Crystallography Open Database

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1000091 CIFCa2.028 F7 Lu0.972I 4/m8.6633; 8.6633; 16.5252
90; 90; 90		1240.3Laval, J P; Abaouz, A; Frit, B; Le Bail, A
Short-range order in the anion-excess fluorite-related Ca~0.68~Ln~0.32~F~2.32~ solid solutions: EXAFS study of the Ln^3+^ environment
Journal of Solid State Chemistry, 1990, 85, 133-143
1001529 CIFNb9 O25 PI 4/m15.639; 15.639; 3.8317
90; 90; 90		937.2Benabbas, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B
Redetermination of the structure of PNb~9~O~25~
Acta Crystallographica C (39,1983-), 1991, 47, 849-850
1001810 CIFBa6.3 Mn24 O48I 4/m18.17299; 18.17299; 2.836
90; 90; 90		936.6Boullay, Ph; Hervieu, M; Raveau, B
A new manganite with an original composite tunnel structure: Ba6 Mn24 O48
Journal of Solid State Chemistry, 1997, 132, 239-248
1004080 CIFK2 O16 Ru8I 4/m9.866; 9.866; 3.131
90; 90; 90		304.8Djafri, F; Canonne, J; Abraham, F; Thomas, D
Insertion de lithium dans la phase de structure Hollandite: K~x~ Ru~8~ O~16~ (x=1.5)
Journal of the Less-Common Metals, 1985, 109, 323-329
1004104 CIFBi1.62 O16 V8I 4/m9.93; 9.93; 2.914
90; 90; 90		287.3Abraham, F; Mentre, O
Bi~1.7~V~8~O~16~ The first Bi-hollandite-type compound
Journal of Solid State Chemistry, 1994, 109, 127-133
1008322 CIFK1.33 Mn8 O16I 4/m9.866; 9.866; 2.872
90; 90; 90		279.6Vicat, J; Fanchon, E; Strobel, P; Tran Qui, D
The Structure of K~1.33~ Mn~8~ O~16~ and Cation Ordering in Hollandite- Type Structures
Acta Crystallographica B (39,1983-), 1986, 42, 162-167
1008514 CIFCs1.1 O16 Ti8I 4/m10.317; 10.317; 2.98
90; 90; 90		317.2Fanchon, E; Hodeau, J L; Vicat, J; Watts, J A
Three-dimensional/one-dimensional transition in the Cs^+^ sublattice of the mixed valence CsTi~8~O~1~6 hollandite: structures at 297 and 673K
Journal of Solid State Chemistry, 1991, 92, 88-100
1101180 CIFC4.5 H10 O3.5 P V0.5I 4/m8.9297; 8.9297; 34.847
90; 90; 90		2778.6Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J.; Zubieta, Jon
Structural Diversity of the Oxovanadium Organodiphosphonate System: A Platform for the Design of Void Channels
Inorganic Chemistry, 2006, 45, 3224-3239
1508122 CIFC192 H96 Cu24 O144I 4/m25.8693; 25.8693; 39.125
90; 90; 90		26183Li, Jian-Rong; Zhou, Hong-Cai
Bridging-ligand-substitution strategy for the preparation of metal-organic polyhedra.
Nature chemistry, 2010, 2, 893-898
1508123 CIFC192 H72 Cu24 O192 S24I 4/m29.044; 29.044; 41.72
90; 90; 90		35193Li, Jian-Rong; Zhou, Hong-Cai
Bridging-ligand-substitution strategy for the preparation of metal-organic polyhedra.
Nature chemistry, 2010, 2, 893-898
1509613 CIFAg1.8 Mn8 O16I 4/m9.725; 9.725; 2.885
90; 90; 90		272.851Chang, F.M.; Jansen, M.
Ag1.8 Mn8 O16: quadratisch-planar koordinierte Ag(+) - Ionen in den Kanaelen einer neuartigen Hollanditvariante
Angewandte Chemie (German Edition), 1984, 96, 902-903
1510539 CIFAu4 HoI 4/m6.6534; 6.6534; 4.174
90; 90; 90		184.774Palenzona, A.; Gschneidner, K.A.jr.; Bruzzone, G.; McMasters, O.D.
Stoichiometry, crystal structure and some melting points of the lanthanide-gold alloys
Journal of the Less-Common Metals, 1971, 25, 135-160
1510541 CIFAu4 YbI 4/m6.628; 6.628; 4.128
90; 90; 90		181.345Iandelli, A.; Palenzona, A.
The yttrium-gold system
Journal of the Less-Common Metals, 1969, 18, 221-227
1511446 CIFB Ba2 Cl17 Zr6I 4/m11.4735; 11.4735; 9.8812
90; 90; 90		1300.77Corbett, J.D.; Zhang, J.
Synthesis and Structure of Ba2 Zr6 Cl17 B, The Missing Link in Cluster Stoichiometries and Structures
Journal of the Less-Common Metals, 1989, 156, 49-58
1513656 CIFC10.5 H7.5 Cl0.75 N0.75 O17.88 V3I 4/m21.1256; 21.1256; 27.4118
90; 90; 90		12233.6Zhang, Zhenjie; Wojtas, Lukasz; Zaworotko, Michael J.
Organic‒inorganic hybrid polyhedra that can serve as supermolecular building blocks
Chemical Science, 2014, 5, 927
1513660 CIFC88 H56 Cl6 N8 O139 V26.2I 4/m21.1683; 21.1683; 27.3991
90; 90; 90		12277.5Zhang, Zhenjie; Wojtas, Lukasz; Zaworotko, Michael J.
Organic‒inorganic hybrid polyhedra that can serve as supermolecular building blocks
Chemical Science, 2014, 5, 927
1514025 CIFLi0.24 Mn O2.12I 4/m9.993; 9.993; 2.853
90; 90; 90		284.9Kijima, N.; Takahashi, Y.; Akimoto, J.; Awaka, J.
Lithium ion insertion and extraction reactions with Hollandite-type manganese dioxide free from any stabilizing cations in its tunnel cavity
Journal of Solid State Chemistry, 2005, 178, 2741-2750
1514116 CIFMn0.98 O2I 4/m9.7876; 9.7876; 2.865
90; 90; 90		274.459Rossouw, M. H.; Liles, D. C.; Thackeray, M. M.; David, W. I. F.; Hull, S.
Alpha manganese dioxide for lithium batteries: a structural and electrochemical study
Materials Research Bulletin, 1992, 27, 221-230
1514430 CIFC66 H111 Cu3 N19 O35I 4/m30.926; 30.926; 45.103
90; 90; 90		43137Yan, Yong; Suyetin, Mikhail; Bichoutskaia, Elena; Blake, Alexander J.; Allan, David R.; Barnett, Sarah A.; Schröder, Martin
Modulating the packing of [Cu24(isophthalate)24] cuboctahedra in a triazole-containing metal‒organic polyhedral framework
Chemical Science, 2013, 4, 1731
1515541 CIFFe15.631 K8.622 Se20I 4/m8.7653; 8.7653; 13.8811
90; 90; 90		1066.49Bacsa, J.; Ganin, A. Y.; Takabayashi, Y.; Christensen, K. E.; Prassides, K.; Rosseinsky, M. J.; Claridge, J. B.
Cation vacancy order in the K0.8+xFe1.6−ySe2 system: Five-fold cell expansion accommodates 20% tetrahedral vacancies
Chemical Science, 2011, 2, 1054
1515542 CIFFe15.29 K9.223 Se20I 4/m8.7788; 8.7788; 13.8604
90; 90; 90		1068.18Bacsa, J.; Ganin, A. Y.; Takabayashi, Y.; Christensen, K. E.; Prassides, K.; Rosseinsky, M. J.; Claridge, J. B.
Cation vacancy order in the K0.8+xFe1.6−ySe2 system: Five-fold cell expansion accommodates 20% tetrahedral vacancies
Chemical Science, 2011, 2, 1054
1516308 CIFC7 H14 F N O20 Si10I 4/m9.1454; 9.1454; 13.3651
90; 90; 90		1117.83Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1516309 CIFC7 H14 F N O20 Si10I 4/m9.1827; 9.1827; 13.3572
90; 90; 90		1126.31Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1516310 CIFC7 H14 F N O20 Si10I 4/m9.1666; 9.1666; 13.3662
90; 90; 90		1123.12Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1516311 CIFC7 H14 F N O20 Si10I 4/m9.154; 9.154; 13.3636
90; 90; 90		1119.81Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1516312 CIFC7 H14 F N O20 Si10I 4/m9.1379; 9.1379; 13.3657
90; 90; 90		1116.05Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1516313 CIFC7 H14 F N O20 Si10I 4/m9.1695; 9.1695; 13.344
90; 90; 90		1122Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1517712 CIFC29 H20 O4 P2 Ru2I 4/m15.571; 15.571; 12.103
90; 90; 90		2934Yomaira Otero; Alejandro Arce; Ysaura De Sanctis; Ruben Machado; Maria C. Goite; Teresa Gonzalez; Alexander Briceno
High versatility of 3,4-dimethyl-1-phenyl-phosphole and 3-methyl-1-phenyl-phosphole as ligands in the reaction with [Re2(CO)8(CH3CN)2] and [Ru3(CO)12]: X-ray structures of [Re2(CO)7(n1:n2:n2-PhPC4H2Me2)], [Re2(CO)7(n1:n2:n2-PhPC4H3Me)] and [Ru2(CO)4(PhPC4H3Me)2]
Inorganica Chimica Acta, 2013, 404, 77-81
1518887 CIFC336 H396 Cl12 N12 O108 Ru24I 4/m29.682; 29.682; 41.882
90; 90; 90		36899Mark D. Young; Qiang Zhang; Hong-Cai Zhou
Metal-organic polyhedra constructed from dinuclear ruthenium paddlewheels
Inorganica Chimica Acta, 2015, 424, 216-220
1519033 CIFAl F5 YbI 4/m13.803; 13.803; 7.013
90; 90; 90		1336.1Kohler, J.
Syntheses and structures of novel complex Yb(II) fluorides : YBeF4, YAlF5 and LiYbAlF6
Solid State Sciences, 1999, 1, 545-553
1519037 CIFNb5 Ni4 P4I 4/m9.9304; 9.9304; 3.5243
90; 90; 90		347.54Charki, F.; Deputier, S.; Benard-Rocherulle, P.; Guerin, R.; Bouayed, M.; Le Beuze, A.; Saillard, J. Y.
An example of the coexistence of octahedral with tetrahedral metal clusters : the ternary phosphide Ni4Nb5P4. Structural and theoretical analyses
Solid State Sciences, 1999, 1, 607-622
1520769 CIFC2 D4 O6 SrI 4/m12.7827; 12.7827; 7.505
90; 90; 90		1226.3Christensen, A. Norlund; Hazell, R. G.
Thermal Analysis and Crystal Structure of Tetragonal Strontium Oxalate Dihydrate and of Triclinic Strontium Oxalate Hydrate
Acta Chemica Scandinavica, 1998, 52, 508-512
1520895 CIFNd16 O17 S17 Ti5I 4/m22.153; 22.153; 3.9426
90; 90; 90		1934.85Boyer-Candalen, C.; Deudon, C.; Meerschaut, A.
Synthesis and structure determination of Nd16 Ti5 S17 O17
Journal of Solid State Chemistry, 2000, 152, 554-559
1521176 CIFBa La Mg O6 RuI 4/m5.623; 5.623; 7.964
90; 90; 90		251.807Hong, K.-P.; Choi, Y.-H.; Jung, D.-Y.; Kwon, Y.-U.; Lee, J.-S.; Lee, C.-H.; Shim, H.-S.
Atomic and magnetic long-range orderings in Ba La M Ru O6 (M = Mg and Zn)
Journal of Solid State Chemistry, 2000, 150, 383-390
1521177 CIFBa La O6 Ru ZnI 4/m5.6521; 5.6521; 7.9987
90; 90; 90		255.528Hong, K.-P.; Choi, Y.-H.; Jung, D.-Y.; Kwon, Y.-U.; Shim, H.-S.; Lee, J.-S.; Lee, C.-H.
Atomic and magnetic long-range orderings in Ba La M Ru O6 (M = Mg and Zn)
Journal of Solid State Chemistry, 2000, 150, 383-390
1521256 CIFBa2 Cu O6 WI 4/m5.5642; 5.5642; 8.6363
90; 90; 90		267.383Iwanaga, D.; Itoh, M.; Inaguma, Y.
Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)
Journal of Solid State Chemistry, 1999, 147, 291-295
1521258 CIFCu O6 Sr2 WI 4/m5.429; 5.429; 8.4155
90; 90; 90		248.039Iwanaga, D.; Inaguma, Y.; Itoh, M.
Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)
Journal of Solid State Chemistry, 1999, 147, 291-295
1521260 CIFCu O6 Sr2 TeI 4/m5.4308; 5.4308; 8.4664
90; 90; 90		249.705Iwanaga, D.; Inaguma, Y.; Itoh, M.
Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)
Journal of Solid State Chemistry, 1999, 147, 291-295
1521262 CIFBa2 Cu O6 TeI 4/m5.5903; 5.5903; 8.6426
90; 90; 90		270.094Iwanaga, D.; Itoh, M.; Inaguma, Y.
Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)
Journal of Solid State Chemistry, 1999, 147, 291-295
1521303 CIFBa9 Br34 O Pr6I 4/m11.9515; 11.9515; 22.8949
90; 90; 90		3270.27Masselmann, S.; Meyer, G.
Die Polyeder-Cluster ((M6 Z) Br36) in den bromiden Ba8 ((M6 Z) Br32) und Ba9 ((M6 Z) Br34)
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1999, 625, 1-2
1521333 CIFBa1.08 Fe O16 Ti7I 4/m10.219; 10.219; 2.963
90; 90; 90		309.42Mitchell, R.H.; Yakovenchuk, V.N.; Chakhmouradian, A.R.; Burns, P.C.; Pakhomovskii, Ya.A.
Henrymeyerite, a new hollandite-type Ba-Fe titanate from the Kovdorcomplex, Russia
Canadian Mineralogist, 2000, 38, 617-626
1521345 CIFAl3 Cl Na4 O24 Si9I 4/m12.0671; 12.0671; 7.5535
90; 90; 90		1099.9Kabalov, Yu.K.; Sokolova, E.V.; Kalygina, N.V.; Schneider, J.
Changes in the crystal structure of marialite during heating
Kristallografiya, 1999, 44, 1049-1053
1521354 CIFAl6 B4 Cu2 O17I 4/m10.57945; 10.57945; 5.67357
90; 90; 90		635.013Kaduk, J.A.; McKenna, S.T.; Satek, L.C.
Crystal structures of metal aluminium borates
The Rigaku Journal, 1999, 16, 17-30
1521666 CIFC30 H64 Mn N8 O4 Re6 S8I 4/m13.255; 13.255; 14.432
90; 90; 90		2535.63Naumov, N.G.; Artemkina, S.B.; Virovets, A.V.; Fedorov, V.E.
Facile transformation of isolated fragments to infinite chains in rhenium chalcocyanide clusters: synthesis and structure of (Pr4 N)2 M (H2 O)5 (Re6 X8 (C N)6) . (H2 O) and (Pr4 N)2 M (H2 O)4 (Re6 S8 (C N)6) (X = S, Se; M = Mn, Ni)
Journal of Solid State Chemistry, 2000, 153, 195-204
1521668 CIFC30 H64 N8 Ni O4 Re6 S8I 4/m13.247; 13.247; 14.246
90; 90; 90		2499.93Naumov, N.G.; Artemkina, S.B.; Virovets, A.V.; Fedorov, V.E.
Facile transformation of isolated fragments to infinite chains in rhenium chalcocyanide clusters: synthesis and structure of (Pr4 N)2 M (H2 O)5 (Re6 X8 (C N)6) . (H2 O) and (Pr4 N)2 M (H2 O)4 (Re6 S8 (C N)6) (X = S, Se; M = Mn, Ni)
Journal of Solid State Chemistry, 2000, 153, 195-204
1521916 CIFAl4.9 Ca2.82 Cl0.19 K0.2 Na1.17 O24 Si7.1I 4/m12.1476; 12.1476; 7.5636
90; 90; 90		1116.12Sherriff, B.L.; Jaeger, C.; Sokolova, E.V.; Schneider, J.; Jenkins, D.M.; Goetz, S.; Kabalov, Yu.K.; Kunath-Fandrei, G.
Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series
Canadian Mineralogist, 2000, 38, 1201-1213
1521917 CIFAl5.2 Ca2.86 Cl0.02 K0.01 Na0.78 O24 S0.32 Si6.8I 4/m12.1637; 12.1637; 7.5739
90; 90; 90		1120.6Sherriff, B.L.; Kabalov, Yu.K.; Sokolova, E.V.; Jenkins, D.M.; Kunath-Fandrei, G.; Goetz, S.; Jaeger, C.; Schneider, J.
Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series
Canadian Mineralogist, 2000, 38, 1201-1213
1521918 CIFAl5.9 Ca3.84 Cl0.02 K0.02 Na0.05 O24 S0.03 Si6.1I 4/m12.1969; 12.1969; 7.5763
90; 90; 90		1127.08Sherriff, B.L.; Sokolova, E.V.; Kabalov, Yu.K.; Jenkins, D.M.; Jaeger, C.; Goetz, S.; Kunath-Fandrei, G.; Schneider, J.
Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series
Canadian Mineralogist, 2000, 38, 1201-1213
1521919 CIFAl6 Ca4 O24 Si6I 4/m12.2119; 12.2119; 7.5811
90; 90; 90		1130.57Sherriff, B.L.; Sokolova, E.V.; Kabalov, Yu.K.; Schneider, J.; Jenkins, D.M.; Kunath-Fandrei, G.; Goetz, S.; Jaeger, C.
Meionite: Rietveld structure-refinement, (29)Si MAS and (27)Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series
Canadian Mineralogist, 2000, 38, 1201-1213
1522144 CIFBi14 Cr O24I 4/m8.684; 8.684; 17.238
90; 90; 90		1299.95Warda, S.A.; Kesper, U.; Pietzuch, W.; Massa, W.; Reinen, D.
Color and constitution of Cr(VI)-doped Bi2 O3 phases: the structure of Bi14 Cr O24
Journal of Solid State Chemistry, 2000, 149, 209-217

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