Crystallography Open Database
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Searching year of publication is 2005
COD ID  |
Links | Formula |
Space group  |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1544612 | CIF | O2 Si | ? | 26.786; 26.786; 13.3351 90; 90; 90 | 9567.8 | Nakagawa, T.; Kihara, K.; Fujinami, S. X-ray studies of structural changes in melanophlogite with varying temperature : Sample at -50 C Journal of Mineralogical and Petrological Sciences, 2005, 100, 247-259 |
| 1544613 | CIF | O2 Si | ? | 26.808; 26.808; 13.394 90; 90; 90 | 9626 | Nakagawa, T.; Kihara, K.; Fujinami, S. X-ray studies of structural changes in melanophlogite with varying temperature : Sample at 60 C Journal of Mineralogical and Petrological Sciences, 2005, 100, 247-259 |
| 2100211 | CIF Paper | Ba0.0504 Bi0.2661 O1.8165 Ti0.6835 | ?P? | 10.6914; 3.7963; 3.3457 90; 92.625; 90 | 135.652 | Michiue, Yuichi; Yamamoto, Akiji; Onoda, Mitsuko; Sato, Akira; Akashi, Takaya; Yamane, Hisanori Incommensurate crystallographic shear structure of Ba~<i>x~</i>Bi~2{-~2<i>x</i>}Ti~4{-~<i>x</i>}O~11{-~4<i>x</i>} (<i>x</i> = 0.275) Acta Crystallographica Section B, 2005, 61, 145-153 |
| 2100218 | CIF Paper | C4 H9 Cd N7 Ni O0 | ?P? | 8.4867; 15.951; 7.604 90; 90.48; 90 | 1029.3 | Petříček, Václav; Dušek, Michal; Černák, Juraj Modulated one-dimensional structure of [Cd(NH~3~)~3~Ni(CN)~4~] Acta Crystallographica Section B, 2005, 61, 280-286 |
| 2100220 | CIF Paper | K5 Mo4 O16 Yb | ?P? | 10.4054; 6.1157; 19.7751 90; 136.625; 90 | 864.2 | Alla Arakcheeva; Gervais Chapuis; Vaclav Petricek; Vladimir Morozov The role of second coordination-sphere interactions in incommensurately modulated structures, using β-K~5~Yb(MoO~4~)~4~ as an example Acta Crystallographica Section B, 2005, 61, 400-406 |
| 9003667 | CIF | Ca Ge O5 Ti0.222 Zr0.778 | A -1 | 7.35292; 9.1; 6.75633 89.085; 113.024; 91.001 | 415.981 | Ellemann-Olesen R; Malcherek, T. Temperature and composition dependence of structural phase transitions in Ca(TixZr1-x)OGeO4. Sample: Ti20, triclinically distorted titanite structure American Mineralogist, 2005, 90, 687-694 |
| 9003668 | CIF | Ca Ge O5 Ti0.114 Zr0.885 | A -1 | 7.38422; 9.12413; 6.76031 88.765; 112.877; 91.297 | 419.499 | Ellemann-Olesen R; Malcherek, T. Temperature and composition dependence of structural phase transitions in Ca(TixZr1-x)OGeO4. Sample: Ti10, triclinically distorted titanite structure American Mineralogist, 2005, 90, 687-694 |
| 9003665 | CIF | Ca Ge O5 Ti0.807 Zr0.192 | A 1 2/a 1 | 7.1749; 8.93321; 6.67312 90; 113.6; 90 | 391.94 | Ellemann-Olesen R; Malcherek, T. Temperature and composition dependence of structural phase transitions in Ca(TixZr1-x)OGeO4. Sample: Ti80, hi-T titanite structure American Mineralogist, 2005, 90, 687-694 |
| 9003666 | CIF | Ca Ge O5 Ti0.507 Zr0.492 | A 1 2/a 1 | 7.25821; 9.01791; 6.722 90; 113.351; 90 | 403.944 | Ellemann-Olesen R; Malcherek, T. Temperature and composition dependence of structural phase transitions in Ca(TixZr1-x)OGeO4. Sample: Ti50, hi-T titanite structure American Mineralogist, 2005, 90, 687-694 |
| 9004920 | CIF | Ca O5 Si Ti0.76 Zr0.24 | A 1 2/a 1 | 7.1136; 8.7724; 6.5987 90; 113.581; 90 | 377.395 | Liferovich, R. P.; Mitchell, R. H. Composition and paragenesis of Na-, Nb-, and Zr-bearing titanite from Khibina, Russia, and crystal-structure data for synthetic analogues The Canadian Mineralogist, 2005, 43, 795-812 |
| 9004921 | CIF | Ca0.85 Na0.14 Nb0.15 O5 Si Ti0.7 Zr0.15 | A 1 2/a 1 | 7.1276; 8.7541; 6.6031 90; 113.847; 90 | 376.832 | Liferovich, R. P.; Mitchell, R. H. Composition and paragenesis of Na-, Nb-, and Zr-bearing titanite from Khibina, Russia, and crystal-structure data for synthetic analogues The Canadian Mineralogist, 2005, 43, 795-812 |
| 9007340 | CIF | Ca O5 Si Ti0.9 Zr0.1 | A 1 2/a 1 | 7.0788; 8.7378; 6.5754 90; 113.709; 90 | 372.383 | Liferovich, R. P.; Mitchell, R. H. Crystal chemistry of titanite-structured compounds: the CaTi1-xZrxOSiO4 (x <= 0.5) series Sample: x=0.1 Physics and Chemistry of Minerals, 2005, 32, 40-51 |
| 9007341 | CIF | Ca O5 Si Ti0.81 Zr0.19 | A 1 2/a 1 | 7.0992; 8.758; 6.5894 90; 113.635; 90 | 375.329 | Liferovich, R. P.; Mitchell, R. H. Crystal chemistry of titanite-structured compounds: the CaTi1-xZrxOSiO4 (x <= 0.5) series Sample: x=0.2 Physics and Chemistry of Minerals, 2005, 32, 40-51 |
| 9007342 | CIF | Ca O5 Si Ti0.71 Zr0.29 | A 1 2/a 1 | 7.1252; 8.7826; 6.6057 90; 113.553; 90 | 378.933 | Liferovich, R. P.; Mitchell, R. H. Crystal chemistry of titanite-structured compounds: the CaTi1-xZrxOSiO4 (x <= 0.5) series Sample: x=0.3 Physics and Chemistry of Minerals, 2005, 32, 40-51 |
| 9007343 | CIF | Ca O5 Si Ti0.62 Zr0.38 | A 1 2/a 1 | 7.1481; 8.8011; 6.6171 90; 113.477; 90 | 381.829 | Liferovich, R. P.; Mitchell, R. H. Crystal chemistry of titanite-structured compounds: the CaTi1-xZrxOSiO4 (x <= 0.5) series Sample: x=0.4 Physics and Chemistry of Minerals, 2005, 32, 40-51 |
| 9007344 | CIF | Ca O5 Si Ti0.51 Zr0.49 | A 1 2/a 1 | 7.1824; 8.8281; 6.6337 90; 113.369; 90 | 386.119 | Liferovich, R. P.; Mitchell, R. H. Crystal chemistry of titanite-structured compounds: the CaTi1-xZrxOSiO4 (x <= 0.5) series Sample: x=0.5 Physics and Chemistry of Minerals, 2005, 32, 40-51 |
| 1535050 | CIF | Br2 Cu3 O6 Te2 | A 1 2/m 1 | 8.1999; 6.2781; 9.3186 90; 107.39; 90 | 457.793 | Becker, R.; Johnsson, M.; Kremer, R.K.; Lemmens, P. Crystal structure and magnetic properties of Cu3(TeO3)2Br2 - a layered compound with a new Cu(II) coordination polyhedron Journal of Solid State Chemistry, 2005, 178, 2024-2029 |
| 4310230 | CIF | C44 H148 Cu7 K14 N8 O183 Si3 W33 | A 1 2/m 1 | 12.546; 21.303; 37.932 90; 106.16; 90 | 9737 | Santiago Reinoso; Pablo Vitoria; Juan M. Gutiérrez-Zorrilla; Luis Lezama; Leire San Felices; Javier I. Beitia Inorganic-Metalorganic Hybrids Based on Copper(II)-Monosubstituted Keggin Polyanions and Dinuclear Copper(II)-Oxalate Complexes. Synthesis, X-ray Structural Characterization, and Magnetic Properties Inorganic Chemistry, 2005, 44, 9731-9742 |
| 9013491 | CIF | O2 Si | A 1 a 1 | 25.878; 5.001; 18.526 90; 117.69; 90 | 2122.98 | Hirose, T.; Kihara, K.; Okuno, M.; Fujinami, S.; Shinoda, K. X-ray, DTA and Raman studies of monoclinic tridymite and its higher temperature orthorhombic modification with varying temperature. Note: T = 298 K Journal of Mineralogical and Petrological Sciences, 2005, 100, 55-69 |
| 9013492 | CIF | O2 Si | A 1 a 1 | 25.919; 5.004; 18.54 90; 117.72; 90 | 2128.64 | Hirose, T.; Kihara, K.; Okuno, M.; Fujinami, S.; Shinoda, K. X-ray, DTA and Raman studies of monoclinic tridymite and its higher temperature orthorhombic modification with varying temperature. Note: T = 373 K Journal of Mineralogical and Petrological Sciences, 2005, 100, 55-69 |
| 2206389 | CIF HKL Paper | C19 H20 N2 Ni O2 | A 21 a m | 7.529; 10.399; 21.555 90; 90; 90 | 1687.6 | You, Zhong-Lu [<i>N</i>,<i>N</i>'-Bis(3-methylsalicylidene)-1,3-propanediaminato]nickel(II) Acta Crystallographica Section E, 2005, 61, m1637-m1638 |
| 1100858 | CIF | C27 H31 Fe2 N O2 Si | A b a 2 | 9.92; 34.927; 14.849 90; 90; 90 | 5144.6 | Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics, 2005, 24, 2297-2306 |
| 2100267 | CIF Paper | C4 H8 O | A b a 2 | 9.3789; 13.658; 13.661 90; 90; 90 | 1749.9 | Dave Allan, D The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH) Acta Crystallographica Section B, 2005, 61, 449-454 |
| 2100268 | CIF Paper | C4 H8 O | A b a 2 | 9.3312; 13.642; 13.619 90; 90; 90 | 1733.6 | Dave Allan, D The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH) Acta Crystallographica Section B, 2005, 61, 449-454 |
| 2205529 | CIF HKL Paper | C18 H18 O8 | A b a 2 | 9.8562; 13.4978; 11.8371 90; 90; 90 | 1574.8 | Mao-Lin Hu; Ya-Qian Cheng; Shun Wang; Ji-Xin Yuan; Xiao-Qing Cai 6,6'-Dioxo-2,2-bi(7-oxatricyclo[3.2.1.1^3,8^]nonane)-4,4'-dicarboxylic acid Acta Crystallographica Section E, 2005, 61, o1196-o1197 |
| 4060562 | CIF | C24 H26 | A b a 2 | 18.2792; 22.9191; 8.519 90; 90; 90 | 3569 | Rowshan Ara Begum; Paul R. Sharp Nickel and Platinum 1,2-Dibromoacenaphthylene Chemistry Organometallics, 2005 |
| 4100318 | CIF | C44 H103 Cl12 Fe10 N15 | A b a 2 | 43.523; 23.303; 15.201 90; 90; 90 | 15417 | Journal of the American Chemical Society, 2005 |
| 4308706 | CIF | C24 H29 Cl O3 P2 Pt | A b a 2 | 32.453; 17.774; 8.834 90; 90; 90 | 5095.6 | Nicola Oberbeckmann-Winter; Xavier Morise; Pierre Braunstein; Richard Welter Synthesis and Structure of Pt(II) Phosphonato-Phosphine Complexes and of a P,O-Stabilized Metal-Metal-Bonded Pt2Ag2 Complex Inorganic Chemistry, 2005, 44, 1391-1403 |
| 4308717 | CIF | C56 H48 B F24 N2 P Pt | A b a 2 | 39.5675; 17.7672; 19.237 90; 90; 90 | 13524 | Raffaello Romeo; Salvatore Carnabuci; Maria Rosaria Plutino; Andrea Romeo; Silvia Rizzato; Alberto Albinati Structural Properties and Dissociative Fluxional Motion of 2,9-Dimethyl-1,10-Phenanthroline in Platinum(II) Complexes Inorganic Chemistry, 2005, 44, 1248-1262 |
| 4310100 | CIF | C84 H124 Mn12 O48 | A b a 2 | 21.2382; 29.477; 19.4191 90; 90; 90 | 12157.1 | Philippa King; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou Single-Molecule Magnets: A Reductive Aggregation Route to New Types of Mn12 Complexes Inorganic Chemistry, 2005, 44, 8659-8669 |
| 4505207 | CIF | C15 H26 Cl N3 | A b a 2 | 11.978; 37.836; 14.948 90; 90; 90 | 6774 | Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides Crystal Growth & Design, 2005, 5, 1881 |
| 7008457 | CIF | C48 H34 Cd N12 O2 | A b a 2 | 12.144; 40.776; 8.353 90; 90; 90 | 4136.3 | Ye, Qiong; Tang, Yu-Zhi; Wang, Xi-Sen; Xiong, Ren-Gen Strong enhancement of second-harmonic generation (SHG) response through multi-chiral centers and metal-coordination. Dalton transactions (Cambridge, England : 2003), 2005, 1570-1573 |
| 7100197 | CIF | C11 H10 N4 O | A b a 2 | 13.713; 6.977; 10.013 90; 90; 90 | 957.9 | Parthasarathi Dastidar; Amitava Das; D.Amilan Jose; D.Krishna Kumar First Snapshot of A Nonpolymeric Hydrogelator Interacting with its Gelling solvents Chemical Communications, 2005 |
| 8000073 | CIF | C32 H40 Cl2 N6 O11 Tc | A b a 2 | 12.546; 25.351; 11.584 89; 90; 89 | 3684.3 | Takashi Yoshimura; Masanori Kawai; Tsutomu Takayama; Tsutomu Sekine; Hiroshi Kudo; Atsushi Shinohara A Novel Seven-coordinate Technetium(IV) Complex: Synthesis and Characterization of [TcO(tpen)]2+ (tpen \δb N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine) Chemistry Letters, 2005, 34, 1624 |
| 4111564 | CIF | C54 H93 B36 Cl4 Co2 Fe N7 | A b m 2 | 23.443; 25.146; 13.2883 90; 90; 90 | 7833.4 | Julien Bachmann; Daniel G. Nocera Multielectron Redox Chemistry of Iron Porphyrinogens Journal of the American Chemical Society, 2005, 127, 4730-4743 |
| 7100572 | CIF | C22 H26 N2 O | A e a 2 | 12.149; 20.4254; 7.2291 90; 90; 90 | 1793.89 | Ebran, Jean-Philippe; Hazell, Rita G.; Skrydstrup, Troels Samarium diiodide-induced intramolecular pinacol coupling of dinitrones: synthesis of cyclic cis-vicinal diamines Chemical Communications (Cambridge, United Kingdom), 2005, 5402-5404 |
| 4000567 | CIF | Ba Cu2 Se4 Sn | A m a 2 | 11.1215; 11.2373; 6.7531 90; 90; 90 | 843.97 | Chemistry of Materials, 2005 |
| 4100299 | CIF | C8 H9 N O S | A m a 2 | 9.2374; 18.966; 4.6027 90; 90; 90 | 806.37 | Journal of the American Chemical Society, 2005 |
| 9013974 | CIF | Ca2.5 H11 O12.5 Si3 | B 1 1 b | 6.735; 7.425; 27.987 90; 90; 123.25 | 1170.43 | Bonaccorsi, E.; Merlino, S. The crystal of tobermorite 14 A (plombierite) a CSH phase Journal of the American Ceramic Society, 2005, 88, 505-512 |
| 4505247 | CIF | C10 H24 Fe N2 O13 | B 1 21 1 | 14.521; 14.229; 68.443 90; 96.26; 90 | 14057.3 | Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt [M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases† Crystal Growth & Design, 2005, 5, 2225 |
| 4000656 | CIF | Fe3 Nd O9 Sr3 | B b m m | 5.5414; 5.4986; 28.81 90; 90; 90 | 877.8 | Barrier, N.; Pelloquin, D.; Nguyen, N.; Giot, M.; Bourrée, F.; Raveau, B. Ferrite Sr~3~NdFe~3~O~9~: An Original Intergrowth between the Brownmillerite and K~2~NiF~4~-type Structures Chemistry of Materials, 2005, 17, 6619-6623 |
| 2014635 | CIF HKL Paper | C13 H9 N O | C -1 | 12.936; 33.696; 10.604 90.35; 120.67; 89.6 | 3975.5 | Britton, Doyle 4'-Hydroxybiphenyl-4-carbonitrile Acta Crystallographica Section C, 2005, 61, o35-o37 |
| 2100160 | CIF Paper | C12 H24 Cl Mn N6 O6 | C -1 | 30.5936; 18.8967; 12.8288 90.18; 111.561; 90.083 | 6897.5 | A. David Rae; Susanne Mossin; Henning O. Sørensen Structure refinement of a twinned pseudo-symmetric crystal of [Mn(C~10~H~24~N~4~)(NCO)~2~]^+^·ClO_4^- Acta Crystallographica Section B, 2005, 61, 407-417 |
| 4505241 | CIF | C10 H24 Mn N2 O13 | C -1 | 14.544; 28.47; 10.646 89.78; 126.43; 89.98 | 3547 | Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt [M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases† Crystal Growth & Design, 2005, 5, 2225 |
| 4505242 | CIF | C10 H24 Mn N2 O13 | C -1 | 14.73; 28.329; 10.786 89.95; 126.05; 90.05 | 3639 | Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt [M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases† Crystal Growth & Design, 2005, 5, 2225 |
| 9003671 | CIF | Al1.27 Fe0.42 K0.09 Mg2.13 Na0.46 O12 Si3.12 | C -1 | 5.31; 9.18; 9.754 96.2; 96.5; 89.9 | 469.621 | Kogure, T.; Miyawaki, R.; Banno, Y. The true structure of wonesite, an interlayer-deficient trioctahedral sodium mica American Mineralogist, 2005, 90, 725-731 |
| 9003676 | CIF | Mn5 O15 Si5 | C -1 | 9.8381; 10.5361; 12.2381 108.697; 103.335; 82.191 | 1166.56 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4018 Note: see samples 15-4029 and 15-4024 for plausible typical "fowlerite" and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003677 | CIF | Ca1.001 Fe0.209 Mg0.13 Mn3.275 O15 Si5 Zn0.41 | C -1 | 9.7718; 10.5084; 12.2256 108.606; 103.017; 82.482 | 1156.84 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4024 Note: this is a plausible typical cation distribution for "fowlerite" American Mineralogist, 2005, 90, 969-983 |
| 9003678 | CIF | Mn5 O15 Si5 | C -1 | 9.7999; 10.5176; 12.2365 108.587; 103.185; 82.32 | 1161.4 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4025 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003679 | CIF | Mn5 O15 Si5 | C -1 | 9.7902; 10.5184; 12.223 108.644; 103.159; 82.308 | 1158.78 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4026 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003680 | CIF | Mn5 O15 Si5 | C -1 | 9.8451; 10.5389; 12.2414 108.692; 103.299; 82.184 | 1168.19 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4030 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003681 | CIF | Mn5 O15 Si5 | C -1 | 9.8121; 10.5187; 12.218 108.651; 103.217; 82.308 | 1160.63 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4031 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003682 | CIF | Mn5 O15 Si5 | C -1 | 9.7834; 10.5023; 12.2338 108.682; 103.273; 82.213 | 1156.34 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4033 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003683 | CIF | Mn5 O15 Si5 | C -1 | 9.7648; 10.4912; 12.2228 108.671; 103.177; 82.284 | 1152.47 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4034 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003684 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.8456; 10.4992; 12.2005 108.726; 103.724; 82.113 | 1157.76 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4006 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003685 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.8768; 10.5222; 12.218 108.748; 103.781; 82.037 | 1165.12 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4014 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003686 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.8393; 10.4941; 12.1977 108.751; 103.751; 82.091 | 1155.87 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4020 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003687 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.8337; 10.4987; 12.1966 108.699; 103.597; 82.221 | 1156.83 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4027 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003688 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.864; 10.5237; 12.218 108.727; 103.705; 82.082 | 1164.33 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4028 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003689 | CIF | Ca0.3 Fe0.4 Mg0.1 Mn4.292 O15 Si5 Zn0.005 | C -1 | 9.8793; 10.5298; 12.2257 108.744; 103.752; 82.03 | 1167.14 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4029 Note: this is a plausible typical cation distribution for rhodonite American Mineralogist, 2005, 90, 969-983 |
| 9003690 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.8719; 10.5262; 12.2214 108.743; 103.728; 82.049 | 1165.6 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4040 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003691 | CIF | Ca Mn3 O15 Si5 Zn | C -1 | 9.8905; 10.5423; 12.2294 108.739; 103.773; 82.05 | 1170.18 | Nelson, W. R.; Griffen, D. T. Crystal chemistry of Zn-rich rhodonite ("fowlerite") Sample: 15-4041 Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite and rhodonite cation distributions American Mineralogist, 2005, 90, 969-983 |
| 9003700 | CIF | Al Na O8 Si3 | C -1 | 7.7176; 12.5592; 7.0113 93.963; 117.177; 88.132 | 603.111 | Benusa, M. D.; Angel, R. J.; Ross, N. L. Compression of albite, NaAlSi3O8 Sample: Amelia Court House, Virginia locality P = 6.489 GPa American Mineralogist, 2005, 90, 1115-1120 |
| 9003701 | CIF | Al Na O8 Si3 | C -1 | 7.5713; 12.517; 6.9697 93.797; 117.448; 87.508 | 584.814 | Benusa, M. D.; Angel, R. J.; Ross, N. L. Compression of albite, NaAlSi3O8 Sample: Amelia Court House, Virginia locality P = 8.411 GPa American Mineralogist, 2005, 90, 1115-1120 |
| 9003702 | CIF | Al Na O8 Si3 | C -1 | 7.5028; 12.4933; 6.9463 93.903; 117.791; 86.786 | 574.453 | Benusa, M. D.; Angel, R. J.; Ross, N. L. Compression of albite, NaAlSi3O8 Sample: Amelia Court House, Virginia locality P = 9.431 GPa American Mineralogist, 2005, 90, 1115-1120 |
| 1101098 | CIF | C65 H85 N15 O35 | C 1 2 1 | 39.54; 8.72; 22.89 90; 95.26; 90 | 7859 | Jarmula, Adam; Rypniewski, Wojciech R.; Felczak, Krzysztof; Rode, Wojciech Struct. Chem., 2005, 541-549 |
| 1101099 | CIF | C13 H16 F N3 O7 | C 1 2 1 | 21.72; 8.72; 8.61 90; 90.42; 90 | 1631 | Jarmula, Adam; Rypniewski, Wojciech R.; Felczak, Krzysztof; Rode, Wojciech Struct. Chem., 2005, 541-549 |
| 1506539 | CIF | C14 H26 O6 S2 | C 1 2 1 | 20.556; 5.32; 15.025 90; 95.915; 90 | 1634.35 | Ward, Dale E.; Jheengut, Vishal; Akinnusi, Olukayode T. Enantioselective direct intermolecular aldol reactions with enantiotopic group selectivity and dynamic kinetic resolution. Organic letters, 2005, 7, 1181-1184 |
| 1506620 | CIF | C15 H23 N O | C 1 2 1 | 16.412; 5.944; 14.762 90; 95.14; 90 | 1434.3 | Bilke, Julia Luzia; Dzuganova, Monika; Fröhlich, Roland; Würthwein, Ernst-Ulrich Diastereoselective one-step synthesis of functionalized cis-aziridinyl alcohols from oxiranyl carbaldimines. Organic letters, 2005, 7, 3267-3270 |
| 1506720 | CIF | C13 H14 Br N O4 | C 1 2 1 | 16.5687; 5.235; 16.4498 90; 92.787; 90 | 1425.12 | Wang, Jian; Li, Hao; Duan, Wenhu; Zu, Liansuo; Wang, Wei Organocatalytic asymmetric Michael addition of 2,4-pentandione to nitroolefins. Organic letters, 2005, 7, 4713-4716 |
| 1506725 | CIF | C23 H24 O2 Sn | C 1 2 1 | 36.529; 11.7506; 26.095 90; 133.184; 90 | 8167.3 | Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J. Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes. Organic letters, 2005, 7, 5377-5380 |
| 2014866 | CIF Paper | C6 H14 O5 | C 1 2 1 | 10.675; 7.3502; 5.1968 90; 103.877; 90 | 395.86 | Goverdhan Mehta; Saikat Sen; Siddharth Dey (1<i>S</i>*,2<i>S</i>*,4<i>S</i>*,5<i>S</i>*)-Cyclohexane-1,2,4,5-tetrol monohydrate Acta Crystallographica Section C, 2005, 61, o358-o360 |
| 2014973 | CIF HKL Paper | C16 H10 Hg N4 S4 | C 1 2 1 | 23.066; 5.0026; 8.022 90; 108.871; 90 | 875.9 | Dürüst, Yaşar; Altuğ, Cevher; Bozkurt, Çetin; Fronczek, Frank R. Bis(3-phenyl-1,2,4-thiadiazole-5-thiolato)mercury(II) Acta Crystallographica Section C, 2005, 61, m442-m444 |
| 2015135 | CIF HKL Paper | C13 H24 O11 | C 1 2 1 | 14.6984; 5.0061; 21.1204 90; 96.5502; 90 | 1543.93 | Pan, Qingfeng; Noll, Bruce C.; Serianni, Anthony S. Methyl 4-<i>O</i>-β-<small>D</small>-galactopyranosyl α-<small>D</small>-glucopyranoside (methyl α-lactoside) Acta Crystallographica Section C, 2005, 61, o674-o677 |
| 2100018 | CIF Paper | C48 H70 I N11 O13 | C 1 2 1 | 40.254; 12.53; 11.134 90; 98.48; 90 | 5554.4 | Richard E. Marsh Space group <i>P</i>1: an update Acta Crystallographica Section B, 2005, 61, 359-359 |
| 2100021 | CIF Paper | C32 H42 O6 Ti2 | C 1 2 1 | 23.2475; 7.9835; 23.097 90; 132.93; 90 | 3138.68 | Richard E. Marsh Space group <i>P</i>1: an update Acta Crystallographica Section B, 2005, 61, 359-359 |
| 2100079 | CIF Paper | C13 H21 Cl N2 O5 S | C 1 2 1 | 19.127; 6.897; 15.147 90; 119.85; 90 | 1733.08 | Richard E. Marsh Space group <i>P</i>1: an update Acta Crystallographica Section B, 2005, 61, 359-359 |
| 2100086 | CIF Paper | C13 H25 O10.5 | C 1 2 1 | 21.735; 4.93; 17.386 90; 123.5; 90 | 1553.51 | Richard E. Marsh Space group <i>P</i>1: an update Acta Crystallographica Section B, 2005, 61, 359-359 |
| 2100091 | CIF Paper | C20 H29 N O4 | C 1 2 1 | 17.138; 9.998; 13.404 90; 119.2; 90 | 2004.86 | Richard E. Marsh Space group <i>P</i>1: an update Acta Crystallographica Section B, 2005, 61, 359-359 |
| 2100207 | CIF Paper | C50 H77 Cl O55.25 | C 1 2 1 | 18.998; 24.82; 16.662 90; 105.29; 90 | 7579 | Tsorteki, Frantzeska; Bethanis, Kostas; Pinotsis, Nikos; Giastas, Petros; Mentzafos, Dimitris Inclusion compounds of plant growth regulators in cyclodextrins. V. 4-Chlorophenoxyacetic acid encapsulated in β-cyclodextrin and heptakis(2,3,6-tri-<i>O</i>-methyl)-β-cyclodextrin Acta Crystallographica Section B, 2005, 61, 207-217 |
| 2100216 | CIF Paper | C24 H37 O5.5 | C 1 2 1 | 26.6049; 7.7044; 22.9126 90; 93.424; 90 | 4688.12 | Bertolasi, Valerio; Ferretti, Valeria; Pretto, Loretta; Fantin, Giancarlo; Fogagnolo, Marco; Bortolini, Olga Hydrogen-bonded aggregations of oxo-cholic acids Acta Crystallographica Section B, 2005, 61, 346-356 |
| 2204901 | CIF HKL Paper | C21 H29 Br O3 | C 1 2 1 | 22.565; 9.393; 21.052 90; 115.682; 90 | 4021 | Shi Wang; Yongli Wang; Qiang Nie; Aishuang Xiang; Lina Zhou 16β-Bromo-17α-hydroxypregn-4-ene-3,20-dione Acta Crystallographica Section E, 2005, 61, o1-o2 |
| 2204978 | CIF HKL Paper | Cs P2 S7 V | C 1 2 1 | 8.601; 9.5176; 6.7287 90; 98.17; 90 | 545.23 | Gutzmann, Andreas; Näther, Christian; Bensch, Wolfgang CsVP~2~S~7~ Acta Crystallographica Section E, 2005, 61, i6-i8 |
| 2205213 | CIF HKL Paper | C30 H50 O | C 1 2 1 | 13.4048; 6.1275; 30.239 90; 94.81; 90 | 2475 | Kouam, Simeon F.; Flörke, Ulrich; Krohn, Karsten; Akhtar, M. Nadeem; Ngadjui, Bonaventure T.; Abegaz, Berhanu M. 3β-Taraxerol from <i>Bridelia micrantha</i> Acta Crystallographica Section E, 2005, 61, o599-o600 |
| 2205628 | CIF HKL Paper | C28 H34 O6 S | C 1 2 1 | 19.508; 10.731; 25.92 90; 108.666; 90 | 5140.7 | Nie, Qiang; Wang, Jingkang; Wang, Shi; Zhang, Meijing 16α,17-Epoxy-11α-(<i>p</i>-tolylsulfonyloxy)pregn-4-ene-3,20-dione Acta Crystallographica Section E, 2005, 61, o912-o913 |
| 2205659 | CIF HKL Paper | C12 H21 Cl0.4 Co N6.6 O8.3 | C 1 2 1 | 29.398; 9.839; 13.59 90; 108.189; 90 | 3734.4 | Leverett J. Zompa <i>trans</i>-Imidazole isomer of the bis(<small>L</small>-histidinato)cobalt(III) complex Acta Crystallographica Section E, 2005, 61, m849-m851 |
| 2205731 | CIF HKL Paper | C23 H23 F O8 | C 1 2 1 | 19.1786; 7.7058; 14.0757 90; 92.373; 90 | 2078.41 | Zhou, Feng-Yan; Jian, Shan-Zhong; He, Xue-Ying; Wang, Yan-Guang (5<i>R</i>,5a<i>R</i>,8a<i>R</i>,9<i>S</i>)-5-(3,4-dihydroxy-5-methoxyphenyl)-9-fluoro-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-<i>d</i>]-1,3-dioxol-6(5a<i>H</i>)-one acetone solvate Acta Crystallographica Section E, 2005, 61, o1374-o1376 |
| 2205861 | CIF HKL Paper | C15 H13 N O | C 1 2 1 | 54.925; 5.8189; 21.628 90; 98.14; 90 | 6843 | Basavegowda Nagaraj; Hemmige S. Yathirajan; Daniel E. Lynch 10-Methoxy-5<i>H</i>-dibenz[<i>b</i>,<i>f</i>]azepine Acta Crystallographica Section E, 2005, 61, o1757-o1759 |
| 2205973 | CIF HKL Paper | C16 H30 N2 O4 | C 1 2 1 | 18.856; 9.311; 5.183 90; 101.04; 90 | 893.1 | Light, Mark E.; Andrea Ragusa; Jeremy D. Kilburn (1<i>R</i>*,2<i>R</i>*)-Di-<i>tert</i>-butyl <i>N</i>,<i>N</i>'-(cyclohexane-1,2-diyl)dicarbamate Acta Crystallographica Section E, 2005, 61, o1956-o1958 |
| 2206009 | CIF HKL Paper | C20 H20 N4 O4 | C 1 2 1 | 52.275; 5.3605; 14.0209 90; 104.952; 90 | 3795.9 | Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L. (1<i>R</i>,2<i>R</i>)-<i>N,N</i>'-Bis(4-nitrophenylmethylene)cyclohexane-1,2-diamine Acta Crystallographica Section E, 2005, 61, o1699-o1701 |
| 2206447 | CIF HKL Paper | C36 H30 Se Si2 | C 1 2 1 | 18.159; 7.8122; 21.777 90; 106.724; 90 | 2958.7 | Medina, Iliana; Mague, Joel T.; Donahue, James P.; Fink, Mark J. Bis(triphenylsilyl)selenide Acta Crystallographica Section E, 2005, 61, o2687-o2688 |
| 2206619 | CIF HKL Paper | C12 H6 Br4 O2 | C 1 2 1 | 23.4583; 3.8928; 7.5495 90; 108.376; 90 | 654.25 | Lehmler, H.-J.; Parkin, S. 3,3',5,5'-Tetrabromo-4,4'-dihydroxybiphenyl Acta Crystallographica Section E, 2005, 61, o2828-o2830 |
| 2207177 | CIF HKL Paper | C6 H11 N O4 | C 1 2 1 | 10.286; 4.6163; 17.111 90; 104.995; 90 | 784.8 | Wu, Yong-Fei; Li, Fen-Fang; Jin, Long-Fei 5-Methyl <small>L</small>-glutamate Acta Crystallographica Section E, 2005, 61, o3752-o3753 |
| 2207228 | CIF HKL Paper | C10 H24 N2 Ni O6 | C 1 2 1 | 9.863; 6.458; 13.007 90; 111.199; 90 | 772.4 | Bian, He-Dong; Zhang, Xiu-Qing; Yang, Xiao-E; Yu, Qing; Liang, Hong Diaquabis(<small>D</small>-valinato-κ^2^<i>N</i>,<i>O</i>)nickel(II) Acta Crystallographica Section E, 2005, 61, m2237-m2239 |
| 2207449 | CIF HKL Paper | C6 H16.2 Cu N2 O8.1 | C 1 2 1 | 7.5866; 8.5684; 8.8257 90; 102.77; 90 | 559.52 | Otavio Versiane; Judith Felcman; Jussara Lopes de Miranda; R. Alan Howie; Janet M. S. Skakle Diaquabis(<small>L</small>-serinato)copper(II) 0.1-hydrate at 120K Acta Crystallographica Section E, 2005, 61, m2517-m2519 |
| 2207621 | CIF HKL Paper | C5 H8 O5 | C 1 2 1 | 22.699; 4.1854; 6.9782 90; 100.415; 90 | 652 | He, Xiangjiu; Lobkovsky, Emil; Liu, Rui Hai (<i>R</i>*)-Methyl 3-carboxy-2-hydroxypropanoate Acta Crystallographica Section E, 2005, 61, o4104-o4106 |
| 4000539 | CIF | C10 H8 Ag2 N2 O6 S2 | C 1 2 1 | 15.089; 5.4096; 8.0336 90; 93.31; 90 | 654.7 | Chemistry of Materials, 2005 |
| 4020043 | CIF | C14 H17 N O3 | C 1 2 1 | 9.741; 4.787; 27.44 90; 97.63; 90 | 1268 | Azusa Sato; Hisanaka Ito; Takeo Taguchi Journal of Organic Chemistry, 2005, 70, 709-712 |
| 4020069 | CIF | C52 H42 N2 O4.5 | C 1 2 1 | 19.55; 14.449; 14.925 90; 96.767; 90 | 4186.7 | Hyuma Masu; Masaki Sakai; Keiki Kishikawa; Makoto Yamamoto; Kentaro Yamaguchi; Shigeo Kohmoto Journal of Organic Chemistry, 2005, 70, 1423-1431 |
| 4020078 | CIF | C13 H17 F O2 | C 1 2 1 | 17.069; 5.886; 12.681 90; 102.407; 90 | 1244.3 | Alice E. Lurain; Patrick J. Carroll; Patrick J. Walsh Journal of Organic Chemistry, 2005, 70, 1262-1268 |
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