 90; 90; 120 | 5920.9 | Lee, Sujin; Zhou, Chenkun; Neu, Jennifer; Beery, Drake; Arcidiacono, Ashley; Chaaban, Maya; Lin, Haoran; Gaiser, Alyssa; Chen, Banghao; Albrecht-Schmitt, Thomas E.; Siegrist, Theo; Ma, Biwu Bulk Assemblies of Lead Bromide Trimer Clusters with Geometry-Dependent Photophysical Properties Chemistry of Materials, 2019 |
| 4003518 | CIF | F Lu3 O12 Se4 | P 63 | 9.883; 9.883; 7.066 90; 90; 120 | 597.7 | Wu, Chao; Li, Longhua; Lin, Lin; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi Enhancement of Second-Order Optical Nonlinearity in a Lutetium Selenite by Monodentate Anion Partial Substitution Chemistry of Materials, 2020 |
| 4021984 | CIF | C75 H69 N3 | P 63 | 32.199; 32.199; 12.957 90; 90; 120 | 11634 | Mao-Sen Yuan; Qi Fang; Zhi-Qiang Liu; Jian-Ping Guo; Hong-Yu Chen; Wen-Tao Yu; Gang Xue; Dian-Sheng Liu Acceptor or Donor (Diaryl B or N) Substituted Octupolar Truxene: Synthesis, Structure, and Charge-Transfer-Enhanced Fluorescence Journal of Organic Chemistry, 2006, 71, 7858-7861 |
| 4023603 | CIF | C27 H36 O9 | P 63 | 23.975; 23.975; 9.5693 90; 90; 120 | 4763.5 | Ravindranath Nasi; Brian O. Patrick; Lyann Sim; David R. Rose; B. Mario Pinto Studies Directed toward the Stereochemical Structure Determination of the Naturally Occurring Glucosidase Inhibitor, Kotalanol: Synthesis and Inhibitory Activities against Human Maltase Glucoamylase of Seven-Carbon, Chain-Extended Homologues of Salacinol Journal of Organic Chemistry, 2008, 73, 6172-6181 |
| 4029281 | CIF | C69 H57 N15 | P 63 | 19.986; 19.986; 8.8105 90; 90; 120 | 3047.8 | Fa, Shi-Xin; Wang, Li-Xia; Wang, De-Xian; Zhao, Liang; Wang, Mei-Xiang Synthesis, Structure, and Fullerene-Complexing Property of Azacalix[6]aromatics. The Journal of organic chemistry, 2014, 79, 3559-3571 |
| 4031426 | CIF | Al H14 I5 O21 | P 63 | 16.107; 16.107; 12.378 90; 90; 120 | 2781.06 | Cradwick, P.D.; de Endredy, A.S. Crystal Structure of Aluminium Iodate-Hydrogen Iodate-Water (1/1/6) and Preparation of Anhydrous Aluminium Iodate Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1977, 1977, 146-149 |
| 4031433 | CIF | Br K3 O12 S3 Sn2 | P 63 | 10.256; 10.256; 7.582 90; 90; 120 | 690.67 | Donaldson, J.D.; Grimes, S.M. Novel tin(II) sites in X-ray crystal structures of the Tin(II) halide sulphates K3 Sn2 (S O4)3 X (X= Br or Cl) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1984, 1984, 1301-1305 |
| 4031434 | CIF | Cl K3 O12 S3 Sn2 | P 63 | 10.183; 10.183; 7.54 90; 90; 120 | 677.101 | Donaldson, J.D.; Grimes, S.M. Novel tin(II) sites in X-ray crystal structures of the tin(II) halide sulphates K3 Sn2 (S O4)3 X (X= Br or Cl) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1984, 1984, 1301-1305 |
| 4031512 | CIF | K3.0001 O3 S3 Sn1.9999 | P 63 | 10.23; 10.23; 7.56 90; 90; 120 | 685.178 | Howie, R.A.; Moser, W.; Starks, R.G.; Woodhams, F.W.D.; Parker, W. Potassium Tin(II) Sulphate and Related Tin Apatites. Moessbauer and X-Ray Studies Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1973, 1973, 1478-1484 |
| 4031572 | CIF | Bi8 Cl8 Ga2 | P 63 | 17.76; 17.76; 12.979 90; 90; 120 | 3545.34 | Lindsjoe, M.; Fischer, A.; Kloo, L. Improvements of and insights into the isolation of bismuth polycations from benzene solution - single-crystal structure determinations of Bi8 [Ga Cl4]2 and Bi5 [Ga Cl4]3 European Journal of Inorganic Chemistry, 2005, 2005, 670-675 |
| 4031801 | CIF | C12 Br Co3 O12 Sn | P 63 | 10.2; 10.2; 11.81 90; 90; 120 | 1064.1 | Ball, R.D.; Hall, D. The crystal structure of Bromotris(tetracarbonylcobalt) tin(IV) Journal of Organometallic Chemistry, 1973, 52, 293-295 |
| 4034756 | CIF | C22 H11 N O6 | P 63 | 15.7405; 15.7405; 11.9054 90; 90; 120 | 2554.53 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Triptycene 1,2-Quinones and Quinols: Permeable Crystalline Redox-Active Molecular Solids. The Journal of organic chemistry, 2018, 83, 15426-15437 |
| 4035431 | CIF | C22 H36.67 O5.33 | P 63 | 15.0636; 15.0636; 15.9737 90; 90; 120 | 3139.02 | Ma, Xiaoshen; Kucera, Roman; Goethe, Olivia F.; Murphy, Stephen K.; Herzon, Seth B. Directed C-H Bond Oxidation of (+)-Pleuromutilin. The Journal of organic chemistry, 2018, 83, 6843-6892 |
| 4062675 | CIF | C21 H15 N3 O9 Os3 | P 63 | 18.545; 18.545; 12.621 90; 90; 120 | 3759.1 | Organometallics, 2004 |
| 4063335 | CIF | C180 H150 La2 O12 P6 | P 63 | 31.7444; 31.7444; 25.393 90; 90; 120 | 22160 | Xianghua Yu; Tobin J. Marks Organophosphine Oxide/Sulfide-Substituted Lanthanide Binaphtholate Catalysts for Enantioselective Hydroamination/Cyclization Organometallics, 2007, 26, 365-376 |
| 4064029 | CIF | C78 H75 Cl Ge4 | P 63 | 18.6792; 18.6792; 9.874 90; 90; 120 | 2983.6 | Samanamu, Christian R.; Amadoruge, Monika L.; Yoder, Claude H.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S. Syntheses, Structures, and Electronic Properties of the Branched Oligogermanes (Ph3Ge)3GeH and (Ph3Ge)3GeX (X = Cl, Br, I)† Organometallics, 2011, 30, 1046 |
| 4064030 | CIF | C72 H63 Br Ge4 | P 63 | 18.6599; 18.6599; 10.0541 90; 90; 120 | 3031.7 | Samanamu, Christian R.; Amadoruge, Monika L.; Yoder, Claude H.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S. Syntheses, Structures, and Electronic Properties of the Branched Oligogermanes (Ph3Ge)3GeH and (Ph3Ge)3GeX (X = Cl, Br, I)† Organometallics, 2011, 30, 1046 |
| 4065852 | CIF | C234 H270 K6 Mn6 O18 | P 63 | 19.125; 19.125; 32.076 90; 90; 120 | 10160 | Crisp, Jeffrey A.; Meier, Ryan M.; Overby, Jason S.; Hanusa, Timothy P.; Rheingold, Arnold L.; Brennessel, William W. Indenyl Complexes of Manganese(II). Conformational Flexibility of the Manganese(II)−(RnC9H7−n) Bond Organometallics, 2010, 29, 2322 |
| 4066281 | CIF | C59 H92 N6 O3 Zr | P 63 | 24.5106; 24.5106; 18.9897 90; 90; 120 | 9880 | Leitch, David C.; Schafer, Laurel L. Zirconium Alkyl Complexes Supported by Ureate Ligands: Synthesis, Characterization, and Precursors to Metal−Element Multiple Bonds† Organometallics, 2010, 29, 5162 |
| 4067935 | CIF | C19 H45 Cl3 P3 Ru Si | P 63 | 11.7497; 11.7497; 10.9259 90; 90; 120 | 1306.3 | Cain, Matthew F.; Glueck, David S.; Golen, James A.; Rheingold, Arnold L. Asymmetric Synthesis and Metal Complexes of aC3-Symmetric P-Stereogenic Triphosphine, (R)-MeSi(CH2PMe(t-Bu))3(MT-Siliphos) Organometallics, 2012, 31, 775 |
| 4077624 | CIF | C84 H84 Na3 O12 Yb | P 63 | 15.1044; 15.1044; 18.419 90; 90; 120 | 3639.2 | Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters! Organometallics, 2000, 19, 5416 |
| 4077625 | CIF | C84 H84 La Na3 O13 | P 63 | 15.2581; 15.2581; 18.207 90; 90; 120 | 3670.9 | Aspinall, Helen C.; Bickley, Jamie F.; Dwyer, Jennifer L. M.; Greeves, Nicholas; Kelly, Richard V.; Steiner, Alexander Pinwheel-Shaped Heterobimetallic Lanthanide Alkali Metal Binaphtholates: Ionic Size Matters! Organometallics, 2000, 19, 5416 |
| 4078132 | CIF | C47 H69 Fe2 S3 Si3 | P 63 | 24.6933; 24.6933; 13.8075 90; 90; 120 | 7291.3 | Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines Organometallics, 2012, 31, 2953 |
| 4086113 | CIF | C31 H29 O Y | P 63 | 11.6507; 11.6507; 10.0984 90; 90; 120 | 1187.1 | Corbey, Jordan F.; Woen, David H.; Palumbo, Chad T.; Fieser, Megan E.; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Ligand Effects in the Synthesis of Ln2+Complexes by Reduction of Tris(cyclopentadienyl) Precursors Including C‒H Bond Activation of an Indenyl Anion Organometallics, 2015, 34, 3909 |
| 4086235 | CIF | C31 H29 Dy O | P 63 | 11.6494; 11.6494; 10.0857 90; 90; 120 | 1185.34 | Corbey, Jordan F.; Woen, David H.; Palumbo, Chad T.; Fieser, Megan E.; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Ligand Effects in the Synthesis of Ln2+Complexes by Reduction of Tris(cyclopentadienyl) Precursors Including C‒H Bond Activation of an Indenyl Anion Organometallics, 2015, 34, 3909 |
| 4088770 | CIF | C55 H45 Ni O P3 | P 63 | 18.4755; 18.4755; 9.9813 90; 90; 120 | 2950.6 | John, Alex; Miranda, Maria O.; Ding, Keying; Dereli, Büsra; Ortuño, Manuel A.; LaPointe, Anne M.; Coates, Geoffrey W.; Cramer, Christopher J.; Tolman, William B. Nickel Catalysts for the Dehydrative Decarbonylation of Carboxylic Acids to Alkenes Organometallics, 2016, 35, 2391 |
| 4100769 | CIF | C132 H234 O21 P12 Pt6 | P 63 | 26.4164; 26.4164; 13.6104 90; 90; 120 | 8225.2 | Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly Journal of the American Chemical Society, 2004, 126, 2464-2473 |
| 4100770 | CIF | C140 H218 Cl6 O12 P12 Pt6 | P 63 | 26.2312; 26.2312; 14.5061 90; 90; 120 | 8644.1 | Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly Journal of the American Chemical Society, 2004, 126, 2464-2473 |
| 4101633 | CIF | C36 H30 I9 N9 O6 Pb3 | P 63 | 20.1518; 20.1518; 7.9277 90; 90; 120 | 2788.1 | Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture. Journal of the American Chemical Society, 2010, 132, 18-19 |
| 4101634 | CIF | C36 H30 Br3 I9 N6 Pb3 | P 63 | 20.028; 20.028; 8.0181 90; 90; 120 | 2785.3 | Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture. Journal of the American Chemical Society, 2010, 132, 18-19 |
| 4101635 | CIF | C12 H10 Cl I3 N2 Pb | P 63 | 20.025; 20.025; 7.975 90; 90; 120 | 2769.5 | Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture. Journal of the American Chemical Society, 2010, 132, 18-19 |
| 4101636 | CIF | C36 H30 F3 I9 N6 Pb3 | P 63 | 19.9426; 19.9426; 7.8618 90; 90; 120 | 2707.8 | Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture. Journal of the American Chemical Society, 2010, 132, 18-19 |
| 4102681 | CIF | C3 H7 N O6 Zn | P 63 | 12.5919; 12.5919; 8.2015 90; 90; 120 | 1126.18 | Guan-Cheng Xu; Xiao-Ming Ma; Li Zhang; Zhe-Ming Wang; Song Gao Disorder-Order Ferroelectric Transition in the Metal Formate Framework of [NH4][Zn(HCOO)3] Journal of the American Chemical Society, 2010, 132, 9588-9590 |
| 4104071 | CIF | C82 H53 Cl2 O9 P | P 63 | 20.6143; 20.6143; 17.9025 90; 90; 120 | 6588.42 | Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis Journal of the American Chemical Society, 2009, 131, 4136-4142 |
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