Crystallography Open Database
Search results
Result : There are 3600 entries in the selection
You can download the COD numbers of the selection as a text file
You can download all files as a single ZIP archive
We are displaying first 300 results.
Searching space group like 'R -3 :H'
| COD ID: 1000243 | |
| CIF file | Formula: - F6 Fe Nb - Comments: Delobbe, V; Chassaing, J; Bizot, D; Quarton, M; Lacorre, P; Calage, Y; Leblanc, M; Ferey, G Fluorocomplexes of Niobium IV; VI: Moessbauer study and magnetic structure of Fe Nb F~6~ Journal of Magnetism and Magnetic Materials 74 (1988) 165-176 Space group: R -3 :H Cell volume: 358 Cell parameters: 5.4201; 5.4201; 14.072; 90; 90; 120; |
| COD ID: 1000244 | |
| CIF file | Formula: - F6 Fe Nb - Comments: Delobbe, V; Chassaing, J; Bizot, D; Quarton, M; Lacorre, P; Calage, Y; Leblanc, M; Ferey, G Fluorocomplexes of Niobium IV; VI: Moessbauer study and magnetic structure of Fe Nb F~6~ Journal of Magnetism and Magnetic Materials 74 (1988) 165-176 Space group: R -3 :H Cell volume: 356.5 Cell parameters: 5.3942; 5.3942; 14.1457; 90; 90; 120; |
| COD ID: 1000354 | |
| CIF file | Formula: - Cu6 Fe0.9 O19 V6 - Comments: Permer, L; Laligant, Y; Ferey, G; Calage, Y Crystal structure, magnetic, and Moessbauer studies of Cu~6~Fe~0.9~V~6~O~19~: a compound with relaxation effect Journal of Solid State Chemistry 107 (1993) 539-546 Space group: R -3 :H Cell volume: 1033.5 Cell parameters: 12.9399; 12.9399; 7.1275; 90; 90; 120; |
| COD ID: 1000466 | |
| CIF file | Formula: - F6 Fe H12 O6 Sn - Comments: Benghalem, A; Leblanc, M; Calage, Y Room-temperature structure of iron(II) hexafluorostannate(IV) hexahydrate Acta Crystallographica C (39,1983-) 46 (1990) 2453-2454 Space group: R -3 :H Cell volume: 845 Cell parameters: 9.826; 9.826; 10.106; 90; 90; 120; |
| COD ID: 1000500 | |
| CIF file | Formula: - La7 Mo7 O30 - Comments: Goutenoire, F; Retoux, R; Suard, E; Lacorre, P Ab initio determination of the novel perovskite-related structure of La7 Mo7 O30 from powder diffraction Journal of Solid State Chemistry 142 (1999) 228-235 Space group: R -3 :H Cell volume: 1718.1 Cell parameters: 17.0051; 17.0051; 6.8607; 90; 90; 120; |
| COD ID: 1000501 | |
| CIF file | Formula: - La7 Mo7 O30 - Comments: Goutenoire, F; Retoux, R; Suard, E; Lacorre, P Ab initio determination of the novel perovskite-related structure of La7 Mo7 O30 from powder diffraction Journal of Solid State Chemistry 142 (1999) 228-235 Space group: R -3 :H Cell volume: 1718.5 Cell parameters: 17.00639; 17.00639; 6.8613; 90; 90; 120; |
| COD ID: 1001733 | |
| CIF file | Formula: - K6.595 Mo2.34 O31 P4 W3.66 - Comments: Leclaire, A; Borel, M M; Chardon, J; Raveau, B A molybdenotungsten monophosphate with an opened structure K6.6 Mo2.36 W3.64 O15 (P O4)4 Journal of Solid State Chemistry 127 (1996) 1-8 Space group: R -3 :H Cell volume: 4189.1 Cell parameters: 17.545; 17.545; 15.714; 90; 90; 120; |
| COD ID: 1004003 | |
| CIF file | Formula: - C44 H90 F6 O2 P7 S8 W6 - Comments: Laurie I. Hill; Song Jin; Ran Zhou; D. Venkataraman; Francis J. DiSalvo Synthesis and Characterization of Oxidized W6S8L6 Clusters Inorganic Chemistry 40 (2001) 2660-2665 Space group: R -3 :H Cell volume: 5432.23 Cell parameters: 13.9117; 13.9117; 32.4106; 90; 90; 120; |
| COD ID: 1007068 | |
| CIF file | Formula: - As2 Ba Ni2 O8 - Comments: Eymond, S; Durif, A; Martin, C Structure cristalline du monoarseniate de nickelbaryum: Ba Ni~2~ (As O~4~)~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 268 (1969) 1694-1696 Space group: R -3 :H Cell volume: 500 Cell parameters: 4.945; 4.945; 23.61; 90; 90; 120; |
| COD ID: 1008081 | |
| CIF file | Formula: - F31 Na7 Zr6 - Comments: Burns, J H; Ellison, R D; Levy, H A The crystal structure of Na~7~ Zr~6~ F~31~ Acta Crystallographica B (24,1968-38,1982) 24 (1968) 230-237 Space group: R -3 :H Cell volume: 1556.7 Cell parameters: 13.807; 13.807; 9.429; 90; 90; 120; |
| COD ID: 1008202 | |
| CIF file | Formula: - H30 N6 O24 P6 Te - Comments: Boudjada, N; Boudjada, A; Guitel, J C Structure du Trimetaphosphate-Tellurate d'Ammonium, 2(N H~4~)~3~ P~3~ O~9~ * Te (O H)~6~ Acta Crystallographica C (39,1983-) 39 (1983) 656-658 Space group: R -3 :H Cell volume: 1926.4 Cell parameters: 11.16; 11.16; 17.86; 90; 90; 120; |
| COD ID: 1008208 | |
| CIF file | Formula: - H6 I2 K2 O12 Te - Comments: Averbuch-Pouchot, M T Crystal Chemistry of Some Addition Compounds of Alkali Iodates with Telluric Acid Journal of Solid State Chemistry 49 (1983) 368-378 Space group: R -3 :H Cell volume: 933.8 Cell parameters: 6.482; 6.482; 25.664; 90; 90; 120; |
| COD ID: 1008267 | |
| CIF file | Formula: - Ca Mn7 O12 - Comments: Bochu, B; Buevoz, J L; Chenavas, J; Collomb, A; Joubert, J C; Marezio, M Bond lengths in (Ca Mn~3~) (Mn~4~) O~12~. A new Jahn-Teller distortion of Mn^3+^ octahedra Solid State Communications 36 (1980) 133-138 Space group: R -3 :H Cell volume: 598.9 Cell parameters: 10.4414; 10.4414; 6.3433; 90; 90; 120; |
| COD ID: 1008727 | |
| CIF file | Formula: - Cu0.5 O12 P3 Ti2 - Comments: Olazcuaga, R; Le Flem, G; Boireau, A; Soubeyroux, J L The structure of the high temperature forms of Cu(II)0.5 Ti2 (P O4)3 and D0.5 Cu(I)0.5 Zr2 (P O4)3 Advanced Materials Research 1 (1994) 177-188 Space group: R -3 :H Cell volume: 1356.2 Cell parameters: 8.46; 8.46; 21.87999; 90; 90; 120; |
| COD ID: 1008794 | |
| CIF file | Formula: - Co F6 Zr - Comments: Rodriguez, V; Couzi, M; Tressaud, A; Grannec, J; Chaminade, J P; Soubeyroux, J L Structural phase transition in the ordered fluorides M(II) Zr F6 (M(II) = Co, Zn) : I.Structural study Journal of Physics: Condensed Matter 2 (1990) 7373-7386 Space group: R -3 :H Cell volume: 361.8 Cell parameters: 5.466; 5.466; 13.982; 90; 90; 120; |
| COD ID: 1008849 | |
| CIF file | Formula: - H2 K3 Li3 O19 P6 - Comments: Averbuch-Pouchot, M T On the existence of two new mixed-alkali cyclohexaphosphates Li3 Na3 P6 O18 (H2 O)12 and Li3 K3 P6 O18 (H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie 574 (1989) 225-234 Space group: R -3 :H Cell volume: 2505.7 Cell parameters: 15.047; 15.047; 12.779; 90; 90; 120; |
| COD ID: 1008850 | |
| CIF file | Formula: - H26 N6 O19 P6 - Comments: Averbuch-Pouchot, M T Structure of ammonium cyclo-hexaphosphate monohydrate Acta Crystallographica C (39,1983-) 45 (1989) 539-540 Space group: R -3 :H Cell volume: 1560.4 Cell parameters: 15.445; 15.445; 7.553; 90; 90; 120; |
| COD ID: 1008851 | |
| CIF file | Formula: - Cd3 H12 O24 P6 - Comments: Averbuch-Pouchot, M T Crystal structure of cadmium cyclohexaphosphate hexahydrate: Cd3 P6 O18 (H2 O)6 Zeitschrift fuer Anorganische und Allgemeine Chemie 570 (1989) 138-144 Space group: R -3 :H Cell volume: 3156.7 Cell parameters: 15.056; 15.056; 16.07999; 90; 90; 120; |
| COD ID: 1008854 | |
| CIF file | Formula: - Ag3 H14 N3 O19 P6 - Comments: Averbuch-Pouchot, M T Crystal chemistry of cyclo-hexaphosphates. XIV.Structure of silver ammonium cyclo-hexaphosphate monohydrate Acta Crystallographica C (39,1983-) 47 (1991) 930-932 Space group: R -3 :H Cell volume: 2789.7 Cell parameters: 15.172; 15.172; 13.994; 90; 90; 120; |
| COD ID: 1008859 | |
| CIF file | Formula: - C12 H192 N36 O132 P12 Te12 - Comments: Averbuch-Pouchot, M. T.; Schülke, U. Preparation and crystal structure of guanidinium cyclododecaphosphate telluric acid hydrate: (C (N H2)3)12 P12 O36. 12Te (O H)6 . 24H2 O Zeitschrift fuer Anorganische und Allgemeine Chemie 622(11) (1996) 1997-2002 Space group: R -3 :H Cell volume: 11158 Cell parameters: 15.854; 15.854; 51.26; 90; 90; 120; |
| COD ID: 1008869 | |
| CIF file | Formula: - Ag6 H2 O19 P6 - Comments: Averbuch-Pouchot, M T Crystal data and crystal structure of silver cyclohexaphosphate monohydrate: Ag6 P6 O18 * H2 O Zeitschrift fuer Kristallographie (149,1979-) 189 (1989) 17-23 Space group: R -3 :H Cell volume: 1252.6 Cell parameters: 14.807; 14.807; 6.597; 90; 90; 120; |
| COD ID: 1100054 | |
| CIF file | Formula: - B2 Ba O6 Ti - Comments: Zhang, S; Wu, X; Chen, X; He, M; Cao, Y; Song,Y; Ni,D A structural study of BaTi(BO~3~)~2~ Materials Research Bulletin 38 (2003) 783-788 Space group: R -3 :H Cell volume: 357.641 Cell parameters: 5.0205; 5.0205; 16.3844; 90; 90; 120; |
| COD ID: 1100196 | |
| CIF file | Formula: - C19 H16 O - Comments: K.Harms; M.Marsch Private Communication (2000) Space group: R -3 :H Cell volume: 6278.28 Cell parameters: 30.5918; 30.5918; 7.7464; 90; 90; 120; |
| COD ID: 1100397 | |
| CIF file | Formula: - C23.48 H30.12 Cr Mn O P2 - Comments: Elschenbroich, Christoph; Isenburg, Thomas; Metz, Bernhard; Behrendt, Andreas; Harms, Klaus Metal π complexes of benzene derivatives: XLIII1. Intramolecular interactions between bis(benzene) chromium and cymantrene units in di- and tri-nuclear species containing PMe~2~ spacers, as studied by CV and EPR Journal of Organometallic Chemistry 481(2) (1994) 153-165 Space group: R -3 :H Cell volume: 10542.2 Cell parameters: 38.401; 38.401; 8.255; 90; 90; 120; |
| COD ID: 1100427 | |
| CIF file | Formula: - C48 H108 Li12 O24 - Comments: Boche, Gernot; Möbus, Konrad; Harms, Klaus; Lohrenz, John C. W.; Marsch, Michael [Lithiumtert-butylperoxide]~12~: Crystal Structure of an Aggregated Oxenoid Chemistry - A European Journal 2(5) (1996) 604-607 Space group: R -3 :H Cell volume: 5432.67 Cell parameters: 20.799; 20.799; 14.501; 90; 90; 120; |
| COD ID: 1100734 | |
| CIF file | Formula: - C65 H46.33 Cl2 Hg2.17 I4.33 N8 O4.17 - Comments: Tara J. Burchell; Richard J. Puddephatt Self-Assembly of Chiral Coordination Polymers and Macrocycles: A Metal Template Effect on the Polymer-Macrocycle Equilibrium Inorganic Chemistry 44 (2005) 3718-3730 Space group: R -3 :H Cell volume: 33246 Cell parameters: 26.836; 26.836; 53.305; 90; 90; 120; |
| COD ID: 1100772 | |
| CIF file | Formula: - C18 H33 Gd N3 O18 P3 - Comments: Deng-Ke Cao; Yi-Zhi Li; You Song; Li-Min Zheng Three-, Two-, and One-Dimensional Metal Phosphonates Based on [Hydroxy(4-pyridyl)methyl]phosphonate: M{(4-C5H4N)CH(OH)PO3}(H2O) (M = Ni, Cd) and Gd{(4-C5H4N)CH(OH)P(OH)O2}3.6H2O Inorganic Chemistry 44 (2005) 3599-3604 Space group: R -3 :H Cell volume: 4245.7 Cell parameters: 22.2714; 22.2714; 9.8838; 90; 90; 120; |
| COD ID: 1101113 | |
| CIF file | Formula: - Fe H4 N O8 S2 - Comments: Richard L. Harlow; John M. Novak Unpublished () Space group: R -3 :H Cell volume: 492.458 Cell parameters: 4.827522; 4.827522; 24.40002; 90; 90; 120; |
| COD ID: 1101146 | |
| CIF file | Formula: - Ga13 H96 N15 O105 - Comments: Gerasko, Olga A.; Mainicheva, Ekaterina A.; Naumov, Dmitry Yu.; Kuratieva, Natalia V.; Sokolov, Maxim N.; Fedin, Vladimir P. Synthesis and Crystal Structure of Unprecedented Oxo/Hydroxo-Bridged Polynuclear Gallium(III) Aqua Complexes Inorganic Chemistry 44(12) (2005) 4133-4135 Space group: R -3 :H Cell volume: 6404.1 Cell parameters: 19.9915; 19.9915; 18.5028; 90; 90; 120; |
| COD ID: 1200014 | |
| CIF file | Formula: - C2 Ca Mg O6 - Comments: Beran, A.; Zemann, J. Refinement and comparison of the crystal structures of a dolomite and of an Fe-rich ankerite TMPM, Tschermaks Mineralogische und Petrographische Mitteilungen 24(4) (1977) 279-286 Space group: R -3 :H Cell volume: 321.3 Cell parameters: 4.812; 4.812; 16.02; 90; 90; 120; |
| COD ID: 1501994 | |
| CIF file | Formula: - C60 H42 - Comments: Ehlers, Peter; Neubauer, Antje; Lochbrunner, Stefan; Villinger, Alexander; Langer, Peter Multiple sonogashira reactions of polychlorinated molecules. Synthesis and photophysical properties of the first pentaalkynylpyridines. Organic letters 13(7) (2011) 1618-1621 Space group: R -3 :H Cell volume: 3204.8 Cell parameters: 18.6752; 18.6752; 10.6107; 90; 90; 120; |
| COD ID: 1502191 | |
| CIF file | Formula: - C60 H42 N4 O4.5 - Comments: Zhou, Ying; Jung, Ji Young; Jeon, Hye Ryeong; Kim, Youngmee; Kim, Sung-Jin; Yoon, Juyoung A novel supermolecular tetrameric vanadate-selective colorimetric and "off-on" sensor with pyrene ligand. Organic letters 13(10) (2011) 2742-2745 Space group: R -3 :H Cell volume: 6993.7 Cell parameters: 15.6; 15.6; 33.184; 90; 90; 120; |
| COD ID: 1502217 | |
| CIF file | Formula: - C18 H32 O2 Si - Comments: Lu, Yin-Suo; Peng, Xiao-Shui A concise construction of the chlorahololide heptacyclic core. Organic letters 13(11) (2011) 2940-2943 Space group: R -3 :H Cell volume: 8967 Cell parameters: 21.881; 21.881; 21.626; 90; 90; 120; |
| COD ID: 1502305 | |
| CIF file | Formula: - C155 H135 Cl9 O2 S6 - Comments: Chen, Jia-Hong; Wang, Shao-An; Liu, Yi-Hung; Wong, Ken-Tsung Synthesis and properties of novel C3-symmetric coplanar chromophores. Organic letters 13(16) (2011) 4168-4171 Space group: R -3 :H Cell volume: 19211 Cell parameters: 22.5627; 22.5627; 43.5749; 90; 90; 120; |
| COD ID: 1502429 | |
| CIF file | Formula: - C24 H17 N O - Comments: Hong, Deng; Zhu, Yuanxun; Li, Yao; Lin, Xufeng; Lu, Ping; Wang, Yanguang Three-component synthesis of polysubstituted pyrroles from α-diazoketones, nitroalkenes, and amines. Organic letters 13(17) (2011) 4668-4671 Space group: R -3 :H Cell volume: 8046.1 Cell parameters: 29.2867; 29.2867; 10.8321; 90; 90; 120; |
| COD ID: 1502734 | |
| CIF file | Formula: - C44 H30 - Comments: Han, Qingchuan; Su, Qiang; Tang, Lei; Feng, Jinwu; Lu, Ping; Wang, Yanguang Electron Transfer and Aggregate Formation Coinduced Emission Enhancement of 9-Cycloheptatrienylidene Fluorenes in the Presence of Cupric Chloride The Journal of Physical Chemistry C 114(43) (2010) 18702 Space group: R -3 :H Cell volume: 14827.4 Cell parameters: 39.1553; 39.1553; 11.16743; 90; 90; 120; |
| COD ID: 1503095 | |
| CIF file | Formula: - C18 H20 O2 - Comments: Valiulin, Roman A.; Arisco, Teresa M.; Kutateladze, Andrei G. Strained to the limit: when a cyclobutyl moiety becomes a thermodynamic sink in a protolytic ring-opening of photogenerated oxetanes. Organic letters 12(15) (2010) 3398-3401 Space group: R -3 :H Cell volume: 3123.53 Cell parameters: 23.8832; 23.8832; 6.3231; 90; 90; 120; |
| COD ID: 1503097 | |
| CIF file | Formula: - C12 H17 Cl O - Comments: Valiulin, Roman A.; Arisco, Teresa M.; Kutateladze, Andrei G. Strained to the limit: when a cyclobutyl moiety becomes a thermodynamic sink in a protolytic ring-opening of photogenerated oxetanes. Organic letters 12(15) (2010) 3398-3401 Space group: R -3 :H Cell volume: 4746.97 Cell parameters: 22.0572; 22.0572; 11.2664; 90; 90; 120; |
| COD ID: 1503139 | |
| CIF file | Formula: - C31 H40 N2 O5 S Si - Comments: Cordes, Jens; Harms, Klaus; Koert, Ulrich Synthesis of the isoquinocycline-pyrrolopyrrole substructure. Organic letters 12(17) (2010) 3808-3811 Space group: R -3 :H Cell volume: 14009 Cell parameters: 35.8162; 35.8162; 12.6101; 90; 90; 120; |
| COD ID: 1503450 | |
| CIF file | Formula: - C90 H102 N6 Si6 - Comments: Ji, Lei; Fang, Qi; Yuan, Mao-Sen; Liu, Zhi-Qiang; Shen, Yu-Xiang; Chen, Hong-Feng Switching high two-photon efficiency: from 3,8,13-substituted triindole derivatives to their 2,7,12-isomers. Organic letters 12(22) (2010) 5192-5195 Space group: R -3 :H Cell volume: 12965.3 Cell parameters: 29.161; 29.161; 17.6054; 90; 90; 120; |
| COD ID: 1503489 | |
| CIF file | Formula: - C12 H15.67 N O4.33 S - Comments: Burkhard, Johannes A.; Guérot, Carine; Knust, Henner; Carreira, Erick M. Expanding the azaspiro[3.3]heptane family: synthesis of novel highly functionalized building blocks. Organic letters 14(1) (2012) 66-69 Space group: R -3 :H Cell volume: 5747.3 Cell parameters: 23.477; 23.477; 12.0406; 90; 90; 120; |
| COD ID: 1503498 | |
| CIF file | Formula: - C15 H24 O3 Si - Comments: Bartoli, Alexandra; Chouraqui, Gaëlle; Parrain, Jean-Luc Collective domino approach toward the core of molecules isolated from the genus Schisandra. Organic letters 14(1) (2012) 122-125 Space group: R -3 :H Cell volume: 7483.6 Cell parameters: 30.0284; 30.0284; 9.5833; 90; 90; 120; |
| COD ID: 1503761 | |
| CIF file | Formula: - C17 H20 Br N O - Comments: Yang, Yong-Sheng; Shen, Zhi-Liang; Loh, Teck-Peng Indium (zinc)-copper-mediated Barbier-type alkylation reaction of nitrones in water: synthesis of amines and hydroxylamines. Organic letters 11(6) (2009) 1209-1212 Space group: R -3 :H Cell volume: 7288.07 Cell parameters: 29.9907; 29.9907; 9.3564; 90; 90; 120; |
| COD ID: 1503762 | |
| CIF file | Formula: - C17 H20 Cl N O - Comments: Yang, Yong-Sheng; Shen, Zhi-Liang; Loh, Teck-Peng Indium (zinc)-copper-mediated Barbier-type alkylation reaction of nitrones in water: synthesis of amines and hydroxylamines. Organic letters 11(6) (2009) 1209-1212 Space group: R -3 :H Cell volume: 7045.7 Cell parameters: 29.6684; 29.6684; 9.2429; 90; 90; 120; |
| COD ID: 1503813 | |
| CIF file | Formula: - C63 H51 N - Comments: Jiang, Zuoquan; Chen, Yonghua; Yang, Chuluo; Cao, Yue; Tao, Youtian; Qin, Jingui; Ma, Dongge A fully diarylmethylene-bridged triphenylamine derivative as novel host for highly efficient green phosphorescent OLEDs. Organic letters 11(7) (2009) 1503-1506 Space group: R -3 :H Cell volume: 16149 Cell parameters: 16.798; 16.798; 66.084; 90; 90; 120; |
| COD ID: 1503826 | |
| CIF file | Formula: - C140.64 H73.28 N4 O - Comments: Clavaguera, Simon; Khan, Saeed I.; Rubin, Yves Unexpected de-arylation of a pentaaryl fullerene. Organic letters 11(6) (2009) 1389-1391 Space group: R -3 :H Cell volume: 48858 Cell parameters: 46.5271; 46.5271; 26.061; 90; 90; 120; |
| COD ID: 1503914 | |
| CIF file | Formula: - C12 H15 N O2 - Comments: Donohoe, Timothy J.; Callens, Cedric K. A.; Thompson, Amber L. Tethered aminohydroxylation (TA) reaction of amides. Organic letters 11(11) (2009) 2305-2307 Space group: R -3 :H Cell volume: 5226.13 Cell parameters: 22.3219; 22.3219; 12.1112; 90; 90; 120; |
| COD ID: 1504150 | |
| CIF file | Formula: - C16 H26 N2 O4 - Comments: Chen, Peiling; Carroll, Patrick J.; Sieburth, Scott McN 3-4'-Bipiperidines via sequential [4 + 4]-[3,3]-retro-Mannich reactions. Organic letters 11(20) (2009) 4540-4543 Space group: R -3 :H Cell volume: 7414.9 Cell parameters: 28.99; 28.99; 10.1877; 90; 90; 120; |
| COD ID: 1504205 | |
| CIF file | Formula: - C30 H34 O2.96 - Comments: Modjewski, Matthew; Lindeman, Sergey V.; Rathore, Rajendra A versatile preparation of Geländer-type p-terphenyls from a readily available diacetylenic precursor. Organic letters 11(20) (2009) 4656-4659 Space group: R -3 :H Cell volume: 5526.77 Cell parameters: 21.0561; 21.0561; 14.3941; 90; 90; 120; |
| COD ID: 1504271 | |
| CIF file | Formula: - C36 H37 Cl O5 - Comments: Zhu, Zhi-Bin; Shi, Min Palladium(II) acetate catalyzed tandem cycloisomerization and oxidation of arylvinylcyclopropenes using p-benzoquinone as oxidant and pro-nucleophile. Organic letters 11(22) (2009) 5278-5281 Space group: R -3 :H Cell volume: 14801 Cell parameters: 30.1433; 30.1433; 18.809; 90; 90; 120; |
| COD ID: 1505779 | |
| CIF file | Formula: - C22.33 H24.33 Cl N2 O2 Zn - Comments: Chen, Hsuan-Ying; Tang, Hui-Yi; Lin, Chu-Chieh Ring-Opening Polymerization of Lactides Initiated by Zinc Alkoxides Derived from NNO-Tridentate Ligands Macromolecules 39(11) (2006) 3745-3752 Space group: R -3 :H Cell volume: 9768.1 Cell parameters: 22.6716; 22.6716; 21.944; 90; 90; 120; |
| COD ID: 1505999 | |
| CIF file | Formula: - C40 H38 N2 O10 - Comments: Lavin, Judith M.; Shimizu, Ken D. Rapid screening of a receptor with molecular memory. Organic letters 8(11) (2006) 2389-2392 Space group: R -3 :H Cell volume: 8526.2 Cell parameters: 31.7102; 31.7102; 9.791; 90; 90; 120; |
| COD ID: 1506326 | |
| CIF file | Formula: - C9 H17 Cl N2 - Comments: Andre, M.; Loidl, J.; Laus, G.; Schottenberger, H.; Bentivoglio, G.; Wurst, K.; Ongania, K.-H. Ionic liquids as advantageous solvents for headspace gas chromatography of compounds with low vapor pressure. Analytical chemistry 77(2) (2005) 702-705 Space group: R -3 :H Cell volume: 4969.8 Cell parameters: 28.3013; 28.3013; 7.1646; 90; 90; 120; |
| COD ID: 1506743 | |
| CIF file | Formula: - C20 H31 Cl N2 O3 - Comments: Lim, Yeon-Hee; Li, Tindy; Chen, Peiling; Schreiber, Patrick; Kuznetsova, Larissa; Carroll, Patrick J.; Lauher, Joseph W.; Sieburth, Scott McN Asymmetry by electrophilic rearrangement of symmetric 2-pyridone photodimers. Organic letters 7(24) (2005) 5413-5415 Space group: R -3 :H Cell volume: 10263.9 Cell parameters: 25.354; 25.354; 18.437; 90; 90; 120; |
| COD ID: 1507040 | |
| CIF file | Formula: - C118 H117 Cl N16 O18 - Comments: Jiang, Hua; Léger, Jean-Michel; Guionneau, Philippe; Huc, Ivan Strained aromatic oligoamide macrocycles as new molecular clips. Organic letters 6(17) (2004) 2985-2988 Space group: R -3 :H Cell volume: 53477 Cell parameters: 33.03; 33.03; 56.6; 90; 90; 120; |
| COD ID: 1507279 | |
| CIF file | Formula: - C44 H7 Ag F20 N4 O0.5 - Comments: Maeda, Hiromitsu; Osuka, Atsuhiro; Ishikawa, Yuichi; Aritome, Isao; Hisaeda, Yoshio; Furuta, Hiroyuki N-confused porphyrin-bearing meso-perfluorophenyl groups: a potential agent that forms stable square-planar complexes with Cu(II) and Ag(III). Organic letters 5(8) (2003) 1293-1296 Space group: R -3 :H Cell volume: 8646 Cell parameters: 20.29; 20.29; 24.25; 90; 90; 120; |
| COD ID: 1507280 | |
| CIF file | Formula: - C44 H8 F20 N4 Ni - Comments: Maeda, Hiromitsu; Osuka, Atsuhiro; Ishikawa, Yuichi; Aritome, Isao; Hisaeda, Yoshio; Furuta, Hiroyuki N-confused porphyrin-bearing meso-perfluorophenyl groups: a potential agent that forms stable square-planar complexes with Cu(II) and Ag(III). Organic letters 5(8) (2003) 1293-1296 Space group: R -3 :H Cell volume: 8333.4 Cell parameters: 19.6856; 19.6856; 24.831; 90; 90; 120; |
| COD ID: 1507281 | |
| CIF file | Formula: - C44 H8 F20 N4 Pd - Comments: Maeda, Hiromitsu; Osuka, Atsuhiro; Ishikawa, Yuichi; Aritome, Isao; Hisaeda, Yoshio; Furuta, Hiroyuki N-confused porphyrin-bearing meso-perfluorophenyl groups: a potential agent that forms stable square-planar complexes with Cu(II) and Ag(III). Organic letters 5(8) (2003) 1293-1296 Space group: R -3 :H Cell volume: 8417.7 Cell parameters: 19.6798; 19.6798; 25.097; 90; 90; 120; |
| COD ID: 1507282 | |
| CIF file | Formula: - C44 H8 Cu F20 N4 - Comments: Maeda, Hiromitsu; Osuka, Atsuhiro; Ishikawa, Yuichi; Aritome, Isao; Hisaeda, Yoshio; Furuta, Hiroyuki N-confused porphyrin-bearing meso-perfluorophenyl groups: a potential agent that forms stable square-planar complexes with Cu(II) and Ag(III). Organic letters 5(8) (2003) 1293-1296 Space group: R -3 :H Cell volume: 8430.6 Cell parameters: 20.1647; 20.1647; 23.941; 90; 90; 120; |
| COD ID: 1507759 | |
| CIF file | Formula: - F6 Mn Nb - Comments: Bizot, D.; Chassaing, J.; Pannetier, J.; Leblanc, M.; Le Bail, A.; Ferey, G. Fluorocomplexes of niobium IV - Part V* the magnetic structure of MnNbF6 Solid State Communications 58(1) (1986) 71-74 Space group: R -3 :H Cell volume: 361.6 Cell parameters: 5.385; 5.385; 14.399; 90; 90; 120; |
| COD ID: 1507787 | |
| CIF file | Formula: - C36.67 H31 Br2 Cl2 Mn2 N4.33 O14 - Comments: Corbella, M; Gomez, V; Garcia, B; Rodriguez, E; Albela, B; Maestro, M A Synthesis, crystal structure and magnetic properties of new dinuclear Mn(III) compounds with 4-ClC6H4COO and 4-BrC6H4COO bridges Inorganica Chimica Acta 376(1) (2011) 456-462 Space group: R -3 :H Cell volume: 19706.4 Cell parameters: 25.4824; 25.4824; 35.0425; 90; 90; 120; |
| COD ID: 1507855 | |
| CIF file | Formula: - C15 H24 O2 - Comments: Gao, Peng; Cook, Silas P. A reductive-Heck approach to the hydroazulene ring system: a formal synthesis of the englerins. Organic letters 14(13) (2012) 3340-3343 Space group: R -3 :H Cell volume: 6392.5 Cell parameters: 27.8708; 27.8708; 9.5026; 90; 90; 120; |
| COD ID: 1508078 | |
| CIF file | Formula: - C30 H30 Re3 Sm - Comments: Butovskii, Mikhail V.; Döring, Christian; Bezugly, Viktor; Wagner, Frank R.; Grin, Yuri; Kempe, Rhett Molecules containing rare-earth atoms solely bonded by transition metals. Nature chemistry 2(9) (2010) 741-744 Space group: R -3 :H Cell volume: 11350.2 Cell parameters: 41.437; 41.437; 7.633; 90; 90; 120; |
| COD ID: 1508080 | |
| CIF file | Formula: - C30 H30 Lu Re3 - Comments: Butovskii, Mikhail V.; Döring, Christian; Bezugly, Viktor; Wagner, Frank R.; Grin, Yuri; Kempe, Rhett Molecules containing rare-earth atoms solely bonded by transition metals. Nature chemistry 2(9) (2010) 741-744 Space group: R -3 :H Cell volume: 11199.1 Cell parameters: 41.12; 41.12; 7.648; 90; 90; 120; |
| COD ID: 1508081 | |
| CIF file | Formula: - C30 H30 La Re3 - Comments: Butovskii, Mikhail V.; Döring, Christian; Bezugly, Viktor; Wagner, Frank R.; Grin, Yuri; Kempe, Rhett Molecules containing rare-earth atoms solely bonded by transition metals. Nature chemistry 2(9) (2010) 741-744 Space group: R -3 :H Cell volume: 11434 Cell parameters: 41.647; 41.647; 7.612; 90; 90; 120; |
| COD ID: 1508205 | |
| CIF file | Formula: - C35 H55 Cu2 N O19 - Comments: Vukotic, V. Nicholas; Harris, Kristopher J.; Zhu, Kelong; Schurko, Robert W.; Loeb, Stephen J. Metal-organic frameworks with dynamic interlocked components. Nature chemistry 4(6) (2012) 456-460 Space group: R -3 :H Cell volume: 9136 Cell parameters: 23.127; 23.127; 19.723; 90; 90; 120; |
| COD ID: 1508293 | |
| CIF file | Formula: - C71.33 H53 F6 O0.33 P3 Ru - Comments: Ma, Hao-Wei; Lin, Ying-Chih; Huang, Shou-Ling Sequential allenylidene/vinylidene cyclization for stereoselective construction of bicyclic carbocycles from propargyl alcohol. Organic letters 14(15) (2012) 3846-3849 Space group: R -3 :H Cell volume: 27741 Cell parameters: 35.4603; 35.4603; 25.4746; 90; 90; 120; |
| COD ID: 1508370 | |
| CIF file | Formula: - C5 H19.47 N2 O5.24 P - Comments: Harrison, William T. A. Supramolecular Hydrogen-Bond Motifs in Chiral and Racemic Molecular Salts: A Comparison of (S)-2-Methyl Piperizinium Hydrogen Phosphite Monohydrate, C5H14N2·HPO3·H2O and (R,S)-2-Methyl Piperizinium Hydrogen Phosphite 2.23 Hydrate, C5H14N2·HPO3·2.23H2O Crystals 1(4) (2011) 236-243 Space group: R -3 :H Cell volume: 5174.5 Cell parameters: 31.075; 31.075; 6.1875; 90; 90; 120; |
| COD ID: 1508387 | |
| CIF file | Formula: - Lu20 Ru11 - Comments: Zimmermann, Sina; Pantenburg, Ingo; Meyer, Gerd Ru11Lu20, a New Intermetallic Compound with Eight- to Ten-Coordinate Ruthenium Atoms Crystals 2(2) (2012) 704-709 Space group: R -3 :H Cell volume: 4056.1 Cell parameters: 12.5514; 12.5514; 29.73; 90; 90; 120; |
| COD ID: 1509237 | |
| CIF file | Formula: - Ag Bi O3 - Comments: Kumada, N.; Sleight, A.W.; Takahashi, N.; Kinomura, N. Synthesis of new ilmenite-type oxides, Ag M O3 (M = Sb, Si) by ion-exchange reaction Special Publication - Royal Society of Chemistry 239 (1999) 212-217 Space group: R -3 :H Cell volume: 444.175 Cell parameters: 5.641; 5.641; 16.118; 90; 90; 120; |
| COD ID: 1509393 | |
| CIF file | Formula: - Ag I3 Tl2 - Comments: Hoyer, M.; Hartl, H. Die Kristallstrukturen von Tl2 Ag I3 und Na Ag I2 . 3H2 O Zeitschrift fuer Anorganische und Allgemeine Chemie 622 (1996) 308-312 Space group: R -3 :H Cell volume: 1882.77 Cell parameters: 10.443; 10.443; 19.935; 90; 90; 120; |
| COD ID: 1509588 | |
| CIF file | Formula: - Ag1.3 Cl6 Na1.7 Y - Comments: Stenzel, F.; Meyer, G. Ternary halides of the A3 M X6 Typ II. The system Ag3-x Nax Y Cl6: Synthesis, structure ionic conductivity Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 652-660 Space group: R -3 :H Cell volume: 767.634 Cell parameters: 6.915; 6.915; 18.537; 90; 90; 120; |
| COD ID: 1509721 | |
| CIF file | Formula: - Ag2 Sr3 - Comments: Merlo, F.; Fornasini, M.L. Crystal structure of the phases Sr2 Ag3, Ca5 Au3, Sr7 Au3 and Sr7 Ag3 Revue de Chimie Minerale 21 (1984) 273-281 Space group: R -3 :H Cell volume: 1599.45 Cell parameters: 9.962; 9.962; 18.61; 90; 90; 120; |
| COD ID: 1509959 | |
| CIF file | Formula: - Ag7 F31 Zr6 - Comments: Koller, D.; Mueller, B.G. Synthese und Struktur von Ag7 M6 F31 (M = Zr, Hf, Ce) Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1426-1428 Space group: R -3 :H Cell volume: 1663.9 Cell parameters: 14.009; 14.009; 9.79; 90; 90; 120; |
| COD ID: 1509979 | |
| CIF file | Formula: - Ag3 Cl6 Y - Comments: Laqua, W.; Lerch, K.; Meyer, G. Kristallstruktur und elektrische Leitfaehigkeit von Ag3 Y Cl6 Zeitschrift fuer Anorganische und Allgemeine Chemie 582 (1990) 143-150 Space group: R -3 :H Cell volume: 747.518 Cell parameters: 6.8669; 6.8669; 18.305; 90; 90; 120; |
| COD ID: 1510148 | |
| CIF file | Formula: - Au F6 O2 - Comments: Graudejus, O.; Mueller, B.G. Zur Kristallstruktur von (O2)+ (M F6)- (M= Sb, Ru, Pt, Au) Zeitschrift fuer Anorganische und Allgemeine Chemie 622 (1996) 1076-1082 Space group: R -3 :H Cell volume: 371.056 Cell parameters: 7.759; 7.759; 7.117; 90; 90; 120; |
| COD ID: 1510400 | |
| CIF file | Formula: - Au0.7 S2 Ta14.3 - Comments: Wagner, V.; Harbrecht, B. AuTa14S2 - zentrierte (Au,Ta)13-Ikosaeder organisiert nach dem Motiv einer kubisch dichten Packung Zeitschrift fuer Anorganische und Allgemeine Chemie 620 (1994) 969-976 Space group: R -3 :H Cell volume: 883.528 Cell parameters: 7.459; 7.459; 18.337; 90; 90; 120; |
| COD ID: 1510468 | |
| CIF file | Formula: - Au2 Sr3 - Comments: Fornasini, M.L.; Merlo, F.; Pani, M. Structures of Ca3 Au, Ca5 Au2, Sr3 Au2, Ba3 Au2 and alloying behaviour of the alkaline earths with Cu, Ag, Au Revue de Chimie Minerale 22 (1985) 791-798 Space group: R -3 :H Cell volume: 1466.59 Cell parameters: 9.604; 9.604; 18.36; 90; 90; 120; |
| COD ID: 1510631 | |
| CIF file | Formula: - B2 Co3 Zr - Comments: Kuz'ma, Yu.B.; Kripyakevich, P.I.; Voroshilov, Yu.V. Crystal structures of Zr Co3 B2 and Hf Co3 B2 Kristallografiya 15 (1970) 934-938 Space group: R -3 :H Cell volume: 560.421 Cell parameters: 8.418; 8.418; 9.132; 90; 90; 120; |
| COD ID: 1510753 | |
| CIF file | Formula: - B2 Mg O6 Sn - Comments: Vicat, J.; Aleonard, S. Borates Me(IV) Me(II) (B O3)2 de structure dolomite Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 266 (1968) 1046-1049 Space group: R -3 :H Cell volume: 286.47 Cell parameters: 4.707; 4.707; 14.93; 90; 90; 120; |
| COD ID: 1510791 | |
| CIF file | Formula: - B2 Ca0.02 Fe0.15 Mn0.83 O6 Sn - Comments: Konovalenko, S.I.; Pushcharovskii, D.Yu.; Yamnova, N.A.; Kalacheva, L.V. Crystal structure of a new natural tusionite borate Mn Sn (B O3)2. Kristallografiya 37 (1992) 1557-1558 Space group: R -3 :H Cell volume: 301.685 Cell parameters: 4.771; 4.771; 15.304; 90; 90; 120; |
| COD ID: 1510801 | |
| CIF file | Formula: - B2 O6 Sn Sr - Comments: Aleonard, S.; Vicat, J. Borates Me(IV) Me(II) (B O3)2 de structure dolomite Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 266 (1968) 1046-1049 Space group: R -3 :H Cell volume: 354.521 Cell parameters: 4.941; 4.941; 16.768; 90; 90; 120; |
| COD ID: 1510871 | |
| CIF file | Formula: - B3 Ba3 Dy O9 - Comments: Ilyukhin, A.B.; Dzhurinskii, B.F. Crystal structures of double borates Ln Ba3 (B O3)3 (Ln= Dy, Ho, Tm, Yb, Lu) Zhurnal Neorganicheskoi Khimii 38 (1993) 1625-1630 Space group: R -3 :H Cell volume: 1402.57 Cell parameters: 13.041; 13.041; 9.523; 90; 90; 120; |
| COD ID: 1510877 | |
| CIF file | Formula: - B3 Ba3 O9 Y - Comments: Xu, Y.P.; Li, X.Z.; Wu, L.; Jian, J.K.; Chen, X.L.; Cao, Y.G. Thermal stability and crystal structure of beta-(Ba3 Y B3 O9) Journal of Solid State Chemistry 177 (2004) 216-220 Space group: R -3 :H Cell volume: 1404.14 Cell parameters: 13.0441; 13.0441; 9.5291; 90; 90; 120; |
| COD ID: 1511042 | |
| CIF file | Formula: - B Cl12 Sc7 - Comments: Corbett, J.D.; Hwu, S.-J. Metal-metal bonded scandium cluster (Sc7 Cl12 Z) and infinite chain (Sc4 Cl6 Z) phases stabilized by interstitial boron or nitrogen (Z) Journal of Solid State Chemistry 64 (1986) 331-346 Space group: R -3 :H Cell volume: 1305.25 Cell parameters: 13.014; 13.014; 8.899; 90; 90; 120; |
| COD ID: 1511274 | |
| CIF file | Formula: - B O3 Sc0.75 Tb0.25 - Comments: Kuz'micheva, G.M.; Panyutin, V.L.; Rybakov, V.B.; Kuz'min, O.V.; Kutovoi, S.A. Morphotropic series of Ln Sc3 (B O3)4 compounds Kristallografiya 45 (2000) 990-995 Space group: R -3 :H Cell volume: 305.411 Cell parameters: 4.773; 4.773; 15.48; 90; 90; 120; |
| COD ID: 1511386 | |
| CIF file | Formula: - B12 Fe1.5 Li5.5 O24 Pb - Comments: Belokoneva, E.L.; Dimitrova, O.V.; Ruchkina, E.A. Synthesis and crystal structure of the new lithium-enriched hexaborate (Li5.5 Fe0.5) Fe Pb (B6 O12)2 with the original helical chain (B3(box) B3(Delta) O12)6-(infin) Zhurnal Neorganicheskoi Khimii 46 (2001) 25-32 Space group: R -3 :H Cell volume: 1228.18 Cell parameters: 14.71; 14.71; 6.554; 90; 90; 120; |
| COD ID: 1511388 | |
| CIF file | Formula: - B12 H12 O8 Sr - Comments: Schleid, T.; Tiritiris, I. Dodekahydro-closo-dodekaborate der schweren Erdalkalimetalle aus waessriger Loesung: Ca (H2 O)7 (B12 H12) * (H2 O), Sr (H2 O)8 (B12 H12) und Ba (H2 O)6 (B12 H12) Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 1836-1845 Space group: R -3 :H Cell volume: 1299.35 Cell parameters: 10.1271; 10.1271; 14.6294; 90; 90; 120; |
| COD ID: 1511429 | |
| CIF file | Formula: - B18 O72.994 V12 Zn6 - Comments: Zhang, L.; Shi, Z.; Feng, S.-H.; Yang, G.; Chen, X. Hydrothermal synthesis and X-ry single crystal structure of (Zn (en)2)6 ((V O)12 O6 B18 O39 (O H)3)*13 H2 O Journal of Solid State Chemistry 148 (1999) 450-454 Space group: R -3 :H Cell volume: 7750.71 Cell parameters: 20.686; 20.686; 20.915; 90; 90; 120; |
| COD ID: 1511639 | |
| CIF file | Formula: - B6 O18 Sc Sr6 Y - Comments: Jin, A.-D.; Lin, X.-T.; Huang, J.-F. Preparation and crystal structure of a new borate Sr6YSc(BO3)6 Jiegon Huaxue 11 (1992) 196-199 Space group: R -3 :H Cell volume: 1211.15 Cell parameters: 12.284; 12.284; 9.268; 90; 90; 120; |
| COD ID: 1511644 | |
| CIF file | Formula: - B6 S12 Sr3 - Comments: Puettmann, C.; Hammerschmidt, A.; Krebs, B.; Doech, M. Sr3 (B S3)2 und Sr3 (B3 S6)2 : zwei neue nicht-oxidische Chalkogenoborate mit trigonal-planar koordiniertem Bor Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 551-555 Space group: R -3 :H Cell volume: 1381.4 Cell parameters: 8.605; 8.605; 21.542; 90; 90; 120; |
| COD ID: 1512365 | |
| CIF file | Formula: - C46.5 H51.17 Cl4 N2 P2 Ru - Comments: Cordes, Jens; Murray, Philip R. D.; White, Andrew J. P.; Barrett, Anthony G. M. 1,7-Diazaspiro[5.5]undecane - A Neglected Heterocycle. Organic letters 15(19) (2013) 4992-4995 Space group: R -3 :H Cell volume: 19755.6 Cell parameters: 45.361; 45.361; 11.08652; 90; 90; 120; |
| COD ID: 1512465 | |
| CIF file | Formula: - C26 H22 N8 Ni2 O2 S2 - Comments: Sayanti Dattaa; Dipravath Kumar Setha; Sudeshna Gangopadhyayb; Parimal Karmakarb; Samaresh Bhattacharya Nickel complexes of some thiosemicarbazones: Synthesis, structure, catalytic properties and cytotoxicity studies Inorganica Chimica Acta 392 (2012) 118-130 Space group: R -3 :H Cell volume: 6390.8 Cell parameters: 29.4973; 29.4973; 8.4812; 90; 90; 120; |
| COD ID: 1512993 | |
| CIF file | Formula: - C24 H48 B2 F8 N24 Ni - Comments: Nader Hassan; Julia Stelzl; Peter Weinberger; Gabor Molnar; Azzedine Bousseksou; Frank Kubel; Kurt Mereiter; Roman Boca; Wolfgang Linert Spectroscopic, structural and magnetic investigations of iron(II) complexes based on 1-isopropyl- and 1-isobutyl-substituted tetrazole ligands Inorganica Chimica Acta 396 (2013) 92-100 Space group: R -3 :H Cell volume: 3361.7 Cell parameters: 11.0211; 11.0211; 31.958; 90; 90; 120; |
| COD ID: 1512994 | |
| CIF file | Formula: - C30 H60 B2 F8 N24 Ni - Comments: Nader Hassan; Julia Stelzl; Peter Weinberger; Gabor Molnar; Azzedine Bousseksou; Frank Kubel; Kurt Mereiter; Roman Boca; Wolfgang Linert Spectroscopic, structural and magnetic investigations of iron(II) complexes based on 1-isopropyl- and 1-isobutyl-substituted tetrazole ligands Inorganica Chimica Acta 396 (2013) 92-100 Space group: R -3 :H Cell volume: 3728.2 Cell parameters: 10.8629; 10.8629; 36.4816; 90; 90; 120; |
| COD ID: 1513261 | |
| CIF file | Formula: - C22 H26 O2 - Comments: Olive, Alexandre G. L.; Raffy, Guillaume; Allouchi, Hassan; Léger, Jean-Michel; Del Guerzo, André; Desvergne, Jean-Pierre Striking Correlation between the Unusual Trigonal Crystal Packing and the Ability to Self-Assemble into Nanofibers of 2,3-Di-n-alkyloxyanthracenes† Langmuir 25(15) (2009) 8606-8614 Space group: R -3 :H Cell volume: 8701.6 Cell parameters: 14.6672; 14.6672; 46.706; 90; 90; 120; |
| COD ID: 1513262 | |
| CIF file | Formula: - C26 H34 O2 - Comments: Olive, Alexandre G. L.; Raffy, Guillaume; Allouchi, Hassan; Léger, Jean-Michel; Del Guerzo, André; Desvergne, Jean-Pierre Striking Correlation between the Unusual Trigonal Crystal Packing and the Ability to Self-Assemble into Nanofibers of 2,3-Di-n-alkyloxyanthracenes† Langmuir 25(15) (2009) 8606-8614 Space group: R -3 :H Cell volume: 10103 Cell parameters: 14.639; 14.639; 54.435; 90; 90; 120; |
| COD ID: 1513383 | |
| CIF file | Formula: - C40 H49 B N2 O2 Pt - Comments: Ko, Soo-Byung; Lu, Jia-Sheng; Wang, Suning Chelation-assisted photoelimination of b,n-heterocycles. Organic letters 16(2) (2014) 616-619 Space group: R -3 :H Cell volume: 16708 Cell parameters: 36.782; 36.782; 14.26; 90; 90; 120; |
| COD ID: 1513617 | |
| CIF file | Formula: - C168 H342 K6 Mg6 N12 - Comments: Martínez-Martínez, A. J.; Armstrong, D. R.; Conway, B.; Fleming, B. J.; Klett, J.; Kennedy, A. R.; Mulvey, R. E.; Robertson, S. D.; O'Hara, C. T. Pre-inverse-crowns: synthetic, structural and reactivity studies of alkali metal magnesiates primed for inverse crown formation Chemical Science 5(2) (2014) 771 Space group: R -3 :H Cell volume: 14374.9 Cell parameters: 37.852; 37.852; 11.585; 90; 90; 120; |
| COD ID: 1513618 | |
| CIF file | Formula: - C189 H282 K6 Mg6 N12 - Comments: Martínez-Martínez, A. J.; Armstrong, D. R.; Conway, B.; Fleming, B. J.; Klett, J.; Kennedy, A. R.; Mulvey, R. E.; Robertson, S. D.; O'Hara, C. T. Pre-inverse-crowns: synthetic, structural and reactivity studies of alkali metal magnesiates primed for inverse crown formation Chemical Science 5(2) (2014) 771 Space group: R -3 :H Cell volume: 14642.8 Cell parameters: 37.8751; 37.8751; 11.7865; 90; 90; 120; |
| COD ID: 1513714 | |
| CIF file | Formula: - C33 H52 Cl3 Cu6 N13 O6 - Comments: Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science 5(1) (2014) 324 Space group: R -3 :H Cell volume: 3409.34 Cell parameters: 19.873; 19.873; 9.9681; 90; 90; 120; |
| COD ID: 1513715 | |
| CIF file | Formula: - C30 H48 Cu6 N12 O6 - Comments: Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science 5(1) (2014) 324 Space group: R -3 :H Cell volume: 3571.4 Cell parameters: 20.1726; 20.1726; 10.1341; 90; 90; 120; |
| COD ID: 1513716 | |
| CIF file | Formula: - C30 H48 Cu6 N12 O6 - Comments: Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science 5(1) (2014) 324 Space group: R -3 :H Cell volume: 3411.95 Cell parameters: 19.8969; 19.8969; 9.9518; 90; 90; 120; |
| COD ID: 1513806 | |
| CIF file | Formula: - C8 H24 O12 Si8 - Comments: Jalarvo, Niina; Gourdon, Olivier; Ehlers, Georg; Tyagi, Madhusudan; Kumar, Sanat K.; Dobbs, Kerwin D.; Smalley, Robert J.; Guise, William E.; Ramirez-Cuesta, Anibal; Wildgruber, Christoph; Crawford, Michael K. Structure and Dynamics of Octamethyl-POSS Nanoparticles The Journal of Physical Chemistry C 118(10) (2014) 5579 Space group: R -3 :H Cell volume: 1748.62 Cell parameters: 12.4443; 12.4443; 13.0384; 90; 90; 120; |
| COD ID: 1513807 | |
| CIF file | Formula: - C8 H24 O12 Si8 - Comments: Jalarvo, Niina; Gourdon, Olivier; Ehlers, Georg; Tyagi, Madhusudan; Kumar, Sanat K.; Dobbs, Kerwin D.; Smalley, Robert J.; Guise, William E.; Ramirez-Cuesta, Anibal; Wildgruber, Christoph; Crawford, Michael K. Structure and Dynamics of Octamethyl-POSS Nanoparticles The Journal of Physical Chemistry C 118(10) (2014) 5579 Space group: R -3 :H Cell volume: 1714.61 Cell parameters: 12.3948; 12.3948; 12.8871; 90; 90; 120; |
| COD ID: 1513808 | |
| CIF file | Formula: - C8 H24 O12 Si8 - Comments: Jalarvo, Niina; Gourdon, Olivier; Ehlers, Georg; Tyagi, Madhusudan; Kumar, Sanat K.; Dobbs, Kerwin D.; Smalley, Robert J.; Guise, William E.; Ramirez-Cuesta, Anibal; Wildgruber, Christoph; Crawford, Michael K. Structure and Dynamics of Octamethyl-POSS Nanoparticles The Journal of Physical Chemistry C 118(10) (2014) 5579 Space group: R -3 :H Cell volume: 1732.87 Cell parameters: 12.4109; 12.4109; 12.99059; 90; 90; 120; |
| COD ID: 1513809 | |
| CIF file | Formula: - C8 H24 O12 Si8 - Comments: Jalarvo, Niina; Gourdon, Olivier; Ehlers, Georg; Tyagi, Madhusudan; Kumar, Sanat K.; Dobbs, Kerwin D.; Smalley, Robert J.; Guise, William E.; Ramirez-Cuesta, Anibal; Wildgruber, Christoph; Crawford, Michael K. Structure and Dynamics of Octamethyl-POSS Nanoparticles The Journal of Physical Chemistry C 118(10) (2014) 5579 Space group: R -3 :H Cell volume: 1719.4 Cell parameters: 12.3959; 12.3959; 12.9208; 90; 90; 120; |
| COD ID: 1513810 | |
| CIF file | Formula: - C8 H24 O12 Si8 - Comments: Jalarvo, Niina; Gourdon, Olivier; Ehlers, Georg; Tyagi, Madhusudan; Kumar, Sanat K.; Dobbs, Kerwin D.; Smalley, Robert J.; Guise, William E.; Ramirez-Cuesta, Anibal; Wildgruber, Christoph; Crawford, Michael K. Structure and Dynamics of Octamethyl-POSS Nanoparticles The Journal of Physical Chemistry C 118(10) (2014) 5579 Space group: R -3 :H Cell volume: 1774.76 Cell parameters: 12.5077; 12.5077; 13.0995; 90; 90; 120; |
| COD ID: 1514235 | |
| CIF file | Formula: - Mn2 O3 - Comments: Ovsyannikov, Sergey V.; Abakumov, Artem M.; Tsirlin, Alexander A.; Schnelle, Walter; Egoavil, Ricardo; Verbeeck, Jo; Van Tendeloo, Gustaaf; Glazyrin, Konstantin V.; Hanfland, Michael; Dubrovinsky, Leonid Perovskite-like Mn2 O3: a path to new manganites Angewandte Chemie. International Edition 52(5) (2013) 1494-1498 Space group: R -3 :H Cell volume: 2369.53 Cell parameters: 10.3043; 10.3043; 25.7688; 90; 90; 120; |
| COD ID: 1515192 | |
| CIF file | Formula: - C8 H10 N12 O Zn - Comments: Qin, Jun-Sheng; Du, Dong-Ying; Li, Wen-Liang; Zhang, Jing-Ping; Li, Shun-Li; Su, Zhong-Min; Wang, Xin-Long; Xu, Qiang; Shao, Kui-Zhan; Lan, Ya-Qian N-rich zeolite-like metal‒organic framework with sodalite topology: high CO2 uptake, selective gas adsorption and efficient drug delivery Chemical Science 3(6) (2012) 2114 Space group: R -3 :H Cell volume: 7241.8 Cell parameters: 23.862; 23.862; 14.686; 90; 90; 120; |
| COD ID: 1515258 | |
| CIF file | Formula: - C169.5 H273 Mn7 N18 O37.5 - Comments: Hoeke, Veronika; Gieb, Klaus; Müller, Paul; Ungur, Liviu; Chibotaru, Liviu F.; Heidemeier, Maik; Krickemeyer, Erich; Stammler, Anja; Bögge, Hartmut; Schröder, Christian; Schnack, Jürgen; Glaser, Thorsten Hysteresis in the ground and excited spin state up to 10 T of a [MnIII6MnIII]3+ triplesalen single-molecule magnet Chemical Science 3(9) (2012) 2868 Space group: R -3 :H Cell volume: 28300 Cell parameters: 32.152; 32.152; 31.611; 90; 90; 120; |
| COD ID: 1515519 | |
| CIF file | Formula: - C104 H70 - Comments: Xia, Hai; Liu, Danqing; Song, Kesheng; Miao, Qian Vapochromic and semiconducting solids of a bifunctional hydrocarbon Chemical Science 2(12) (2011) 2402 Space group: R -3 :H Cell volume: 5569.7 Cell parameters: 22.054; 22.054; 13.223; 90; 90; 120; |
| COD ID: 1515563 | |
| CIF file | Formula: - C105 H138 N3 Na Nb O9 P - Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166 Space group: R -3 :H Cell volume: 14142 Cell parameters: 17.736; 17.736; 51.913; 90; 90; 120; |
| COD ID: 1515586 | |
| CIF file | Formula: - C45 H62 Li N3 O3 Ti - Comments: Silvia, Jared S.; Cummins, Christopher C. Binding, release, and functionalization of CO2 at a nucleophilic oxo anion complex of titanium Chemical Science 2(8) (2011) 1474 Space group: R -3 :H Cell volume: 19407.2 Cell parameters: 30.849; 30.849; 23.5478; 90; 90; 120; |
| COD ID: 1515639 | |
| CIF file | Formula: - C132 H126 In8 N84 O39.67 - Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695 Space group: R -3 :H Cell volume: 13111.9 Cell parameters: 28.1055; 28.1055; 19.1669; 90; 90; 120; |
| COD ID: 1515770 | |
| CIF file | Formula: - C21 H34 B Cl3 Ga2 N6 S3 - Comments: Yurkerwich, Kevin; Buccella, Daniela; Melnick, Jonathan G.; Parkin, Gerard Tris(2-mercapto-1-tert-butylimidazolyl)hydroborato gallium derivatives: synthesis of di- and trigallium compounds in a sulfur-rich coordination environment Chemical Science 1(2) (2010) 210 Space group: R -3 :H Cell volume: 4552.4 Cell parameters: 15.7834; 15.7834; 21.1015; 90; 90; 120; |
| COD ID: 1516564 | |
| CIF file | Formula: - C20 H15 F5 N2 O3 - Comments: Jin, Li-Mei; Lu, Hongjian; Cui, Yuan; Lizardi, Christopher L.; Arzua, Thiago N.; Wojtas, Lukasz; Cui, Xin; Zhang, X. Peter Selective Radical Amination of Aldehydic C(sp(2))-H Bonds with Fluoroaryl Azides via Co(II)-Based Metalloradical Catalysis: Synthesis of N-Fluoroaryl Amides from Aldehydes under Neutral and Nonoxidative Conditions. Chemical science (Royal Society of Chemistry : 2010) 5(6) (2014) 2422-2427 Space group: R -3 :H Cell volume: 9024.5 Cell parameters: 24.8585; 24.8585; 16.8633; 90; 90; 120; |
| COD ID: 1516842 | |
| CIF file | Formula: - C90 H72 Cl6 Cu3 N18 O13.5 - Comments: Kuldeep Mahiya; Pavan Mathur Morphology dependant oxidation of aromatic alcohols by new symmetrical copper(II) metallatriangles formed by self-assembly of a shared bis-benzimidazolyl diamide ligand Inorganica Chimica Acta 399 (2013) 36-44 Space group: R -3 :H Cell volume: 32092.7 Cell parameters: 27.3168; 27.3168; 49.6611; 90; 90; 120; |
| COD ID: 1517451 | |
| CIF file | Formula: - C16 H15.33 N O4.17 S - Comments: Takesue, Takuya; Fujita, Morifumi; Sugimura, Takashi; Akutsu, Hiroki A Series of Two Oxidation Reactions of ortho-Alkenylbenzamide with Hypervalent Iodine(III): A Concise Entry into (3R,4R)-4-Hydroxymellein and (3R,4R)-4-Hydroxy-6-methoxymellein. Organic letters 16(17) (2014) 4634 Space group: R -3 :H Cell volume: 6826.6 Cell parameters: 27.829; 27.829; 10.1784; 90; 90; 120; |
| COD ID: 1517465 | |
| CIF file | Formula: - C4.35 H Fe O3.7 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 4021.44 Cell parameters: 26.0349; 26.0349; 6.85076; 90; 90; 120; |
| COD ID: 1517466 | |
| CIF file | Formula: - C4.62 H Co O4.25 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3976.4 Cell parameters: 25.8977; 25.8977; 6.846; 90; 90; 120; |
| COD ID: 1517467 | |
| CIF file | Formula: - C4.34 H Cu O3.68 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3625.81 Cell parameters: 25.8582; 25.8582; 6.26149; 90; 90; 120; |
| COD ID: 1517468 | |
| CIF file | Formula: - C4.54 H Mn O4.07 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 4227.9 Cell parameters: 26.3262; 26.3262; 7.044; 90; 90; 120; |
| COD ID: 1517469 | |
| CIF file | Formula: - C4.53 H O4.07 Zn - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3953.8 Cell parameters: 25.914; 25.914; 6.7986; 90; 90; 120; |
| COD ID: 1517470 | |
| CIF file | Formula: - C4 H Co O3 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3984.3 Cell parameters: 25.9067; 25.9067; 6.8548; 90; 90; 120; |
| COD ID: 1517471 | |
| CIF file | Formula: - C4 H Cu O3 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3627.84 Cell parameters: 25.8733; 25.8733; 6.25768; 90; 90; 120; |
| COD ID: 1517472 | |
| CIF file | Formula: - C4 H Fe O3 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 4041.3 Cell parameters: 26.0983; 26.0983; 6.85119; 90; 90; 120; |
| COD ID: 1517473 | |
| CIF file | Formula: - C4 H Mn O3 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 4232.4 Cell parameters: 26.3331; 26.3331; 7.0477; 90; 90; 120; |
| COD ID: 1517474 | |
| CIF file | Formula: - C4 H O3 Zn - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3957.1 Cell parameters: 25.9292; 25.9292; 6.7962; 90; 90; 120; |
| COD ID: 1517475 | |
| CIF file | Formula: - C4.82 H Mg O4.65 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3982.7 Cell parameters: 25.8728; 25.8728; 6.87004; 90; 90; 120; |
| COD ID: 1517476 | |
| CIF file | Formula: - C5.26 H Fe O5.53 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 4016.8 Cell parameters: 26.001; 26.001; 6.86071; 90; 90; 120; |
| COD ID: 1517477 | |
| CIF file | Formula: - C5.5 H Co O6.01 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3970.5 Cell parameters: 25.8735; 25.8735; 6.8486; 90; 90; 120; |
| COD ID: 1517478 | |
| CIF file | Formula: - C5.29 H O5.57 Zn - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3939.4 Cell parameters: 25.8504; 25.8504; 6.8072; 90; 90; 120; |
| COD ID: 1517479 | |
| CIF file | Formula: - C5.14 Cu O5.27 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3646.77 Cell parameters: 25.89776; 25.89776; 6.27846; 90; 90; 120; |
| COD ID: 1517480 | |
| CIF file | Formula: - C10.94 H2 Co2 O11.88 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3986.5 Cell parameters: 25.994; 25.994; 6.8127; 90; 90; 120; |
| COD ID: 1517481 | |
| CIF file | Formula: - C4.77 H Fe O4.54 - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 4052.2 Cell parameters: 26.0818; 26.0818; 6.8783; 90; 90; 120; |
| COD ID: 1517482 | |
| CIF file | Formula: - C4.62 H O4.25 Zn - Comments: Queen, Wendy L.; Hudson, Matthew R.; Bloch, Eric D.; Mason, Jarad A.; Gonzalez, Miguel I.; Lee, Jason S.; Gygi, David; Howe, Joshua D.; Lee, Kyuho; Darwish, Tamim A.; James, Michael; Peterson, Vanessa K.; Teat, Simon J.; Smit, Berend; Neaton, Jeffrey B.; Long, Jeffrey R.; Brown, Craig M. Comprehensive study of carbon dioxide adsorption in the metal‒organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Cu, Zn) Chem. Sci. 5(12) (2014) 4569 Space group: R -3 :H Cell volume: 3958.6 Cell parameters: 25.887; 25.887; 6.821; 90; 90; 120; |
| COD ID: 1517795 | |
| CIF file | Formula: - C2 Ca Mg O6 - Comments: Reeder, R.J.; Wenk, H.R. Structure refinement of some thermally disordered dolomites American Mineralogist 68 (1983) 769-776 Space group: R -3 :H Cell volume: 320.2 Cell parameters: 4.805; 4.805; 16.015; 90; 90; 120; |
| COD ID: 1517796 | |
| CIF file | Formula: - C2 Ca Mg O6 - Comments: Effenberger, H.; Kirfel, A.; Will, G. Untersuchungen zur Elektronendichteverteilung im Dolomit Ca Mg (C O3)2 TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-) 31 (1983) 151-164 Space group: R -3 :H Cell volume: 320.76 Cell parameters: 4.808; 4.808; 16.022; 90; 90; 120; |
| COD ID: 1517797 | |
| CIF file | Formula: - C2 Ca Mg O6 - Comments: Wasastjerna, J.A. Crystal structure of dolomite Societas Scientiarum Fennica. Commentationes Physicomathematicae II 2 (1925) 1-14 Space group: R -3 :H Cell volume: 315.998 Cell parameters: 4.795; 4.795; 15.87; 90; 90; 120; |
| COD ID: 1518520 | |
| CIF file | Formula: - C168 H168 Au8 O46 P8 Si W12 - Comments: Yoshida, Takuya; Yasuda, Yuta; Nagashima, Eri; Arai, Hidekazu; Matsunaga, Satoshi; Nomiya, Kenji Various Oxygen-Centered Phosphanegold(I) Cluster Cations Formed by Polyoxometalate (POM)-Mediated Clusterization: Effects of POMs and Phosphanes Inorganics 2(4) (2014) 660 Space group: R -3 :H Cell volume: 13338 Cell parameters: 20.478; 20.478; 36.726; 90; 90; 120; |
| COD ID: 1518521 | |
| CIF file | Formula: - C168 H168 Au8 Mo12 O46 P8 Si - Comments: Yoshida, Takuya; Yasuda, Yuta; Nagashima, Eri; Arai, Hidekazu; Matsunaga, Satoshi; Nomiya, Kenji Various Oxygen-Centered Phosphanegold(I) Cluster Cations Formed by Polyoxometalate (POM)-Mediated Clusterization: Effects of POMs and Phosphanes Inorganics 2(4) (2014) 660 Space group: R -3 :H Cell volume: 13195.1 Cell parameters: 20.3813; 20.3813; 36.679; 90; 90; 120; |
| COD ID: 1518533 | |
| CIF file | Formula: - C90 H72 Ag12 F18 N6 O12 S6 - Comments: Xu, Qing-Qing; Dong, Xi-Yan; Huang, Ren-Wu; Li, Bo; Zang, Shuang-Quan; Mak, Thomas C. W. A thermochromic silver nanocluster exhibiting dual emission character. Nanoscale 7(5) (2015) 1650-1654 Space group: R -3 :H Cell volume: 8221.9 Cell parameters: 23.9571; 23.9571; 16.5415; 90; 90; 120; |
| COD ID: 1518637 | |
| CIF file | Formula: - C27 H24 B3 N3 O12 - Comments: Li, Gang; Xiong, Wei-Wei; Gu, Pei-Yang; Cao, Jun; Zhu, Jia; Ganguly, Rakesh; Li, Yongxin; Grimsdale, Andrew C.; Zhang, Qichun 1,5,9-Triaza-2,6,10-triphenylboracoronene: BN-Embedded Analogue of Coronene. Organic letters 17(3) (2015) 560-563 Space group: R -3 :H Cell volume: 4363.46 Cell parameters: 19.9798; 19.9798; 12.6217; 90; 90; 120; |
| COD ID: 1518741 | |
| CIF file | Formula: - C30 H42 As3 Cl3 S6 - Comments: Collins, Mary S.; Choi, Robert Y.; Zakharov, Lev N.; Watson, Lori A.; Hay, Benjamin P.; Johnson, Darren W. Self-assembled trinuclear arsenic and antimony macrobicycles Chem. Sci. 6(4) (2015) 2444 Space group: R -3 :H Cell volume: 5552.4 Cell parameters: 16.413; 16.413; 23.8; 90; 90; 120; |
| COD ID: 1518743 | |
| CIF file | Formula: - C30 H42 Cl3 S6 Sb3 - Comments: Collins, Mary S.; Choi, Robert Y.; Zakharov, Lev N.; Watson, Lori A.; Hay, Benjamin P.; Johnson, Darren W. Self-assembled trinuclear arsenic and antimony macrobicycles Chem. Sci. 6(4) (2015) 2444 Space group: R -3 :H Cell volume: 5616.9 Cell parameters: 16.458; 16.458; 23.9449; 90; 90; 120; |
| COD ID: 1518932 | |
| CIF file | Formula: - C45 H162 Mo60 N22.5 O601.26 Se21.57 W72 - Comments: Korenev, Vladimir S.; Abramov, Pavel A.; Vicent, Cristian; Zhdanov, Artem A.; Tsygankova, Alphiya R.; Sokolov, Maxim N.; Fedin, Vladimir P. Selenate as a novel ligand for keplerate chemistry. New {W72Mo60} keplerates with selenates inside the cavity. Dalton transactions (Cambridge, England : 2003) 44(19) (2015) 8839-8845 Space group: R -3 :H Cell volume: 69627 Cell parameters: 32.8171; 32.8171; 74.653; 90; 90; 120; |
| COD ID: 1518950 | |
| CIF file | Formula: - C42 H42 N2 S4 - Comments: He, Bo; Dai, Jing; Zherebetskyy, Danylo; Chen, Teresa L.; Zhang, Benjamin A.; Teat, Simon J.; Zhang, Qichun; Wang, Linwang; Liu, Yi A divergent route to core- and peripherally functionalized diazacoronenes that act as colorimetric and fluorescence proton sensors Chem. Sci. 6(5) (2015) 3180 Space group: R -3 :H Cell volume: 8178.6 Cell parameters: 43.2109; 43.2109; 5.0578; 90; 90; 120; |
| COD ID: 1518981 | |
| CIF file | Formula: - C52 H80 Cl2 Cr2 N4 O2 P4 - Comments: Reed J. Eisenhart; Rebecca K. Carlson; Kelsey M. Boyle; Laura Gagliardi; Connie C. Lu Synthesis and redox reactivity of a phosphine-ligated dichromium paddlewheel Inorganica Chimica Acta 424 (2015) 336-344 Space group: R -3 :H Cell volume: 15417.4 Cell parameters: 21.646; 21.646; 37.995; 90; 90; 120; |
| COD ID: 1519317 | |
| CIF file | Formula: - C10 H10 Fe I3 - Comments: Bricklebank, Neil; Gelbrich, Thomas; Hursthouse, Michael B. C10H10FeI3 Crystal Structure Report Archive (2001) 831 Space group: R -3 :H Cell volume: 1053.21 Cell parameters: 8.461; 8.461; 16.988; 90; 90; 120; |
| COD ID: 1519392 | |
| CIF file | Formula: - C36 H82 Cl2 N3 Na O4.5 Si6 Th - Comments: Smiles, Danil E.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Thorium‒ligand multiple bonds via reductive deprotection of a trityl group Chem. Sci. 6(7) (2015) 3891 Space group: R -3 :H Cell volume: 8690 Cell parameters: 18.404; 18.404; 29.626; 90; 90; 120; |
| COD ID: 1519776 | |
| CIF file | Formula: - C144 H96 B3 F78 Fe4 Ga4 O8 - Comments: Aldridge, Simon; Horton, Peter N.; Hursthouse, Michael B. C144H96B3F78Fe4Ga4O8 Crystal Structure Report Archive (2006) 1180 Space group: R -3 :H Cell volume: 25291 Cell parameters: 24.595; 24.595; 48.278; 90; 90; 120; |
| COD ID: 1520808 | |
| CIF file | Formula: - Eu0.0501 La0.1169 O12 P2.833 Pb0.333 Si0.167 Zr2 - Comments: Bakhous, K.; Cherkaoui, F.; Benabad, A.; Dexpert-Ghys, J.; Savariault, J.M.; El Jouhari, N. Structural approach and luminescence properties of La1/6 Pb1/3 Zr2 (P O4)17/6 (Si O4)1/6 : Eu(3+) Journal of Solid State Chemistry 146 (1999) 499-505 Space group: R -3 :H Cell volume: 1534.87 Cell parameters: 8.701; 8.701; 23.41; 90; 90; 120; |
| COD ID: 1520809 | |
| CIF file | Formula: - La0.167 O12 P2.833 Pb0.333 Si0.167 Zr2 - Comments: Bakhous, K.; Cherkaoui, F.; Benabad, A.; Savariault, J.M. New phosphosilicates with Nasicon structure type Materials Research Bulletin 34 (1999) 263-269 Space group: R -3 :H Cell volume: 1534.31 Cell parameters: 8.692; 8.692; 23.45; 90; 90; 120; |
| COD ID: 1521051 | |
| CIF file | Formula: - Mo12 Rb2 Se14 - Comments: Gautier, R.; Picard, S.; Gougeon, P.; Potel, M. Synthesis, crystal and electronic structures, and electrical properties of Rb2 Mo12 Se14 containing trioctahedral Mo12 clusters Materials Research Bulletin 34 (1999) 93-101 Space group: R -3 :H Cell volume: 1942.85 Cell parameters: 9.538; 9.538; 24.66; 90; 90; 120; |
| COD ID: 1521121 | |
| CIF file | Formula: - O12 Re Tm6 - Comments: Hartmann, T.; Ehrenberg, H.; Miehe, G.; Wltschek, G.; Fuess, H. Preparation and characterization of rare earth rhenium oxides Ln6 Re O12, Ln = Ho, Er, Tm, Yb, Lu Journal of Solid State Chemistry 148 (1999) 220-223 Space group: R -3 :H Cell volume: 749.613 Cell parameters: 9.6953; 9.6953; 9.2084; 90; 90; 120; |
| COD ID: 1521374 | |
| CIF file | Formula: - Mg O3 Si - Comments: Karki, B.B.; Duan, W.; da Silva, C.R.S.; Wentzcovitch, R.M. Ab initio structure of Mg Si O3 ilmenite at high pressure American Mineralogist 85 (2000) 317-320 Space group: R -3 :H Cell volume: 252.751 Cell parameters: 4.686; 4.686; 13.291; 90; 90; 120; |
| COD ID: 1521515 | |
| CIF file | Formula: - La0.333 O12 P3 Ti2 - Comments: Lightfoot, P.; Jorgensen, J.D.; Woodcock, D.A.; Short, S. Low thermal expansion materials: a comparison of the structural behaviour of La0.33 Ti2 (P O4)3, Sr0.5 Ti2 (P O4)3 and Na Ti2 (P O4)3 International Journal of Inorganic Materials 1 (1999) 53-60 Space group: R -3 :H Cell volume: 1324.18 Cell parameters: 8.26988; 8.26988; 22.3573; 90; 90; 120; |
| COD ID: 1521631 | |
| CIF file | Formula: - Cu0.5 Mn0.25 O12 P3 Zr2 - Comments: Mouline, A.; Alami, M.; Parent, C.; Brochu, R.; Olazcuaga, R.; le Flem, G. Structural and luminescent properties of a Nasicon-type phosphate Cu(I)0.5 Mn(II)0.25 Zr2 (P O4)3 Journal of Solid State Chemistry 152 (2000) 453-459 Space group: R -3 :H Cell volume: 1504.43 Cell parameters: 8.8352; 8.8352; 22.254; 90; 90; 120; |
| COD ID: 1521670 | |
| CIF file | Formula: - Ga In O4 Zn - Comments: Nespolo, M.; Sato, A.; Osawa, T.; Ohashi, H. Synthesis, crystal structure and charge distribution of In Ga Zn O4. X-ray diffraction of 20 kb single crystal and 50 kb twin by reticular merohedry Crystal Research and Technology 35 (2000) 151-165 Space group: R -3 :H Cell volume: 246.01 Cell parameters: 3.299; 3.299; 26.101; 90; 90; 120; |
| COD ID: 1521832 | |
| CIF file | Formula: - Cl4 Co Cs D18 N6 O8 - Comments: Reynolds, P.A.; Henning, R.W.; Schultz, A.J. Orientational disordering in Cs Co (N D3)6 (Cl O4)2 Cl2 crystals studied by single crystal neutron diffraction between 20 and 290 K Journal of Solid State Chemistry 149 (2000) 60-67 Space group: R -3 :H Cell volume: 1207.38 Cell parameters: 7.21; 7.21; 26.8189; 90; 90; 120; |
| COD ID: 1521849 | |
| CIF file | Formula: - Fe5 O12 Y3 - Comments: Rodic, D.; Mitric, M.; Tellgren, R.; Rundloef, H.; Kremenovic, A. True magnetic structure of the ferrimagnetic garnet Y3 Fe5 O12 and magnetic moments of iron ions Journal of Magnetism and Magnetic Materials 191 (1999) 137-145 Space group: R -3 :H Cell volume: 2830.02 Cell parameters: 17.484; 17.484; 10.69; 90; 90; 120; |
| COD ID: 1522047 | |
| CIF file | Formula: - Nb10.132 O19 Si0.867 Sr0.926 - Comments: Tortelier, J.; Emge, T.J.; Veith, G.; Greenblatt, M. Synthesis, crystal structure, and physical properties of Sr0.93 (Six Nb1-x) Nb10 O19 (x=0.87) Journal of Solid State Chemistry 152 (2000) 540-545 Space group: R -3 :H Cell volume: 2251.25 Cell parameters: 7.843; 7.843; 42.26; 90; 90; 120; |
| COD ID: 1522053 | |
| CIF file | Formula: - H6 Hf Na2 O6 - Comments: Troyanov, S.I.; Kostrikin, A.V.; Lin'ko, I.V.; Ezhov, A.I.; Zaitsev, B.E.; Spiridonov, F.M. Crystal structure of hydroxohafnates Na2 Hf (O H)6 and K2 Hf (O H)6 Kristallografiya 44 (1999) 1054-1058 Space group: R -3 :H Cell volume: 443.016 Cell parameters: 6.001; 6.001; 14.205; 90; 90; 120; |
| COD ID: 1522135 | |
| CIF file | Formula: - Ca2 La2 Mn O7 - Comments: Wang, Y.-X.; Lin, J.-H.; Du, Y.; Loong, C.-K.; Qin, R.-W.; Han, B. A hexagonal perovskite intergrowth compound: La2 Ca2 Mn O7 Angew. Chem. Int. ed. 39 (2000) 2730-2732 Space group: R -3 :H Cell volume: 473.942 Cell parameters: 5.62176; 5.62176; 17.31609; 90; 90; 120; |
| COD ID: 1522209 | |
| CIF file | Formula: - Ge Na2 O6 Te - Comments: Woodward, P.M.; Sleight, A.W.; Du, L.-S.; Grey, C.P. Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6 Journal of Solid State Chemistry 147 (1999) 99-116 Space group: R -3 :H Cell volume: 359.648 Cell parameters: 5.10118; 5.10118; 15.959; 90; 90; 120; |
| COD ID: 1522211 | |
| CIF file | Formula: - Na2 O6 Te Ti - Comments: Woodward, P.M.; Grey, C.P.; Sleight, A.W.; Du, L.-S. Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6 Journal of Solid State Chemistry 147 (1999) 99-116 Space group: R -3 :H Cell volume: 373.745 Cell parameters: 5.2201; 5.2201; 15.8375; 90; 90; 120; |
| COD ID: 1522650 | |
| CIF file | Formula: - Pt4 Yb3 - Comments: Palenzona, A. The crystal structure and lattice constants of R3 Pt4 compounds Journal of the Less-Common Metals 53 (1977) 133-136 Space group: R -3 :H Cell volume: 809.716 Cell parameters: 12.888; 12.888; 5.629; 90; 90; 120; |
| COD ID: 1522816 | |
| CIF file | Formula: - Ni4 Ti3 - Comments: Saburi, T.; Nenno, S.; Fukuda, T. Crystal structure and morphology of the metastable X-phase in shape memory Ti-Ni alloys Journal of the Less-Common Metals 125 (1986) 157-166 Space group: R -3 :H Cell volume: 555.483 Cell parameters: 11.24; 11.24; 5.077; 90; 90; 120; |
| COD ID: 1524030 | |
| CIF file | Formula: - Co22.99 Cr15.01 W15 - Comments: Barrows, R.G.; Newkirk, J.B. Phase equilibria in the Co-Cr-W system with special emphasis on the R-phase Metallography 5 (1972) 515-541 Space group: R -3 :H Cell volume: 1972.73 Cell parameters: 10.8819; 10.8819; 19.2366; 90; 90; 120; |
| COD ID: 1524056 | |
| CIF file | Formula: - O12 W Y6 - Comments: Beaury, O.; Faucher, M.; Caro, P. Crystal structure and fluorescence spectrum of 3(Y2 O3), W O3:Eu((3+)) Materials Research Bulletin 13 (1978) 175-185 Space group: R -3 :H Cell volume: 768.429 Cell parameters: 9.751; 9.751; 9.332; 90; 90; 120; |
| COD ID: 1524589 | |
| CIF file | Formula: - Eu3 Pd2 - Comments: Iandelli, A.; Palenzona, A. The Crystal structure of the intermetallic compound Eu3 Pd2 Journal of the Less-Common Metals 40 (1975) 263-264 Space group: R -3 :H Cell volume: 1275.36 Cell parameters: 9.204; 9.204; 17.384; 90; 90; 120; |
| COD ID: 1525068 | |
| CIF file | Formula: - Ho2.64 Mo18 S24 - Comments: Pena, O.; Horyn, R.; Potel, M.; Padiou, J.; Sergent, M. Crystal structure and normal state physical properties of Hox Mo6 S8 (0.88<= x<= 1.0) single crystals Journal of the Less-Common Metals 105 (1985) 105-117 Space group: R -3 :H Cell volume: 807.098 Cell parameters: 9.0884; 9.0884; 11.2829; 90; 90; 120; |
| COD ID: 1525155 | |
| CIF file | Formula: - O12 Y4 Zr3 - Comments: Ray, S.P.; Stubican, V.S.; Cox, D.E. Neutron diffraction investigation of Zr3 Y4 O12 Materials Research Bulletin 15 (1980) 1419-1423 Space group: R -3 :H Cell volume: 746.194 Cell parameters: 9.729; 9.729; 9.103; 90; 90; 120; |
| COD ID: 1525280 | |
| CIF file | Formula: - Ca Cr F6 - Comments: Siebert, G.; Hoppe, R. Ternaere Fluoride mit vierwertigem Chrom: M(II) Cr F6 mit M(II)= Ba, Sr, Ca, Mg, Zn, Cd, Hg, Ni Zeitschrift fuer Anorganische und Allgemeine Chemie 391 (1972) 126-136 Space group: R -3 :H Cell volume: 348.988 Cell parameters: 5.336; 5.336; 14.153; 90; 90; 120; |
| COD ID: 1525281 | |
| CIF file | Formula: - Cr F6 Mg - Comments: Siebert, G.; Hoppe, R. Ternaere Fluoride mit vierwertigem Chrom: M(II) Cr F6 mit M(II)= Ba, Sr, Ca, Mg, Zn, Cd, Hg, Ni Zeitschrift fuer Anorganische und Allgemeine Chemie 391 (1972) 126-136 Space group: R -3 :H Cell volume: 295.006 Cell parameters: 5.091; 5.091; 13.143; 90; 90; 120; |
| COD ID: 1525283 | |
| CIF file | Formula: - Cd Cr F6 - Comments: Siebert, G.; Hoppe, R. Ternaere Fluoride mit vierwertigem Chrom: M(II) Cr F6 mit M(II)= Ba, Sr, Ca, Mg, Zn, Cd, Hg, Ni Zeitschrift fuer Anorganische und Allgemeine Chemie 391 (1972) 126-136 Space group: R -3 :H Cell volume: 322.037 Cell parameters: 5.14; 5.14; 14.075; 90; 90; 120; |
| COD ID: 1525284 | |
| CIF file | Formula: - Cr F6 Hg - Comments: Siebert, G.; Hoppe, R. Ternaere Fluoride mit vierwertigem Chrom: M(II) Cr F6 mit M(II)= Ba, Sr, Ca, Mg, Zn, Cd, Hg, Ni Zeitschrift fuer Anorganische und Allgemeine Chemie 391 (1972) 126-136 Space group: R -3 :H Cell volume: 324.862 Cell parameters: 5.128; 5.128; 14.265; 90; 90; 120; |
| COD ID: 1525399 | |
| CIF file | Formula: - Li8 O6 Pb - Comments: Troemel, M.; Maetz, J.; Muellner, M. Die Kristallstruktur von Li8 Pb O6 Zeitschrift fuer Anorganische und Allgemeine Chemie 449 (1979) 102-104 Space group: R -3 :H Cell volume: 415.891 Cell parameters: 5.543; 5.543; 15.63; 90; 90; 120; |
| COD ID: 1525900 | |
| CIF file | Formula: - O12 W Y6 - Comments: Diot, N.; Benard-Rocherulle, P.; Marchand, R. X-ray powder diffraction data and Rietveld refinement for Ln6 W O12(Ln = Y, Ho) Powder Diffraction 15 (2000) 220-226 Space group: R -3 :H Cell volume: 766.489 Cell parameters: 9.7505; 9.7505; 9.3094; 90; 90; 120; |
| COD ID: 1525901 | |
| CIF file | Formula: - Ho6 O12 W - Comments: Diot, N.; Benard-Rocherulle, P.; Marchand, R. X-ray powder diffraction data and Rietveld refinement for Ln6 W O12(Ln = Y, Ho) Powder Diffraction 15 (2000) 220-226 Space group: R -3 :H Cell volume: 768.112 Cell parameters: 9.7583; 9.7583; 9.3142; 90; 90; 120; |
| COD ID: 1525972 | |
| CIF file | Formula: - Ge5 O25 P6 - Comments: Mayer, H.; Voellenkle, H. Die Kristallstruktur von Ge5 O (P O4)6 Monatshefte fuer Chemie (-108,1977) 103 (1972) 1560-1571 Space group: R -3 :H Cell volume: 1376.37 Cell parameters: 7.994; 7.994; 24.87; 90; 90; 120; |
| COD ID: 1526062 | |
| CIF file | Formula: - Mn0.5 O12 P3 Zr2 - Comments: Mouline, A.; Alami, M.; Brochu, R.; Olazcuaga, R.; Parent, C.; le Flem, G. The structure and luminescent properties of Mn0.5 Zr2 (P O4)3 Materials Research Bulletin 35 (2000) 899-908 Space group: R -3 :H Cell volume: 1478.68 Cell parameters: 8.85; 8.85; 21.8; 90; 90; 120; |
| COD ID: 1526260 | |
| CIF file | Formula: - Fe1.2 O3 Ti0.8 - Comments: Harrison, R.J.; Redfern, S.A.T.; Smith, R.I. In-situ study of the R3- to R3-c phase transition in the ilmenite -hematite solid solution using time-of-flight neutron powder diffraction American Mineralogist 85 (2000) 194-205 Space group: R -3 :H Cell volume: 312.378 Cell parameters: 5.0786; 5.0786; 13.985; 90; 90; 120; |
| COD ID: 1526269 | |
| CIF file | Formula: - Fe1.1 O3 Ti0.9 - Comments: Harrison, R.J.; Redfern, S.A.T.; Smith, R.I. In-situ study of the R3- to R3-c phase transition in the ilmenite -hematite solid solution using time-of-flight neutron powder diffraction American Mineralogist 85 (2000) 194-205 Space group: R -3 :H Cell volume: 313.969 Cell parameters: 5.0828; 5.0828; 14.033; 90; 90; 120; |
| COD ID: 1526274 | |
| CIF file | Formula: - Fe O3 Ti - Comments: Harrison, R.J.; Redfern, S.A.T.; Smith, R.I. In-situ study of the R3- to R3-c phase transition in the ilmenite -hematite solid solution using time-of-flight neutron powder diffraction American Mineralogist 85 (2000) 194-205 Space group: R -3 :H Cell volume: 327.509 Cell parameters: 5.15116; 5.15116; 14.2522; 90; 90; 120; |
| COD ID: 1526467 | |
| CIF file | Formula: - H6 Na2 O6 Sn - Comments: Jacobs, H.; Stahl, R. Neubestimmung der Kristallstrukturen der Hexahydroxometallate Na2 Sn (O H)6, K2 Sn (O H)6 und K2 Pb (O H)6 Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1863-1866 Space group: R -3 :H Cell volume: 435.235 Cell parameters: 5.951; 5.951; 14.191; 90; 90; 120; |
| COD ID: 1526469 | |
| CIF file | Formula: - H6 K2 O6 Sn - Comments: Jacobs, H.; Stahl, R. Neubestimmung der Kristallstrukturen der Hexahydroxometallate Na2 Sn (O H)6, K2 Sn (O H)6 und K2 Pb (O H)6 Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1863-1866 Space group: R -3 :H Cell volume: 474.755 Cell parameters: 6.541; 6.541; 12.813; 90; 90; 120; |
| COD ID: 1526619 | |
| CIF file | Formula: - In12 K2 Se19 - Comments: Kienle, L.; Simon, A. Microdomains and diffuse scattering in K2 In12 Se19 Journal of Solid State Chemistry 161 (2001) 385-395 Space group: R -3 :H Cell volume: 5847.56 Cell parameters: 13.852; 13.852; 35.19; 90; 90; 120; |
| COD ID: 1526681 | |
| CIF file | Formula: - C6 H18 Co N12 Os S6 - Comments: Staehler, O.; Preetz, W. Darstellung, Kristallstruktur, Schwingungsspektren und Normalkoordinatenanalyse von (Co (N H3)6) (Os (S C N)6) Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 2077-2080 Space group: R -3 :H Cell volume: 1567.16 Cell parameters: 12.368; 12.368; 11.83; 90; 90; 120; |
| COD ID: 1526720 | |
| CIF file | Formula: - La4 O12 Ti3 - Comments: Konstantinov, P.; Krezhov, K.; Svab, E.; Torok, G.; Meszaros, G. Neutron powder diffraction refinement of the crystal structure of La4 Ti3 O12 Physik (Berlin) 276 (2000) 260-261 Space group: R -3 :H Cell volume: 702.749 Cell parameters: 5.561; 5.561; 26.24; 90; 90; 120; |
| COD ID: 1526779 | |
| CIF file | Formula: - Ba2 La4 O18 Ti5 - Comments: Teneze, N.; Mercurio, D.; Frit, B.; Trolliard, G. Cation-deficient perovskite-related compounds (Ba, La)n Tin-1 O3n (n=4,5 and 6): a Rietveld refinement from neutron powder diffraction data Materials Research Bulletin 35 (2000) 1603-1614 Space group: R -3 :H Cell volume: 1107.42 Cell parameters: 5.5809; 5.5809; 41.05579; 90; 90; 120; |
| COD ID: 1526788 | |
| CIF file | Formula: - Bi Na O3 - Comments: Kumada, N.; Kinomura, N.; Sleight, A.W. Neutron powder diffraction refinement of ilmenite-type bismuth oxides: A Bi O3 (A = Na, Ag) Materials Research Bulletin 35 (2000) 2397-2402 Space group: R -3 :H Cell volume: 429.166 Cell parameters: 5.5672; 5.5672; 15.989; 90; 90; 120; |
| COD ID: 1526865 | |
| CIF file | Formula: - I12 La6 Na Os - Comments: Uma, S.; Corbett, J.D. Derivatization of the rhombohedral rare-earth-metal (R) cluster halides R7 (Z) X12: the new Na La6 (Os) I12 Journal of Solid State Chemistry 161 (2001) 161-165 Space group: R -3 :H Cell volume: 2543.56 Cell parameters: 16.214; 16.214; 11.172; 90; 90; 120; |
| COD ID: 1527062 | |
| CIF file | Formula: - Cr2 Se3 - Comments: Adachi, Y.; Funahashi, S.; Kaneko, T.; Ohashi, M.; Yuzuri, M.; Yamaguchi, Y.; Morii, Y. Magnetic structure of rhombohedral Cr2 Se3 Journal of the Physical Society of Japan 63 (1994) 1548-1559 Space group: R -3 :H Cell volume: 584.567 Cell parameters: 6.25; 6.25; 17.28; 90; 90; 120; |
| COD ID: 1527081 | |
| CIF file | Formula: - P2 Pd15 - Comments: Andersson, Y. The crystal structure of Pd15 P2 Acta Chemica Scandinavica, Series A: (28,1974-) 31 (1977) 354-358 Space group: R -3 :H Cell volume: 747.351 Cell parameters: 7.1067; 7.1067; 17.0867; 90; 90; 120; |
| COD ID: 1527496 | |
| CIF file | Formula: - Bi F6 Li - Comments: Hebecker, C. Ueber Alkalihexafluorobismutate(V) Zeitschrift fuer Anorganische und Allgemeine Chemie 376 (1970) 236-243 Space group: R -3 :H Cell volume: 325.219 Cell parameters: 5.181; 5.181; 13.99; 90; 90; 120; |
| COD ID: 1527497 | |
| CIF file | Formula: - Bi F6 Na - Comments: Hebecker, C. Ueber Alkalihexafluorobismutate(V) Zeitschrift fuer Anorganische und Allgemeine Chemie 376 (1970) 236-243 Space group: R -3 :H Cell volume: 392.543 Cell parameters: 5.468; 5.468; 15.16; 90; 90; 120; |
| COD ID: 1527498 | |
| CIF file | Formula: - Bi F6 Rb - Comments: Hebecker, C. Ueber Alkalihexafluorobismutate(V) Zeitschrift fuer Anorganische und Allgemeine Chemie 376 (1970) 236-243 Space group: R -3 :H Cell volume: 406.337 Cell parameters: 7.712; 7.712; 7.889; 90; 90; 120; |
| COD ID: 1527499 | |
| CIF file | Formula: - Bi Cs F6 - Comments: Hebecker, C. Ueber Alkalihexafluorobismutate(V) Zeitschrift fuer Anorganische und Allgemeine Chemie 376 (1970) 236-243 Space group: R -3 :H Cell volume: 450.601 Cell parameters: 7.93; 7.93; 8.274; 90; 90; 120; |
| COD ID: 1527518 | |
| CIF file | Formula: - F6 Mg Pb - Comments: Homann, R.; Hoppe, R. Neue Hexafluoroplumbate(IV) Mg Pb F6, Zn Pb F6, Cd Pb F6, Hg Pb F6 und Ni Pb F6 Zeitschrift fuer Anorganische und Allgemeine Chemie 368 (1969) 271-278 Space group: R -3 :H Cell volume: 333.223 Cell parameters: 5.25; 5.25; 13.96; 90; 90; 120; |
| COD ID: 1527519 | |
| CIF file | Formula: - F6 Pb Zn - Comments: Homann, R.; Hoppe, R. Neue Hexafluoroplumbate(IV) Mg Pb F6, Zn Pb F6, Cd Pb F6, Hg Pb F6 und Ni Pb F6 Zeitschrift fuer Anorganische und Allgemeine Chemie 368 (1969) 271-278 Space group: R -3 :H Cell volume: 332.631 Cell parameters: 5.21; 5.21; 14.15; 90; 90; 120; |
| COD ID: 1527520 | |
| CIF file | Formula: - F6 Ni Pb - Comments: Homann, R.; Hoppe, R. Neue Hexafluoroplumbate(IV) Mg Pb F6, Zn Pb F6, Cd Pb F6, Hg Pb F6 und Ni Pb F6 Zeitschrift fuer Anorganische und Allgemeine Chemie 368 (1969) 271-278 Space group: R -3 :H Cell volume: 329.105 Cell parameters: 5.21; 5.21; 14; 90; 90; 120; |
| COD ID: 1527812 | |
| CIF file | Formula: - Nb1.5 O12 Sc5.5 - Comments: Michel, D.; Perez y Jorba, M.; Kahn, A. Etude structurale des phases Sc5.5 Nb1.5 O12 et Sc5.5 Ta1.5 O12. Ordre des cations dans les composes (A, B)7 O12 de type Y6 U O12 Materials Research Bulletin 11 (1976) 857-866 Space group: R -3 :H Cell volume: 645.334 Cell parameters: 9.258; 9.258; 8.694; 90; 90; 120; |
| COD ID: 1527894 | |
| CIF file | Formula: - Cd F6 Ti - Comments: Odenthal, R.H.; Hoppe, R. Ueber hexafluorotitanate(IV): M Ti F6 mit M=Zn, Cd, Mn, Co, Ni Zeitschrift fuer Anorganische und Allgemeine Chemie 384 (1971) 104-110 Space group: R -3 :H Cell volume: 353.055 Cell parameters: 5.36; 5.36; 14.19; 90; 90; 120; |
| COD ID: 1528127 | |
| CIF file | Formula: - O12 Yb4 Zr3 - Comments: Thornber, M.R.; Bevan, D.J.M. Mixed oxides of the type M O2 (fluorite)-M2 O3. IV. Crystal structures of the high- and low-temperature forms of Zr3 Yb4 O12 Journal of Solid State Chemistry 1 (1970) 536-544 Space group: R -3 :H Cell volume: 727.092 Cell parameters: 9.68; 9.68; 8.96; 90; 90; 120; |
| COD ID: 1528146 | |
| CIF file | Formula: - Li8 O6 Sn - Comments: Troemel, M.; Hauck, J. Die Kristallstruktur von Li8 Sn O6 Zeitschrift fuer Anorganische und Allgemeine Chemie 368 (1969) 248-253 Space group: R -3 :H Cell volume: 394.735 Cell parameters: 5.464; 5.464; 15.267; 90; 90; 120; |
| COD ID: 1528239 | |
| CIF file | Formula: - Ce2 H48 Mg3 N12 O60 - Comments: Zalkin, A.; Forrester, J.D.; Templeton, D.H. Crystal structure of cerium magnesium nitrate hydrate Journal of Chemical Physics 39 (1963) 2881-2891 Space group: R -3 :H Cell volume: 3627.5 Cell parameters: 11.004; 11.004; 34.592; 90; 90; 120; |
| COD ID: 1528392 | |
| CIF file | Formula: - Li1.048 O4 V0.974 Zn0.982 - Comments: Capsoni, D.; Bini, M.; Massarotti, V.; Mustarelli, P.; Belotti, F.; Galinetto, P. Cation distribution in Li Mg V O4 and Li Zn V O4: structural and spectroscopic study J. Phys. Chem. B 110 (2006) 5409-5415 Space group: R -3 :H Cell volume: 1653.49 Cell parameters: 14.1857; 14.1857; 9.4879; 90; 90; 120; |
| COD ID: 1528650 | |
| CIF file | Formula: - C36 H108 K4 O12 Si16 - Comments: Krempner, C.; Chisholm, M.H.; Gallucci, J. The multidentate ligand (Me O Me2 Si)3 Si(-): unusual coordination modes in alkali metal silanides Angew. Chem. Int. ed. 47 (2008) 410-413 Space group: R -3 :H Cell volume: 12840.4 Cell parameters: 15.1755; 15.1755; 64.3817; 90; 90; 120; |
| COD ID: 1528689 | |
| CIF file | Formula: - Mg0.3 Mn0.37 O3 Ti Zn0.333 - Comments: Liferovich, R.P.; Mitchell, R.H. Mn, Mg, and Zn ilmenite group titanates: a reconnaissance Rietveld study Kristallografiya 51 (2006) 417-424 Space group: R -3 :H Cell volume: 315.298 Cell parameters: 5.09227; 5.09227; 14.04; 90; 90; 120; |
| COD ID: 1528690 | |
| CIF file | Formula: - Mg0.46 O3 Ti Zn0.54 - Comments: Liferovich, R.P.; Mitchell, R.H. Mn, Mg, and Zn ilmenite group titanates: a reconnaissance Rietveld study Kristallografiya 51 (2006) 417-424 Space group: R -3 :H Cell volume: 309.54 Cell parameters: 5.06683; 5.06683; 13.9224; 90; 90; 120; |
| COD ID: 1528818 | |
| CIF file | Formula: - Cu6.78 O18.78 V6 - Comments: Rea, J.R.; Kostiner, E. The crystal structure of alpha-copper vanadate Journal of Solid State Chemistry 7 (1973) 17-24 Space group: R -3 :H Cell volume: 1025.14 Cell parameters: 12.857; 12.857; 7.161; 90; 90; 120; |
| COD ID: 1528904 | |
| CIF file | Formula: - F17 Lu3 Sr4 - Comments: Sul'yanova, E.A.; Molchanov, V.N.; Sobolev, B.P.; Sul'yanov, S.N.; Verin, I.A. Nanostructured crystals of the fluorite phases Sr(1-x) R(x) F(2+x) (R = rare-earth elements) and their ordering: II. Crystal structure of the ordered Sr4 Lu3 F17 phase Kristallografiya 54 (2009) 554-562 Space group: R -3 :H Cell volume: 1907.44 Cell parameters: 10.615; 10.615; 19.547; 90; 90; 120; |
| COD ID: 1528944 | |
| CIF file | Formula: - C60 Br13.42 Cl14.58 Ti - Comments: Troyanov, S.I.; Burtsev, A.V.; Kemnitz, E. Synthesis and structure of fullerene halides in the C60-(Ti Cl4 + Br2) system: molecular structures of (C60 Cl5)2, C60 X6, C60 X8, and C60 X24 (X = Cl, Br) Kristallografiya 54 (2009) 268-275 Space group: R -3 :H Cell volume: 4593.1 Cell parameters: 12.82; 12.82; 32.27; 90; 90; 120; |
| COD ID: 1529088 | |
| CIF file | Formula: - C133 H99 Cu5.5 N17 O31 - Comments: Thorp-Greenwood, Flora L.; Ronson, Tanya K.; Hardie, Michaele J. Copper coordination polymers from cavitand ligands: hierarchical spaces from cage and capsule motifs, and other topologies Chem. Sci. 6(10) (2015) 5779 Space group: R -3 :H Cell volume: 39648 Cell parameters: 29.5994; 29.5994; 52.255; 90; 90; 120; |
| COD ID: 1529237 | |
| CIF file | Formula: - C16 H22 N4 O4 Pb S2 - Comments: Golovnev, Nikolay; Molokeev, Maxim; Golovneva, Irina The crystal structure of lead(II) 1,3-diethyl-2-thiobarbiturate Russian Journal of Coordination Chemistry 41(5) (2015) 300 Space group: R -3 :H Cell volume: 4658.9 Cell parameters: 12.9503; 12.9503; 32.0771; 90; 90; 120; |
| COD ID: 1529261 | |
| CIF file | Formula: - C20 H19 N O - Comments: Dange, Nitin S.; Stepherson, Jacob R.; Ayala, Caitlan E.; Fronczek, Frank R.; Kartika, Rendy Cooperative benzylic‒oxyallylic stabilized cations: regioselective construction of α-quaternary centers in ketone-derived compounds Chem. Sci. 6(11) (2015) 6312 Space group: R -3 :H Cell volume: 7612.5 Cell parameters: 25.0795; 25.0795; 13.9752; 90; 90; 120; |
| COD ID: 1529616 | |
| CIF file | Formula: - Fe0.955 Mg0.208 O3 Ti0.833 - Comments: Belokoneva, E.L.; Garanin, V.K.; Simonov, M.A.; Kudryavtseva, G.P.; Belov, N.V. Crystal structure of ilmenite from yakutsk kimberlites Doklady Akademii Nauk SSSR 242 (1978) 330-332 Space group: R -3 :H Cell volume: 309.897 Cell parameters: 5.068; 5.068; 13.932; 90; 90; 120; |
| COD ID: 1529675 | |
| CIF file | Formula: - C6 H24 Co3 Cr N30 O33 - Comments: Bondar, V.I.; Belov, N.V.; Kurkutova, E.N.; Ilyukhin, V.V.; Rau, V.G. The crystal structure of the complex compound (Cr (O C N2 H4)6) (Co (N H3)2 (N O2)4)3 (H2 O)3 Doklady Akademii Nauk SSSR 244 (1979) 358-361 Space group: R -3 :H Cell volume: 7016.86 Cell parameters: 24.78; 24.78; 13.195; 90; 90; 120; |
| COD ID: 1529753 | |
| CIF file | Formula: - F6 H12 Mn O6 Ti - Comments: Chattopadhyay, T.K.; Devreux, F.; Peters, K.; Peters, E.M.; Gmelin, E.; Ghosh, B. Crystal structure and phase transitions in Mn Ti F6 6(H2 0) and Zn Ti F6 6(H2 O) Journal of Physics C 21 (1988) 1321-1334 Space group: R -3 :H Cell volume: 820.922 Cell parameters: 9.708; 9.708; 10.058; 90; 90; 120; |
| COD ID: 1529754 | |
| CIF file | Formula: - F6 H12 O6 Ti Zn - Comments: Chattopadhyay, T.K.; Devreux, F.; Peters, K.; Ghosh, B.; Gmelin, E.; Peters, E M. Crystal structure and phase transitions in Mn Ti F6 6(H2O) and Zn Ti F6 6(H2 O) Journal of Physics C 21 (1988) 1321-1334 Space group: R -3 :H Cell volume: 790.062 Cell parameters: 9.584; 9.584; 9.932; 90; 90; 120; |
| COD ID: 1529801 | |
| CIF file | Formula: - F32 O Pb8 Y6 - Comments: Dib, A.; Aleonard, S. Structure cristalline de Pb8 Y6 F32 O Journal of Solid State Chemistry 64 (1986) 148-161 Space group: R -3 :H Cell volume: 2020.75 Cell parameters: 10.817; 10.817; 19.942; 90; 90; 120; |
| COD ID: 1529820 | |
| CIF file | Formula: - As Li O3 - Comments: Driss, A.; Jouini, T. Structure cristalline d'une nouvelle variete polymorphique de Li As O3 Journal of Solid State Chemistry 78 (1989) 126-129 Space group: R -3 :H Cell volume: 284.481 Cell parameters: 4.808; 4.808; 14.21; 90; 90; 120; |
| COD ID: 1529843 | |
| CIF file | Formula: - Cs F6 Sb - Comments: de Steyn, M.M.V.; English, R.B.; Heyns, A.M. X-ray and Raman studies of single crystals of Cs Sb F6 Journal of Crystallographic and Spectroscopic Research 14 (1984) 505-512 Space group: R -3 :H Cell volume: 446.948 Cell parameters: 7.904; 7.904; 8.261; 90; 90; 120; |
| COD ID: 1529867 | |
| CIF file | Formula: - C66 H60 Cl9 N6 O6 P3 - Comments: Katagiri, Kosuke; Komagawa, Shinsuke; Uchiyama, Masanobu; Yamaguchi, Kentaro; Azumaya, Isao Control of a Chiral Property of a Calix[3]aramide: The Racemization Suppressed by Intramolecular Cyclic Hydrogen Bonds and DMSO-H2O System-Induced Spontaneous Resolution. Organic letters 17(15) (2015) 3650-3653 Space group: R -3 :H Cell volume: 10121 Cell parameters: 17.622; 17.622; 37.634; 90; 90; 120; |
| COD ID: 1530093 | |
| CIF file | Formula: - La6 O12 U - Comments: Hinatsu, Y.; Fujino, T.; Masaki, N. The Crystal Structure of La6 U O12 Journal of Solid State Chemistry 73 (1988) 567-571 Space group: R -3 :H Cell volume: 947.274 Cell parameters: 10.468; 10.468; 9.982; 90; 90; 120; |
| COD ID: 1530094 | |
| CIF file | Formula: - Cl33 Nd5 Sr9 - Comments: Hodorowicz, S.A.; Olejak-Chodan, M.; Eick, H.A. A preparatory and X-ray diffraction study of the Sr Cl2 Nd Cl3 system Journal of Solid State Chemistry 71 (1987) 205-213 Space group: R -3 :H Cell volume: 3581.38 Cell parameters: 12.908; 12.908; 24.82; 90; 90; 120; |
| COD ID: 1530107 | |
| CIF file | Formula: - Cs F6 Re - Comments: Hoskins, B.F.; Linden, A.; Mulvaney, P.C.; O'Donnell, T.A. The structures of barium hexafluorosilicate and cesium hexafluororhenate(V) Inorganica Chimica Acta 88 (1984) 217-222 Space group: R -3 :H Cell volume: 434.737 Cell parameters: 7.853; 7.853; 8.14; 90; 90; 120; |
| COD ID: 1530471 | |
| CIF file | Formula: - As Br5 F6 Se2 - Comments: Murchie, M.; Passmore, J.; White, P.S. The characterization and X-ray crystal structure of pentabromodiselenium hexafluoroarsenate, Se2 Br5 As F6. Some thermodynamic considerations and the nonexistence of Se2 I5 As F6 Canadian Journal of Chemistry 65 (1987) 1584-1593 Space group: R -3 :H Cell volume: 2940.03 Cell parameters: 13.367; 13.367; 19; 90; 90; 120; |
| COD ID: 1530487 | |
| CIF file | Formula: - Co0.4 Fe0.6 O3 Ti - Comments: Newsam, J.M.; Takei, H.; Endoh, Y.; Ishikawa, Y. Powder neutron diffraction studies of the mixed ilmenite system Fe0.6 Co0.4 Ti O3 Journal of Physics C 19 (1986) 1273-1282 Space group: R -3 :H Cell volume: 313.107 Cell parameters: 5.076; 5.076; 14.032; 90; 90; 120; |
| COD ID: 1530525 | |
| CIF file | Formula: - Bi0.5 O12 P3 Sb1.5 - Comments: Oyetola, A.; Verbaere, A.; Guyomard, D.; Piffard, Y. Bi(III)05 Sb(V)1.5 (P O4)3: A new type of M2 (X O4)3 framework related to garnet and Nasicon Journal of Solid State Chemistry 77 (1988) 102-111 Space group: R -3 :H Cell volume: 5342.29 Cell parameters: 17.034; 17.034; 21.26; 90; 90; 120; |
| COD ID: 1530636 | |
| CIF file | Formula: - Cu O3 V - Comments: Rea, J.R.; Kostiner, E. The crystal structure of Cu V O3 (II), a high-pressure Ilmenite phase Journal of Solid State Chemistry 7 (1973) 163-168 Space group: R -3 :H Cell volume: 300.805 Cell parameters: 4.966; 4.966; 14.0845; 90; 90; 120; |
| COD ID: 1530786 | |
| CIF file | Formula: - Ge3 Na4 O12 Zr2 - Comments: Sizova, R.G.; Blinov, V.A.; Kuznetsov, V.A.; Ilyukhin, V.V.; Voronkov, A.A.; Belov, N.V. The crystal structure of Na4 Zr2 Ge3 O12 Doklady Akademii Nauk SSSR 238 (1978) 855-857 Space group: R -3 :H Cell volume: 1734.62 Cell parameters: 9.429; 9.429; 22.529; 90; 90; 120; |
| COD ID: 1530943 | |
| CIF file | Formula: - Nb4.42 O16.55 Pb4.92 Zn0.575 - Comments: Vandenborre, M.T.; Chubb, M. Etude structurale d'un compose non stoechiometrique de formule Pb1.97 Nb1.77 Zn.23 O6.66 Revue de Chimie Minerale 21 (1984) 129-138 Space group: R -3 :H Cell volume: 886.495 Cell parameters: 7.476; 7.476; 18.315; 90; 90; 120; |
| COD ID: 1530983 | |
| CIF file | Formula: - As2 Co0.99 O75.9999 Rb8.01 W19.98 - Comments: Weakley, T.J.R. The crystal structures of rubidium 20-tungstocobalto(II) diarsenate(III) hydrate Rb8 (As2 Co W20 O68 (O H2)2) (H2 O)10 and its zinc analogue Inorganica Chimica Acta 87 (1984) 13-18 Space group: R -3 :H Cell volume: 11417.4 Cell parameters: 20.035; 20.035; 32.844; 90; 90; 120; |
| COD ID: 1530984 | |
| CIF file | Formula: - As2 O75.9999 Rb8.01 W19.98 Zn0.99 - Comments: Weakley, T.J.R. The crystal structures of rubidium 20-tungstocobalto(II) diarsenate(III) hydrate Rb8 (As2 Co W20 O68 (O H2)2) (H2 O)10 and its zinc analogue Inorganica Chimica Acta 87 (1984) 13-18 Space group: R -3 :H Cell volume: 11396.4 Cell parameters: 20.03; 20.03; 32.8; 90; 90; 120; |
| COD ID: 1531048 | |
| CIF file | Formula: - Mn0.5 O12 P3 Ti2 - Comments: Aatiq, A.; Menetrier, M.; El Jazouli, A.; Delmas, C. Structural and lithium intercalation studies of Mn0.5-x Cax Ti2 (P O4)3 phases (0 <= x <= 0.5) Solid State Ionics 150 (2002) 391-405 Space group: R -3 :H Cell volume: 1322.53 Cell parameters: 8.51; 8.51; 21.087; 90; 90; 120; |
| COD ID: 1531049 | |
| CIF file | Formula: - Ca0.25 Mn0.25 O12 P3 Ti2 - Comments: Aatiq, A.; Menetrier, M.; El Jazouli, A.; Delmas, C. Structural and lithium intercalation studies of Mn0.5-x Cax Ti2 (P O4)3 phases (0 <= x <= 0.5) Solid State Ionics 150 (2002) 391-405 Space group: R -3 :H Cell volume: 1326.3 Cell parameters: 8.425; 8.425; 21.576; 90; 90; 120; |
| COD ID: 1531168 | |
| CIF file | Formula: - Al D6 Li3 - Comments: Brinks, H.W.; Hauback, B.C. The structure of Li3 Al D6 Journal of Alloys Compd. 354 (2003) 143-147 Space group: R -3 :H Cell volume: 536.687 Cell parameters: 8.07117; 8.07117; 9.513; 90; 90; 120; |
| COD ID: 1531318 | |
| CIF file | Formula: - Cl18 Nb6 Tl2 V - Comments: Duraisamy, T.; Qualls, J.S.; Lachgar, A. A2 V Nb6 Cl18 (A = Rb, In, Tl): synthesis, crystal structure and magnetic properties of a new series of quaternary niobium chloride cluster compounds Journal of Solid State Chemistry 170 (2003) 227-231 Space group: R -3 :H Cell volume: 1810.5 Cell parameters: 9.1122; 9.1122; 25.178; 90; 90; 120; |
| COD ID: 1531406 | |
| CIF file | Formula: - F6 Li Rh - Comments: Fitz, H.; Mueller, B.G.; Grandejus, O.; Bartlett, N. Einkristalluntersuchungen an Li M F6 (M = Rh, Ir), Li2 Rh F6 und K2 Ir F6 Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 133-137 Space group: R -3 :H Cell volume: 295.931 Cell parameters: 5.02018; 5.02018; 13.5588; 90; 90; 120; |
| COD ID: 1531409 | |
| CIF file | Formula: - F6 Ir Li - Comments: Fitz, H.; Mueller, B.G.; Grandejus, O.; Bartlett, N. Einkristalluntersuchungen an Li M F6 (M = Rh, Ir), Li2 Rh F6 und K2Ir F6 Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 133-137 Space group: R -3 :H Cell volume: 302.311 Cell parameters: 5.06148; 5.06148; 13.626; 90; 90; 120; |
| COD ID: 1531637 | |
| CIF file | Formula: - I12 Ir Na0.9 Pr6.1 - Comments: Jensen, E.A.; Corbett, J.D. Alteration of rare-earth-metal cluster iodides R (R6 I12 Z) through cation substitution Journal of Solid State Chemistry 172 (2003) 132-137 Space group: R -3 :H Cell volume: 2390.88 Cell parameters: 15.958; 15.958; 10.841; 90; 90; 120; |
| COD ID: 1531639 | |
| CIF file | Formula: - Fe I12 La6.046 Na0.954 - Comments: Jensen, E.A.; Corbett, J.D. Alteration of rare-earth-metal cluster iodides R (R6 I12 Z) through cation substitution Journal of Solid State Chemistry 172 (2003) 132-137 Space group: R -3 :H Cell volume: 2509.74 Cell parameters: 16.142; 16.142; 11.122; 90; 90; 120; |
| COD ID: 1531642 | |
| CIF file | Formula: - Co I12 La6.199 Na0.801 - Comments: Jensen, E.A.; Corbett, J.D. Alteration of rare-earth-metal cluster iodides R (R6 I12 Z) through cation substitution Journal of Solid State Chemistry 172 (2003) 132-137 Space group: R -3 :H Cell volume: 2463.45 Cell parameters: 16.009; 16.009; 11.099; 90; 90; 120; |
| COD ID: 1531691 | |
| CIF file | Formula: - F K O6 Te3 - Comments: Laval, J.P.; Guillet, L.; Frit, B. K Te3 O6 F: a new layer Te O2 structure, stuffed with K F units Solid State Sciences 4 (2002) 549-556 Space group: R -3 :H Cell volume: 1073.39 Cell parameters: 9.486; 9.486; 13.774; 90; 90; 120; |
| COD ID: 1531925 | |
| CIF file | Formula: - Cu3 Mg2 O6 Sb - Comments: Nagarajan, R.; Uma, S.; Jayaraj, M.K.; Tate, J.; Sleight, A.W. New Cu M2/3 Sb1/3 O2 and Ag M2/3 Sb1/3 O2 compounds with the delafossite structure Solid State Sciences 4 (2002) 787-792 Space group: R -3 :H Cell volume: 848.984 Cell parameters: 5.344; 5.344; 34.327; 90; 90; 120; |
| COD ID: 1531934 | |
| CIF file | Formula: - C4 H4 Mn O6 - Comments: Neeraj, S.; Noy, M.L.; Rao, C.N.R.; Cheetham, A.K. Sodalite networks formed by metal squarates Solid State Sciences 4 (2002) 1231-1236 Space group: R -3 :H Cell volume: 1710.43 Cell parameters: 11.607; 11.607; 14.66; 90; 90; 120; |
| COD ID: 1532106 | |
| CIF file | Formula: - Ba Ni2 O8 V2 - Comments: Rogado, N.; Lynn, J.W.; Huang, Q.; Ramirez, A.P.; Huse, D.; Cava, R.J. Ba Ni2 V2 O8 : a two-dimensional honeycomb antiferromagnet Physical Review, Serie 3. B - Condensed Matter (18,1978-) 65 (2002) 144443-1-144443-7 Space group: R -3 :H Cell volume: 489.41 Cell parameters: 5.02899; 5.02899; 22.345; 90; 90; 120; |
| COD ID: 1532107 | |
| CIF file | Formula: - O12 Sc4 Ti3 - Comments: Rossell, H.J. Crystal structures of some fluorite-related M7 O12 compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 611.144 Cell parameters: 9.088; 9.088; 8.5443; 90; 90; 120; |
| COD ID: 1532108 | |
| CIF file | Formula: - Nb1.498 O12 Sc5.502 - Comments: Rossell, H.J. Crystal structures of some fluorite-related M7 O12 compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 646.535 Cell parameters: 9.259; 9.259; 8.7083; 90; 90; 120; |
| COD ID: 1532109 | |
| CIF file | Formula: - F Nb O11 Sc6 - Comments: Rossell, H.J. Crystal structures of some fluorite-related M7 O12 compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 649.766 Cell parameters: 9.2746; 9.2746; 8.7224; 90; 90; 120; |
| COD ID: 1532110 | |
| CIF file | Formula: - Hf Nb O12 Sc5 - Comments: Rossell, H.J. Crystal structures of some fluorite-related M7 O12 compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 652.532 Cell parameters: 9.2964; 9.2964; 8.7185; 90; 90; 120; |
| COD ID: 1532111 | |
| CIF file | Formula: - Hf3 O12 Sc4 - Comments: Rossell, H.J. Crystal Structures of Some Fluorite-Related M7 O12 Compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 662.096 Cell parameters: 9.371; 9.371; 8.706; 90; 90; 120; |
| COD ID: 1532112 | |
| CIF file | Formula: - O12 Yb4 Zr3 - Comments: Rossell, H.J. Crystal Structures of Some Fluorite-Related M7 O12 Compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 728.769 Cell parameters: 9.657; 9.657; 9.0235; 90; 90; 120; |
| COD ID: 1532113 | |
| CIF file | Formula: - Er4 O12 Zr3 - Comments: Rossell, H.J. Crystal Structures of Some Fluorite-Related M7 O12 Compounds Journal of Solid State Chemistry 19 (1976) 103-111 Space group: R -3 :H Cell volume: 741.467 Cell parameters: 9.7102; 9.7102; 9.0804; 90; 90; 120; |
| COD ID: 1532149 | |
| CIF file | Formula: - Cs2 O12 U4 - Comments: Van den Berghe, S.; Laval, J.P.; Verwerft, M.; Gaudreau, B.; Suard, E. Study of the pyrochlore-related structure of alpha-(Cs2 U4 O12) by powder neutron and X-ray diffraction Solid State Sciences 4 (2002) 1257-1264 Space group: R -3 :H Cell volume: 3951.52 Cell parameters: 15.4232; 15.4232; 19.1816; 90; 90; 120; |
| COD ID: 1532466 | |
| CIF file | Formula: - C138 H129 F18 N3 O18 P3 - Comments: Jia, Fei; He, Zhenfeng; Yang, Liu-Pan; Pan, Zhi-Sheng; Yi, Min; Jiang, Ren-Wang; Jiang, Wei Oxatub[4]arene: a smart macrocyclic receptor with multiple interconvertible cavities Chem. Sci. 6(12) (2015) 6731 Space group: R -3 :H Cell volume: 20163.7 Cell parameters: 43.2165; 43.2165; 12.4664; 90; 90; 120; |
| COD ID: 1532568 | |
| CIF file | Formula: - Ba4 Eu3 F17 - Comments: Achary, S.N.; Patwe, S.J.; Tyagi, A.K. Powder XRD study of Ba4 Eu3 F17 Powder Diffraction 17 (2002) 225-229 Space group: R -3 :H Cell volume: 2227.08 Cell parameters: 11.1787; 11.1787; 20.5789; 90; 90; 120; |
| COD ID: 1532603 | |
| CIF file | Formula: - Ba O18 V13 - Comments: Iwasaki, K.; Takizawa, H.; Yamane, H.; Kubota, S.; Takahashi, J.; Endo, T.; Uheda, K. Synthesis, crystal structure refinement, electrical and magnetic properties of Ba V13 O18 and Sr V13 O18 Materials Research Bulletin 38 (2003) 141-148 Space group: R -3 :H Cell volume: 968.584 Cell parameters: 12.6293; 12.6293; 7.0121; 90; 90; 120; |
| COD ID: 1532604 | |
| CIF file | Formula: - O18 Sr V13 - Comments: Iwasaki, K.; Takizawa, H.; Takahashi, J.; Yamane, H.; Kubota, S.; Uheda, K.; Endo, T. Synthesis, crystal structure refinement, electrical and magnetic properties of Ba V13 O18 and Sr V13 O18 Materials Research Bulletin 38 (2003) 141-148 Space group: R -3 :H Cell volume: 953.007 Cell parameters: 12.5491; 12.5491; 6.9878; 90; 90; 120; |
| COD ID: 1532615 | |
| CIF file | Formula: - Al H6 Li3 - Comments: Chung Saicheong; Morioka, H. Thermochemistry and crystal structures of lithium, sodium and potassium alanates as determined by ab initio simulations Journal of Alloys Compd. 372 (2004) 92-96 Space group: R -3 :H Cell volume: 526.279 Cell parameters: 8.017; 8.017; 9.455; 90; 90; 120; |
| COD ID: 1532656 | |
| CIF file | Formula: - Ca2 Mn Nd2 O7 - Comments: Wang Yingxia; Bie Lijian; Du Yu; Lin Jianhua; Richardson, J.W.jr.; You Liping; Loong Chun-K Hexagonal perovskite-intergrowth manganates: Ln2 Ca2 Mn O7 (Ln= La, Nd and Sm) Journal of Solid State Chemistry 177 (2004) 65-72 Space group: R -3 :H Cell volume: 1838.33 Cell parameters: 11.1096; 11.1096; 17.1987; 90; 90; 120; |
| COD ID: 1532682 | |
| CIF file | Formula: - H0.5 Nb2 O11.25 S2 - Comments: Bostroem, M.; Gemmi, M.; Schnelle, W.; Eriksson, L. Synthesis, properties and structure determination of Nb2 O3 (S O4)2 * 0.25(H2 O) from neutron and synchrotron X-ray powder diffraction data Journal of Solid State Chemistry 177 (2004) 1738-1745 Space group: R -3 :H Cell volume: 2479.27 Cell parameters: 10.384; 10.384; 26.55; 90; 90; 120; |
| COD ID: 1532809 | |
| CIF file | Formula: - Cr O12 P3 Sn Sr - Comments: Buvaneswari, G.; Govindan Kutty, K.V.; Varadaraju, U.V. Thermal expansion behaviour of sodium zirconium phosphate structure type phosphates containing tin Materials Research Bulletin 39 (2004) 475-488 Space group: R -3 :H Cell volume: 1381.26 Cell parameters: 8.351; 8.351; 22.87; 90; 90; 120; |
| COD ID: 1532813 | |
| CIF file | Formula: - Fe O12 P3 Sn Sr - Comments: Buvaneswari, G.; Govindan Kutty, K.V.; Varadaraju, U.V. Thermal expansion behaviour of sodium zirconium phosphate structure type phosphates containing tin Materials Research Bulletin 39 (2004) 475-488 Space group: R -3 :H Cell volume: 1397.09 Cell parameters: 8.398; 8.398; 22.874; 90; 90; 120; |
| COD ID: 1532824 | |
| CIF file | Formula: - O118 Sc12.14 Zr49.86 - Comments: Wurst, K.; Wallwork, K.S.; Schweda, E.; Bevan, D.J.M.; Mohyla, J.; Hofmann, M. Single-crystal structure determination of Zr50 Sc12 O118 Solid State Sciences 5 (2003) 1491-1497 Space group: R -3 :H Cell volume: 6049.7 Cell parameters: 19.7441; 19.7441; 17.9196; 90; 90; 120; |
| COD ID: 1533035 | |
| CIF file | Formula: - Ba3.6 Ca0.05 Ce1.95 Fe0.92 H16.25 K2.4 Mn0.38 Na2 Nb0.3 O48 Si11.7 Sr0.1 Ti2.7 - Comments: Rastsvetaeva, R.K.; Ma, Z.; Khomyakov, A.P.; Rozenberg, K.A.; Xiong, M.; Shi, N. Crystal structure of the K, Ti analogue of ilimaussite, the first representative of silicates with isolated (Si3 O9) rings and (Si O3 O H) tetrahedra Doklady Akad. Nauk 388 (2003) 64-68 Space group: R -3 :H Cell volume: 6030.13 Cell parameters: 10.713; 10.713; 60.67; 90; 90; 120; |
| COD ID: 1533098 | |
| CIF file | Formula: - Ba4 Bi3 F17 - Comments: Dombrovski, E.N.; Serov, T.V.; Ardashnikova, E.I.; Abakumov, A.M.; Dolgikh, V.A.; van Tendeloo, G. The structural investigation of Ba4 Bi3 F17 Journal of Solid State Chemistry 177 (2004) 312-318 Space group: R -3 :H Cell volume: 2269.16 Cell parameters: 11.23; 11.23; 20.7766; 90; 90; 120; |
| COD ID: 1533446 | |
| CIF file | Formula: - O9 P3 Y - Comments: Graia, M.; Driss, A.; Jouini, T. Crystal structure of three polymorphs of Y (P O3)3 Solid State Sciences 5 (2003) 393-402 Space group: R -3 :H Cell volume: 4662.33 Cell parameters: 21.042; 21.042; 12.159; 90; 90; 120; |
| COD ID: 1533489 | |
| CIF file | Formula: - Ba4 F17 Nd3 - Comments: Grover, V.; Patwe, S.J.; Achary, S.N.; Tyagi, A.K. Synthesis and structural elucidation of Ba4 Nd3 F17: a powder XRD study Powder Diffraction 17 (2002) 326-330 Space group: R -3 :H Cell volume: 2290.38 Cell parameters: 11.2818; 11.2818; 20.7788; 90; 90; 120; |
| COD ID: 1533775 | |
| CIF file | Formula: - Ca2 Mn O7 Sm2 - Comments: Bie Lijian; Li Guobao; Liao Fuhui; Lin Jianhua Structure variation and phase relationship of the hexagonal perovskite system La2 Ca2 Mn O7 - Sm2 Ca2 Mn O7 Gaodeng Xuexiao Huaxue Xuebao 24 (2003) 753-756 Space group: R -3 :H Cell volume: 1810.77 Cell parameters: 11.0526; 11.0526; 17.1161; 90; 90; 120; |
| COD ID: 1533783 | |
| CIF file | Formula: - La Mn0.5 Ni0.5 O3 - Comments: Blasco, J.; Garcia, J.; Sanchez, M.C.; Campo, J.; Subias, G.; Perez-Cacho, J. Magnetic properties of La Ni1-x Mnx O3+d perovskites The European Physical Journal B 30 (2002) 469-479 Space group: R -3 :H Cell volume: 349.8 Cell parameters: 5.5172; 5.5172; 13.2694; 90; 90; 120; |
| COD ID: 1533787 | |
| CIF file | Formula: - Er3 F17 Pb4 - Comments: Tyagi, A.K.; Patwe, S.J.; Achary, S.N.; Mallia, M.B. Phase relation studies in Pb1-x M'x F2+x systems (0.0 < x < 1.0; M'= Nd(3+), Eu(3+) and Er (3+)) Journal of Solid State Chemistry 177 (2004) 1746-1757 Space group: R -3 :H Cell volume: 2022.44 Cell parameters: 10.819; 10.819; 19.9513; 90; 90; 120; |
| COD ID: 1533819 | |
| CIF file | Formula: - Al77.69 Fe25.46 Si19.85 - Comments: Sugiyama, K.; Kaji, N.; Hiraga, K. Crystal structure of rhombohedral lambda-(Al Fe Si) Journal of Alloys Compd. 368 (2004) 251-255 Space group: R -3 :H Cell volume: 1779.67 Cell parameters: 10.222; 10.222; 19.667; 90; 90; 120; |
| COD ID: 1534150 | |
| CIF file | Formula: - Al3 Ca6 O30 S1.5 - Comments: Allmann, R. Die Doppelschichtstruktur der plaettchenfoermigen Calcium-Aluminium-H Salze am Beispiel des (Ca O)3 Al2 O3 Ca S O4 (H2 O)12 Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-) 1968 (1968) 140-144 Space group: R -3 :H Cell volume: 769.506 Cell parameters: 5.7586; 5.7586; 26.7946; 90; 90; 120; |
| COD ID: 1534179 | |
| CIF file | Formula: - Bi Na O3 - Comments: Aurivillius, B. X-ray studies on 'sodium metabismuthate' Acta Chemica Scandinavica (1-27,1973-42,1988) 9 (1955) 1219-1221 Space group: R -3 :H Cell volume: 428.887 Cell parameters: 5.56; 5.56; 16.01999; 90; 90; 120; |
| COD ID: 1534384 | |
| CIF file | Formula: - Ni S6 Ti3 - Comments: Danot, M.; Bichon, J.; Rouxel, J. Le systeme nickel-disulfure de titane Bulletin de la Societe Chimique de France (Vol=Year) 1972 (1972) 3063-3066 Space group: R -3 :H Cell volume: 508.42 Cell parameters: 5.88; 5.88; 16.98; 90; 90; 120; |
| COD ID: 1534594 | |
| CIF file | Formula: - O36 P12 Yb4 - Comments: Anisimova, N.Yu.; Trunov, V.K.; Karmanovskaya, N.B.; Chudinova, N.N. Synthesis and crystal structure of new modification of Yb (P O3)3 Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 28 (1992) 441-444 Space group: R -3 :H Cell volume: 4622.71 Cell parameters: 20.974; 20.974; 12.134; 90; 90; 120; |
| COD ID: 1534615 | |
| CIF file | Formula: - N9 Pr9 Se6 Si3 - Comments: Lissner, F.; Schleid, T. Pr3 Se2 Si N3: Das erste Nitrido-cyclo-Trisilicat mit diskreten (Si3 N9)(15-)-Anionen gemaess Pr9 Se6 (Si3 N9) Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 2226-2230 Space group: R -3 :H Cell volume: 3216.95 Cell parameters: 18.9241; 18.9241; 10.3725; 90; 90; 120; |
| COD ID: 1534643 | |
| CIF file | Formula: - Ca26 F67 Yb5 - Comments: Golubev, A.M. The fifth rhombohedral modification of fluoride-like structures built from M8R6F69 clusters Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 19 (1993) 939-943 Space group: R -3 :H Cell volume: 3939.82 Cell parameters: 21.69; 21.69; 9.67; 90; 90; 120; |
| COD ID: 1534770 | |
| CIF file | Formula: - C6 H18 Co Fe N12 - Comments: Seitz, K.; Peschel, S.; Babel, D. Ueber die Kristallstrukturen der Cyanokomplexe (Co (N H3)6) (Fe (C N)6), (Co (N H3)6)2 (Ni (C N)4)3 . 2(H2 O) und (Cu (en)2) (Ni (C N)4) Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 929-934 Space group: R -3 :H Cell volume: 1133.65 Cell parameters: 10.986; 10.986; 10.846; 90; 90; 120; |
| COD ID: 1534791 | |
| CIF file | Formula: - Al12 Bi2 O27 Sr6 - Comments: Bakakin, V.V.; Shaburova, V.P.; Mazus, M.D.; Kozeeva, L.P.; Podberezskaya, N.V.; Malinovskii, T.I. The structure of frame strontium aluminate Sr6(Al12O24)* Bi2O3 with inclusion of Bi2O3 molecule Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 35 (1994) 92-99 Space group: R -3 :H Cell volume: 1932.61 Cell parameters: 17.72; 17.72; 7.107; 90; 90; 120; |
| COD ID: 1534809 | |
| CIF file | Formula: - I6 Mo O18 Rb2 - Comments: Shehee, T.C.; Pehler, S.F.; Albrecht-Schmitt, T.E. Hydrothermal synthesis and structures of the homoleptic iodate complexes [M (I O)6](2-) (M = Mo, Zr) Journal of Alloys Compd. 388 (2005) 225-229 Space group: R -3 :H Cell volume: 1284.83 Cell parameters: 11.4048; 11.4048; 11.4062; 90; 90; 120; |
| COD ID: 1534812 | |
| CIF file | Formula: - Cs2 I6 O18 Zr - Comments: Shehee, T.C.; Pehler, S.F.; Albrecht-Schmitt, T.E. Hydrothermal synthesis and structures of the homoleptic iodate complexes [M (I O)6](2-) (M = Mo, Zr) Journal of Alloys Compd. 388 (2005) 225-229 Space group: R -3 :H Cell volume: 1405.71 Cell parameters: 11.7684; 11.7684; 11.7201; 90; 90; 120; |
| COD ID: 1534815 | |
| CIF file | Formula: - I6 O18 Rb2 Zr - Comments: Shehee, T.C.; Pehler, S.F.; Albrecht-Schmitt, T.E. Hydrothermal synthesis and structures of the homoleptic iodate complexes [M (I O)6](2-) (M= Mo, Zr) Journal of Alloys Compd. 388 (2005) 225-229 Space group: R -3 :H Cell volume: 1330.17 Cell parameters: 11.5575; 11.5575; 11.4987; 90; 90; 120; |
| COD ID: 1534927 | |
| CIF file | Formula: - Ba4 F17 Y3 - Comments: Maksimov, B.A.; Golubev, A.M.; Solans, H.; Dudka, A.P.; Badria-Font, M.; Genkina, E.A.; Buchinskaya, I.I.; Loshmanov, A.A.; Simonov, V.I.; Font-Altaba, M. The fluorite-matrix-based Ba4 R3 F17 (R= Y, Yb) crystal structure. Ordering of cations and specific features of the anionic motif. Kristallografiya 41 (1996) 51-59 Space group: R -3 :H Cell volume: 2163.97 Cell parameters: 11.075; 11.075; 20.372; 90; 90; 120; |
| COD ID: 1534931 | |
| CIF file | Formula: - Ba4 F17 Yb3 - Comments: Maksimov, B.A.; Buchinskaya, I.I.; Solans, H.; Dudka, A.P.; Genkina, E.A.; Font-Altaba, M.; Badria-Font, M.; Loshmanov, A.A.; Golubev, A.M.; Simonov, V.I. The fluorite-matrix-based Ba4 R3 F17 (R= Y, Yb) crystal structure. Ordering of cations and specific features of the anionic motif. Kristallografiya 41 (1996) 51-59 Space group: R -3 :H Cell volume: 2123.24 Cell parameters: 11; 11; 20.262; 90; 90; 120; |
| COD ID: 1535118 | |
| CIF file | Formula: - Ge I12 La7.72 - Comments: Mattausch, H.J.; Simon, A.; Zheng, C.; Ryazanov, M. Reduced lanthanum halides with Ge as interstitials: La2 I2 Ge, La2 I2 Ge2, La3 Cl2 Ge3, La3 Br2 Ge3, La3 I3 Ge, La6 I5 Ge3 and La(7+x) I12 Ge Zeitschrift fuer Anorganische und Allgemeine Chemie 631 (2005) 302-308 Space group: R -3 :H Cell volume: 2423.84 Cell parameters: 16.122; 16.122; 10.768; 90; 90; 120; |
| COD ID: 1535179 | |
| CIF file | Formula: - I3 O9 Sc - Comments: Hector, A.L.; Webster, M.; Levason, W.; Henderson, S. Hydrothermal synthesis of scandium, yttrium and lanthanide iodates from the corresponding periodates: X-ray crystal structures of Sc (I O3)3, Y (I O3)3 * 2(H2 O), La (I O3)3 * 1/2(H2 O) and Lu (I O3)3 * 2(H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 198-202 Space group: R -3 :H Cell volume: 1144.65 Cell parameters: 9.738; 9.738; 13.938; 90; 90; 120; |
| COD ID: 1535197 | |
| CIF file | Formula: - Cs F6 Nb - Comments: Berg, R.W.; von Barner, J.H.; Christensen, E.; Nielsen, K. Crystal Stucture and IR and Raman Spectra of alpha-CsNbF6 Progress in Molten Salt Chemistry 1, ISBN: 2-84299-249-0, Elsevier 2000 (2000) 1-1 Space group: R -3 :H Cell volume: 437.356 Cell parameters: 7.866; 7.866; 8.162; 90; 90; 120; |
| COD ID: 1535422 | |
| CIF file | Formula: - Li6 Mn2 N6 Sr2 - Comments: Hochrein, O.; Hoehn, P.; Kniep, R. Control of oxidation states of transition elements (Cr, Mn) in nitridometallates and the solid solution series Li6 (Ca1-x Srx)2 (Mn2 N6) Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 923-927 Space group: R -3 :H Cell volume: 567.404 Cell parameters: 5.859; 5.859; 19.086; 90; 90; 120; |
| COD ID: 1535457 | |
| CIF file | Formula: - Co N2 O6 - Comments: Tikhomirov, G.A.; Znamenkov, K.O.; Morozov, I.V.; Kemnitz, E.; Troyanov, S.I. Anhydrous nitrates and nitrosonium nitratometallates of manganese and cobalt, M (N O3)2, N O (Mn (N O3)3), and (N O)2 (Co (N O3)4): synthesis and crystal structure Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 269-273 Space group: R -3 :H Cell volume: 1225.67 Cell parameters: 10.5; 10.5; 12.837; 90; 90; 120; |
| COD ID: 1535571 | |
| CIF file | Formula: - Al F3 - Comments: Hoppe, R.; Kissel, D. Zur Kenntnis von Al F3 und In F3 Journal of Fluorine Chemistry 24 (1984) 327-340 Space group: R -3 :H Cell volume: 261.519 Cell parameters: 4.9254; 4.9254; 12.4477; 90; 90; 120; |
| COD ID: 1535626 | |
| CIF file | Formula: - Cl12 S Ti2 - Comments: Troyanov, S.I.; Timoshchenko, N.I.; Rybakov, V.B.; Fokina, Z.A. Synthesis and crystal structure of nonachlorodititanate(IV) trichlorosulfonium (SCl3) (Ti2Cl9) Zhurnal Neorganicheskoi Khimii 35 (1990) 1683-1685 Space group: R -3 :H Cell volume: 6941.13 Cell parameters: 21.513; 21.513; 17.318; 90; 90; 120; |
| COD ID: 1535636 | |
| CIF file | Formula: - Br3 Ti - Comments: Troyanov, S.I.; Ionov, V.M.; Rybakov, V.B. Synthesis and crystal structures of TiBr4,TiBr3 and Ti(AlBr4)2 Zhurnal Neorganicheskoi Khimii 35 (1990) 882-887 Space group: R -3 :H Cell volume: 677.13 Cell parameters: 6.478; 6.478; 18.632; 90; 90; 120; |
| COD ID: 1535644 | |
| CIF file | Formula: - Cl3 Ti - Comments: Troyanov, S.I.; Snigireva, E.M.; Rybakov, V.B. X-ray diffraction study of phase transition in alfa-TiCl3 Zhurnal Neorganicheskoi Khimii 36 (1991) 1117-1122 Space group: R -3 :H Cell volume: 577.022 Cell parameters: 6.153; 6.153; 17.599; 90; 90; 120; |
| COD ID: 1535680 | |
| CIF file | Formula: - Al0.705 O6 Sc3.295 - Comments: Mueller, D.; Assenmacher, W.; Mader, W. Darstellung und Struktur von Sc3 (Sc0.31 Al0.69) O6 - einem neuen Abkoemmling des Mg3 Te O6-Strukturtyps Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 2483-2489 Space group: R -3 :H Cell volume: 675.659 Cell parameters: 8.77451; 8.77451; 10.1333; 90; 90; 120; |
| COD ID: 1535681 | |
| CIF file | Formula: - Cl3 Fe - Comments: Troyanov, S.I. Crystal structure of FeCl3 polytyped modifications Zhurnal Neorganicheskoi Khimii 38 (1993) 1946-1949 Space group: R -3 :H Cell volume: 552.874 Cell parameters: 6.056; 6.056; 17.407; 90; 90; 120; |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!