Crystallography Open Database
Search results
Result: there are 771 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching space group like 'P a -3'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2007667 | CIF HKL Paper | N2 O6 Sr | P a -3 | 7.822; 7.822; 7.822 90; 90; 90 | 478.58 | El-Bali, Brahim; Bolte, Michael Sr(NO~3~)~2~ at 173K Acta Crystallographica Section C, 1998, 54, IUC9800046 |
| 2008541 | CIF HKL Paper | C27 H36 Cl4 Fe2 N6 | P a -3 | 18.793; 18.793; 18.793 90; 90; 90 | 6637.3 | Alcock, Nathaniel W.; Zhang, Delong; Busch, Daryle H. Tris(2-pyridylmethyl)triazacyclododecane complexes of Fe^II^ and Cu^II^ Acta Crystallographica Section C, 1999, 55, 886-889 |
| 2008723 | CIF Paper | C33 H33 N3 O3 | P a -3 | 17.862; 17.862; 17.862 90; 90; 90 | 5698.9 | Herbstein, Frank H. <i>N</i>,<i>N</i>',<i>N</i>''-Trimethyl-<i>N</i>,<i>N</i>',<i>N</i>''-tris(3-methylphenyl)-1,3,5-benzenetricarboxamide is cubic (space group <i>Pa</i>øverline{3}) and not orthorhombic (space group <i>Pbca</i>). Erratum Acta Crystallographica Section C, 1999, 55, 1196 |
| 2009711 | CIF Paper | C18 H15 As I2 | P a -3 | 15.448; 15.448; 15.448 90; 90; 90 | 3686.5 | Abbas, S.; Godfrey, S.M.; McAuliffe, C.A.; Pritchard, R.G. A cubic modification of (triphenylarsine)diiodine Acta Crystallographica Section C, 1994, 50, 717-719 |
| 2009888 | CIF Paper | C85 H78 Cl3 F9 O9 P6 Rh2 S3 | P a -3 | 26.43; 26.43; 26.43 90; 90; 90 | 18463 | Bachechi, Fiorella A tri-μ-chloro dirhodium (III) complex [Rh~2~(μ-Cl)~3~(triphos)~2~](CF~3~SO~3~)~3~ [triphos = CH~3~C(CH~2~PPh~2~)~3~] Acta Crystallographica Section C, 1994, 50, 1069-1072 |
| 2010226 | CIF Paper | C H N3 O6 | P a -3 | 10.358; 10.358; 10.358 90; 90; 90 | 1111.29 | Schodel, H.; Dienelt, R.; Bock, H. Trinitromethane Acta Crystallographica Section C, 1994, 50, 1790-1792 |
| 2010607 | CIF HKL Paper | C16 H32 Cd3 N12 O S6 | P a -3 | 15.0766; 15.0766; 15.0766 90; 90; 90 | 3427 | Mostafa, Golam; Mondal, Arunendu; Laskar, Inamur R.; Welch, A. J.; Chaudhuri, N. Ray A three-dimensional network of cadmium Acta Crystallographica Section C, 2000, 56, 146-148 |
| 2011079 | CIF HKL Paper | Cr H24 O20 Rb S2 | P a -3 | 12.296; 12.296; 12.296 90; 90; 90 | 1859.1 | Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N. The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K Acta Crystallographica Section C, 2000, 56, 731-734 |
| 2011080 | CIF HKL Paper | Cr H24 O20 Rb S2 | P a -3 | 12.241; 12.241; 12.241 90; 90; 90 | 1834.2 | Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N. The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K Acta Crystallographica Section C, 2000, 56, 731-734 |
| 2011081 | CIF HKL Paper | Cr Cs H24 O20 Se2 | P a -3 | 12.585; 12.585; 12.585 90; 90; 90 | 1993.2 | Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N. The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K Acta Crystallographica Section C, 2000, 56, 731-734 |
| 2011082 | CIF HKL Paper | Cr Cs H24 O20 Se2 | P a -3 | 12.522; 12.522; 12.522 90; 90; 90 | 1963.5 | Figgis, Brian N.; Reynolds, Philip A.; Sobolev, Alexandre N. The structures of the α-alums RbCr(SO~4~)~2~·12H~2~O and CsCr(SeO~4~)~2~·12H~2~O at 293 and 12K Acta Crystallographica Section C, 2000, 56, 731-734 |
| 2011792 | CIF Paper | O7 P2 Ti | P a -3 | 23.534; 23.534; 23.534 90; 90; 90 | 13034.3 | Norberg, Stefan T.; Svennson, Göran; Albertsson, Jörgen A TiP~2~O~7~ superstructure Acta Crystallographica Section C, 2001, 57, 225-227 |
| 2011815 | CIF HKL Paper | C12 H27 P Se | P a -3 | 14.4773; 14.4773; 14.4773 90; 90; 90 | 3034.3 | Steinberger, Hans-Uwe; Ziemer, Burkhard; Meisel, Manfred Tris(<i>tert</i>-butyl)phosphine selenide, the missing link in tris(<i>tert</i>-butyl)phosphine chalcogenide structures ^<i>t^</i>Bu~3~P=<i>X</i> (<i>X</i> = O, S, Se, Te) Acta Crystallographica Section C, 2001, 57, 323-324 |
| 2012064 | CIF HKL Paper | C12 H27 P S | P a -3 | 14.232; 14.232; 14.232 90; 90; 90 | 2883 | Steinberger, Hans-Uwe; Ziemer, Burkhard; Meisel, Manfred Tris(<i>tert</i>-butyl)phosphine sulfide, a phosphine sulfide with three bulky substituents Acta Crystallographica Section C, 2001, 57, 835-837 |
| 2014623 | CIF HKL Paper | C72 H66 Cl3 Fe N6 S6 | P a -3 | 18.8566; 18.8566; 18.8566 90; 90; 90 | 6704.9 | Dale, Sophie H.; Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F. The effect of hydrogen-bonding anions on the structure of metal‒sulfimide complexes Acta Crystallographica Section C, 2005, 61, m34-m39 |
| 2015225 | CIF Paper | C20 H22 B2 Cl6 Mg N12 | P a -3 | 14.3475; 14.3475; 14.3475 90; 90; 90 | 2953.4 | María Gabriela-Ballinas-López; Itzia I. Padilla-Martínez; Francisco J. Martínez-Martínez; Herbert Höpfl; Efrén V. García-Báez Facial π···Cl···π interactions as the directing motif of the supramolecular structures of Mg^2+^ and Ca^2+^ bis[hydrotris(pyrazolyl)borate] chloroform disolvates Acta Crystallographica Section C, 2006, 62, m132-m135 |
| 2015226 | CIF Paper | C20 H22 B2 Ca Cl6 N12 | P a -3 | 14.6697; 14.6697; 14.6697 90; 90; 90 | 3156.9 | María Gabriela-Ballinas-López; Itzia I. Padilla-Martínez; Francisco J. Martínez-Martínez; Herbert Höpfl; Efrén V. García-Báez Facial π···Cl···π interactions as the directing motif of the supramolecular structures of Mg^2+^ and Ca^2+^ bis[hydrotris(pyrazolyl)borate] chloroform disolvates Acta Crystallographica Section C, 2006, 62, m132-m135 |
| 2015402 | CIF HKL Paper | As F12 I | P a -3 | 9.409; 9.409; 9.409 90; 90; 90 | 833 | Evgeny Goreshnik; Zoran Mazej Hexafluoroiodium(VII) hexafluoroarsenate Acta Crystallographica Section C, 2006, 62, i59-i60 |
| 2017322 | CIF Paper | O7.9 V0.2 W1.8 Zr | P a -3 | 9.11787; 9.11787; 9.11787 90; 90; 90 | 758.019 | Chen, Xi; Tao, Juzhou; Ma, Hui; Zhao, Xinhua Disordered structure of ZrW~1.8~V~0.2~O~7.9~ from a combined X-ray and neutron powder diffraction study at 530 K Acta Crystallographica Section C, 2009, 65, i74-i76 |
| 2017431 | CIF HKL Paper | B12 H26 K2 Ni10 O72 P12 | P a -3 | 13.467; 13.467; 13.467 90; 90; 90 | 2442.4 | Yakubovich, Olga V.; Steele, Ian M.; Massa, Werner; Dimitrova, Olga V. 12-Membered borophosphate rings in KNi~5~[P~6~B~6~O~23~(OH)~13~] Acta Crystallographica Section C, 2009, 65, i94-i98 |
| 2018267 | CIF HKL Paper | C6 H21 B6 Co N3 O13 | P a -3 | 15.2796; 15.2796; 15.2796 90; 90; 90 | 3567.3 | Lan, Shao-Min; Di, Wen-Jing; Shao, Zhi-Dong; Liang, Yun-Xiao Two new transition metal inorganic‒organic hybrid borates: [tris(2-aminoethoxy)trihydroxyhexaborato]cobalt(II) and its nickel(II) analogue Acta Crystallographica Section C, 2011, 67, m338-m341 |
| 2018268 | CIF HKL Paper | C6 H21 B6 N3 Ni O13 | P a -3 | 15.2217; 15.2217; 15.2217 90; 90; 90 | 3526.9 | Lan, Shao-Min; Di, Wen-Jing; Shao, Zhi-Dong; Liang, Yun-Xiao Two new transition metal inorganic‒organic hybrid borates: [tris(2-aminoethoxy)trihydroxyhexaborato]cobalt(II) and its nickel(II) analogue Acta Crystallographica Section C, 2011, 67, m338-m341 |
| 2020196 | CIF | Ca1.15 Ge3 Na3.7 O9 | P a -3 | 15.626; 15.626; 15.626 90; 90; 90 | 3815.43 | Nishi, F.; Takeuchi, Y. Cubic structure of sodium calcium germanate Na3.7 Ca1.15 Ge3 O9 Acta Crystallographica C (39,1983-), 1988, 44, 1867-1869 |
| 2020626 | CIF Paper | C66 H79 B Hf N6 S3 | P a -3 | 23.1441; 23.1441; 23.1441 90; 90; 90 | 12397.1 | Rong, Yi; Sambade, David; Parkin, Gerard Molecular structures of tris(1-<i>tert</i>-butyl-2-mercaptoimidazolyl)hydroborate complexes of titanium, zirconium and hafnium Acta Crystallographica Section C, 2016, 72, 806-812 |
| 2020790 | CIF HKL Paper | C3 H18 F6 N9 V | P a -3 | 14.095; 14.095; 14.095 90; 90; 90 | 2800.2 | Black, Cameron; Lightfoot, Philip Crystal structure of guanidinium hexafluoridovanadate(III), (CN~3~H~6~)~3~[VF~6~]: an unusual hybrid compound related to perovskite Acta Crystallographica Section C, 2017, 73, 244-246 |
| 2020879 | CIF HKL Paper | C36 H75 Cl2 Fe7 N6 O26 | P a -3 | 22.0884; 22.0884; 22.0884 90; 90; 90 | 10776.9 | van der Horn, Jitschaq A.; Lutz, Martin Triethanolaminate iron perchlorate revisited: change of space group, chemical composition and oxidation states in [Fe~7~(tea)~3~(tea-H)~3~](ClO~4~)~2~ (tea-H~3~ is triethanolamine) Acta Crystallographica Section C, 2018, 74 |
| 2020897 | CIF | N2 O6 Pb | P a -3 | 7.8586; 7.8586; 7.8586 90; 90; 90 | 485.33 | Nowotny, H.; Heger, G. Structure refinement of lead nitrate Acta Crystallographica, Section C: Crystal Structure Communications, 1986, 42, 133-135 |
| 2022864 | CIF HKL Paper | N2 Si | P a -3 | 4.1205; 4.1205; 4.1205 90; 90; 90 | 69.96 | Jurzick, Pascal L.; Krach, Georg; Brüning, Lukas; Schnick, Wolfgang; Bykov, Maxim Synthesis and crystal structure of silicon pernitride SiN2 at 140 GPa Acta Crystallographica Section E Crystallographic Communications, 2023, 79 |
| 2100840 | CIF Paper | C2 H2 | P a -3 | 6.094; 6.094; 6.094 90; 90; 90 | 226.31 | McMullan, R. K.; Kvick, Å.; Popelier, P. Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction Acta Crystallographica Section B, 1992, 48, 726-731 |
| 2100841 | CIF Paper | C2 H2 | P a -3 | 6.105; 6.105; 6.105 90; 90; 90 | 227.54 | McMullan, R. K.; Kvick, Å.; Popelier, P. Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction Acta Crystallographica Section B, 1992, 48, 726-731 |
| 2100842 | CIF Paper | C2 D2 | P a -3 | 6.102; 6.102; 6.102 90; 90; 90 | 227.2 | McMullan, R. K.; Kvick, Å.; Popelier, P. Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction Acta Crystallographica Section B, 1992, 48, 726-731 |
| 2102034 | CIF Paper | Al H24 K O20 S2 | P a -3 | 12.135; 12.135; 12.135 90; 90; 90 | 1786.98 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102035 | CIF Paper | Al H24 K O20 S2 | P a -3 | 12.164; 12.164; 12.164 90; 90; 90 | 1799.82 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102036 | CIF Paper | Al H24 O20 S2 Tl | P a -3 | 12.207; 12.207; 12.207 90; 90; 90 | 1818.98 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102037 | CIF Paper | Al H24 O20 S2 Tl | P a -3 | 12.2305; 12.2305; 12.2305 90; 90; 90 | 1829.5 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102038 | CIF Paper | Cr H24 K O20 S2 | P a -3 | 12.2133; 12.2133; 12.2133 90; 90; 90 | 1821.79 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102039 | CIF Paper | Cr H24 K O20 S2 | P a -3 | 12.2305; 12.2305; 12.2305 90; 90; 90 | 1829.5 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102040 | CIF Paper | Ga H24 O20 Rb S2 | P a -3 | 12.2679; 12.2679; 12.2679 90; 90; 90 | 1846.34 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2102041 | CIF Paper | Ga H24 O20 S2 Tl | P a -3 | 12.2368; 12.2368; 12.2368 90; 90; 90 | 1832.33 | Nyburg, Stanley C.; Steed, Jon W.; Aleksovska, Slobotka; Petrusevski, Vladimir M. Structure of the alums. I. On the sulfate group disorder in the α-alums Acta Crystallographica Section B, 2000, 56, 204-209 |
| 2104027 | CIF Paper | Ge O2 | P a -3 | 4.3365; 4.3365; 4.3365 90; 90; 90 | 81.55 | Shiraki, Koichi; Tsuchiya, Taku; Ono, Shigeaki Structural refinements of high-pressure phases in germanium dioxide Acta Crystallographica Section B, 2003, 59, 701-708 |
| 2105369 | CIF | Ag4 N2 O6 Te | P a -3 | 8.173; 8.173; 8.173 90; 90; 90 | 545.939 | Schultze-Rhonhof, E. Die Kristallstruktur von alpha-Tetrasilbertelluriddinitrat Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2837-2840 |
| 2105408 | CIF | B2 Ca O4 | P a -3 | 9.008; 9.008; 9.008 90; 90; 90 | 730.946 | Marezio, M.; Dernier, P.D.; Remeika, J.P. The crystal structure of the high pressure phase, Ca B2 O4 (IV), and polymorphism in Ca B2 O4 Acta Crystallographica B (24,1968-38,1982), 1969, 25, 965-970 |
| 2105706 | CIF Paper | Br4 Si | P a -3 | 11.17701; 11.17701; 11.17701 90; 90; 90 | 1396.29 | Wolf, Alexandra K.; Glinnemann, Jürgen; Schmidt, Martin U.; Tong, Jianwei; Dinnebier, Robert E.; Simon, Arndt; Köhler, Jürgen SiBr4‒ prediction and determination of crystal structures Acta Crystallographica Section B Structural Science, 2009, 65, 342-349 |
| 2106623 | CIF Paper | F5 H12 N3 O2 W | P a -3 | 11.9635; 11.9635; 11.9635 90; 90; 90 | 1712.28 | Udovenko, Anatoly; Laptash, Natalia Crystal structure and phase transition in (NH~4~)~3~WO~2~F~5~: from dynamic to static orientational disorder Acta Crystallographica Section B, 2015, 71, 478-483 |
| 2106653 | CIF HKL Paper | F7 H12 N3 Ti | P a -3 | 11.78316; 11.78316; 11.78316 90; 90; 90 | 1636.01 | Molokeev, Maxim; Misjul, Sergey V.; Flerov, Igor N.; Laptash, Natalia M. Reconstructive phase transition in (NH~4~)~3~TiF~7~ accompained by the ordering TiF~6~ of octahera Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 924-931 |
| 2107239 | CIF | Cr F6 H18 Mn N6 | P a -3 | 10.059; 10.059; 10.059 90; 90; 90 | 1017.8 | Wieghardt, K.; Weiss, J. Die Kristallstrukturen von Hexamminchrom(III) Hexafluoromanganat(III) und Hexamminchrom(III) Hexafluoroferrat(III) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 529-534 |
| 2107240 | CIF | Cr F6 Fe H18 N6 | P a -3 | 10.079; 10.079; 10.079 90; 90; 90 | 1023.89 | Wieghardt, K.; Weiss, J. Die Kristallstrukturen von Hexamminchrom(III) Hexafluoromanganat(III) und Hexamminchrom(III) Hexafluoroferrat(III) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 529-534 |
| 2108033 | CIF HKL Paper | C88 H40 Br2 F12 I12 P2 | P a -3 | 22.3941; 22.3941; 22.3941 90; 90; 90 | 11230.5 | Szell, Patrick M. J.; Gabidullin, Bulat; Bryce, David L. 1,3,5-Tri(iodoethynyl)-2,4,6-trifluorobenzene: halogen-bonded frameworks and NMR spectroscopic analysis Acta Crystallographica Section B, 2017, 73 |
| 2108350 | CIF HKL Paper | F7 H12 N3 Ti | P a -3 | 11.78316; 11.78316; 11.78316 90; 90; 90 | 1636.01 | Molokeev, Maxim; Misjul, Sergey V.; Flerov, Igor N.; Laptash, Natalia M. Reconstructive phase transition in (NH~4~)~3~TiF~7~ accompained by the ordering TiF~6~ of octahera Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 924-931 |
| 2108846 | CIF HKL | Cd432.91 Mg177.41 Y90.4 | P a -3 | 25.0654; 25.0654; 25.0654 90; 90; 90 | 15748 | Yamada, Tsunetomo; Fujita, Nobuhisa; Labib, Farid 2/1 and 1/1 cubic approximants in the ternary <i>R</i>-Cd-Mg (<i>R</i> = Y, Er) systems Acta Crystallographica Section B, 2021, 77 |
| 2200315 | CIF HKL Paper | C24 H48 Cl6 Fe3 O7 | P a -3 | 15.244; 15.244; 15.244 90; 90; 90 | 3542.4 | Bolte, Michael; Lerner, Hans-Wolfram; Scholz, Stefan [Fe(thf)~6~][Cl~3~Fe‒O‒FeCl~3~] Acta Crystallographica Section E, 2001, 57, m216-m217 |
| 2202247 | CIF HKL Paper | C4 H12 Pb | P a -3 | 11.1725; 11.1725; 11.1725 90; 90; 90 | 1394.6 | Holger Fleischer; Simon Parsons; Colin R. Pulham Tetramethyllead(IV) at 150K Acta Crystallographica Section E, 2003, 59, m11-m13 |
| 2203958 | CIF Paper | Cr H28 N O20 S2 | P a -3 | 12.2491; 12.2491; 12.2491 90; 90; 90 | 1837.9 | Rempfer, Nora; Lerner, Hans-Wolfram; Bolte, Michael The ammonium chromium(III) alum NH~4~Cr(SO~4~)~2~.12H~2~O Acta Crystallographica, Section E, 2004, 60, i80-i81 |
| 2205949 | CIF HKL Paper | C15 H21 Mn Na O6 | P a -3 | 22.075; 22.075; 22.075 90; 90; 90 | 10757 | Saha, Amrita; Musie, Ghezai; Powell, Douglas R. Sodium tris(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')manganese(II) Acta Crystallographica Section E, 2005, 61, m1144-m1146 |
| 2215685 | CIF HKL Paper | Cl2 H6 N2 | P a -3 | 7.8731; 7.8731; 7.8731 90; 90; 90 | 488.02 | Kruszynski, Rafal; Trzesowska, Agata Redetermination of hydrogenhydrazinium dichloride Acta Crystallographica Section E, 2007, 63, i179-i179 |
| 2232239 | CIF HKL Paper | Ca2.894 N1.76 O4.24 Si2 | P a -3 | 15.0626; 15.0626; 15.0626 90; 90; 90 | 3417.43 | Sharafat, Ali; Berastegui, Pedro; Esmaeilzadeh, Saeid; Eriksson, Lars; Grins, Jekabs A cubic calcium oxynitrido-silicate, Ca~2.89~Si~2~N~1.76~O~4.24~ Acta Crystallographica Section E, 2011, 67, i66 |
| 2239407 | CIF Paper | As2 Br3 Cd4 | P a -3 | 12.625; 12.625; 12.625 90; 90; 90 | 2012.3 | Kars, Mohammed; Roisnel, Thierry; Dorcet, Vincent; Rebbah, Allaoua; Otero-Diáz, L. Carlos Cd~4~As~2~Br~3~ Acta Crystallographica Section E, 2014, 70, i15 |
| 2242573 | CIF HKL | C9 H27 Br Si4 | P a -3 | 15.6497; 15.6497; 15.6497 90; 90; 90 | 3832.8 | Gulotty, Eva M.; Staples, Richard J.; Biros, Shannon M.; Gaspar, Peter P.; Rath, Nigam P.; Winchester, William R. Crystal structures of 2-bromo-1,1,1,3,3,3-hexamethyl-2-(trimethylsilyl)trisilane and 2-bromo-1,1,1,3,3,3-hexaisopropyl-2-(triisopropylsilyl)trisilane Acta Crystallographica Section E, 2018, 74, 1142-1146 |
| 2244159 | CIF HKL Paper | B12 H3 K Mg2 O22 | P a -3 | 12.2966; 12.2966; 12.2966 90; 90; 90 | 1859.32 | Qiu, Qi-Ming; Song, Jian-Biao Crystal structure of MgK~0.5~[B~6~O~10~](OH)~0.5~·0.5H~2~O, poly[dimagnesium potassium bis(hexaborate) hydroxide monohydrate] Acta Crystallographica Section E, 2022, 78, 1003-1005 |
| 2310113 | CIF Paper | Al72.515 Cr4.928 Fe7.853 Pd22.498 | P a -3 | 40.5405; 40.5405; 40.5405 90; 90; 90 | 66629.6 | Fujita, Nobuhisa; Takano, Hikari; Yamamoto, Akiji; Tsai, An-Pang Cluster-packing geometry for Al-based F-type icosahedral alloys Acta Crystallographica Section A, 2013, 69, 322-340 |
| 2310368 | CIF | Al Cs H24 O20 S2 | P a -3 | 12.352; 12.352; 12.352 90; 90; 90 | 1884.57 | Cromer, D.T.; Kay, M.I.; Larson, A.C. Refinement of the alum structures. I. X-ray and neutron diffraction study of Cs Al (S O4)2 * (H2 O)12, a beta Alum Acta Crystallographica (1,1948-23,1967), 1966, 21, 383-389 |
| 2310370 | CIF | Al D28 N O20 S2 | P a -3 | 12.243; 12.243; 12.243 90; 90; 90 | 1835.12 | Cromer, D.T.; Kay, M.I. Refinement of the alum structures IV. Neutron diffraction study of deuterated ammonium alum, N D4 Al (S O4)2 (D2 O)12, an alpha-Alum Acta Crystallographica (1,1948-23,1967), 1967, 22, 800-805 |
| 2310817 | CIF | I4 Sn | P a -3 | 12.26; 12.26; 12.26 90; 90; 90 | 1842.77 | Meller, F.; Fankuchen, I. The crystal structure of tin tetraiodide Acta Crystallographica (1,1948-23,1967), 1955, 8, 343-344 |
| 2310876 | CIF | C4 Ni O4 | P a -3 | 10.84; 10.84; 10.84 90; 90; 90 | 1273.76 | Ladell, J.; Post, B.; Fankuchen, I. The Crystal Structure of Nickel Carbonyl, Ni (C O)4 Acta Crystallographica (1,1948-23,1967), 1952, 5, 795-800 |
| 3000231 | On hold until 2019-09-26 | C26 H35 Br3 N Ni P | P a -3 | 17.7361; 17.7361; 17.7361 90; 90; 90 | 5579.23 | Francois Baril-Robert Nicolas Belanger-Desmarais, Christian Reber To be published |
| 4000095 | CIF | Ga K O14 Te6 | P a -3 | 10.9267; 10.9267; 10.9267 90; 90; 90 | 1304.57 | Ok, Kang Min; Halasyamani, P. Shiv New Tellurites: Syntheses, Structures, and Characterization of K2Te4O9·3.2H2O, KGaTe6O14, and KGaTe2O6·1.8H2O Chemistry of Materials, 2001, 13, 4278-4284 |
| 4003029 | CIF | Ni P2 | P a -3 | 5.4475; 5.4475; 5.4475 90; 90; 90 | 161.656 | Owens-Baird, Bryan; Xu, Junyuan; Petrovykh, Dmitri Y.; Bondarchuk, Oleksandr; Ziouani, Yasmine; González-Ballesteros, Noelia; Yox, Philip; Sapountzi, Foteini M.; Niemantsverdriet, Hans; Kolen’ko, Yury V.; Kovnir, Kirill NiP2: A Story of Two Divergent Polymorphic Multifunctional Materials Chemistry of Materials, 2019, 31, 3407 |
| 4003218 | CIF | C60 H42 N12 O19 Zn4 | P a -3 | 33.9803; 33.9803; 33.9803 90; 90; 90 | 39235.7 | Ju, Zhanfeng; Yan, Shichen; Yuan, Daqiang De Novo Tailoring Pore Morphologies and Sizes for Different Substrates in a Urea-Containing MOFs Catalytic Platform Chemistry of Materials, 2016, 28, 2000 |
| 4021982 | CIF | C39 H45 Br3 O3 | P a -3 | 19.732; 19.732; 19.732 90; 90; 90 | 7683.2 | Mao-Sen Yuan; Qi Fang; Zhi-Qiang Liu; Jian-Ping Guo; Hong-Yu Chen; Wen-Tao Yu; Gang Xue; Dian-Sheng Liu Acceptor or Donor (Diaryl B or N) Substituted Octupolar Truxene: Synthesis, Structure, and Charge-Transfer-Enhanced Fluorescence Journal of Organic Chemistry, 2006, 71, 7858-7861 |
| 4021985 | CIF | C39 H45 I3 O3 | P a -3 | 19.844; 19.844; 19.844 90; 90; 90 | 7814 | Mao-Sen Yuan; Qi Fang; Zhi-Qiang Liu; Jian-Ping Guo; Hong-Yu Chen; Wen-Tao Yu; Gang Xue; Dian-Sheng Liu Acceptor or Donor (Diaryl B or N) Substituted Octupolar Truxene: Synthesis, Structure, and Charge-Transfer-Enhanced Fluorescence Journal of Organic Chemistry, 2006, 71, 7858-7861 |
| 4027818 | CIF | Ag2 As4 Hg7 I6 | P a -3 | 13.1075; 13.1075; 13.1075 90; 90; 90 | 2251.95 | Olenev, A.V.; Vorontsov, I.I.; Baranov, A.I.; Antipin, M.Yu.; Shevelkov, A.V.; Oleneva, O.S. Synthesis, Crystal and Electronic Structure of [Hg7 As4] (Ag I3)2, a Novel Supramolecular Complex with the Off-plane (AgI3)2(2-) Guest Anion. European Journal of Inorganic Chemistry, 2003, 2003, 1053-1057 |
| 4031390 | CIF | Cs H24 O20 S2 V | P a -3 | 12.452; 12.452; 12.452 90; 90; 90 | 1930.71 | Beattie, J.K.; Best, S.P.; Skelton, B.W.; White, A.H. Structural studies on the cesium alums Cs M(III) (S O4)2 (H2 O)12 Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1981, 1981, 2105-2111 |
| 4031391 | CIF | Cr Cs H24 O20 S2 | P a -3 | 12.413; 12.413; 12.413 90; 90; 90 | 1912.63 | Beattie, J.K.; Best, S.P.; Skelton, B.W.; White, A.H. Structural studies on the cesium alums Cs M(III) (S O4)2 (H2 O)12 Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1981, 1981, 2105-2111 |
| 4031392 | CIF | Cs Fe H24 O20 S2 | P a -3 | 12.449; 12.449; 12.449 90; 90; 90 | 1929.32 | Beattie, J.K.; Best, S.P.; Skelton, B.W.; White, A.H. Structural studies of the cesium alums Cs M(III) (S O4)2 (H2 O)12 Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1981, 1981, 2105-2111 |
| 4031393 | CIF | Co Cs H24 O20 S2 | P a -3 | 12.292; 12.292; 12.292 90; 90; 90 | 1857.24 | Beattie, J.K.; Best, S.P.; Skelton, B.W.; White, A.H. Structural studies of the cesium alums Cs M(III) (S O4)2 (H2 O)12 Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1981, 1981, 2105-2111 |
| 4031394 | CIF | Cs Ga H24 O20 S2 | P a -3 | 12.418; 12.418; 12.418 90; 90; 90 | 1914.94 | Beattie, J.K.; Best, S.P.; White, A.H.; Skelton, B.W. Structural studies on the cesium alums Cs M(III) (S O4)2 (H2 O)12 Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1981, 1981, 2105-2111 |
| 4031395 | CIF | Cs H24 In O20 S2 | P a -3 | 12.54; 12.54; 12.54 90; 90; 90 | 1971.94 | Beattie, J.K.; Best, S.P.; Skelton, B.W.; White, A.H. Structural studies on the cesium alums Cs M(III) (S O4)2 (H2 O)12 Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1981, 1981, 2105-2111 |
| 4031584 | CIF | Cs D24 Mo O20 S2 | P a -3 | 12.436; 12.436; 12.436 90; 90; 90 | 1923.28 | Best, S.P.; Forsyth, J.P.; Tregenna-Piggott, P.L. Influence of the stereochemistry of water co-ordination to metall(III) cations on the M-O bond length and electronic structure of the cation Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1993, 1993, 2711-2715 |
| 4031794 | CIF | Cs H24 Ir O20 S2 | P a -3 | 12.395; 12.395; 12.395 90; 90; 90 | 1904.32 | Armstrong, R.S.; Beattie, J.K.; Best, S.P.; Skelton, B.W.; White, A.H. Crystal Structures of the alpha Alums Cs M(S O4)2 * 12 H2 O (M = Rh or Ir) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1983, 1983, 1973-1975 |
| 4031808 | CIF | Mg Te2 | P a -3 | 7.025; 7.025; 7.025 90; 90; 90 | 346.688 | Yanagisawa, S.; Tashiro, M.; Anzai, S. Crystal Structure of Magnesium Ditelluride Journal of Inorganic and Nuclear Chemistry, 1969, 31, 943-946 |
| 4038065 | CIF | C88 H108 B6 O12 | P a -3 | 19.9143; 19.9143; 19.9143 90; 90; 90 | 7897.6 | Nagase, Mai; Kato, Kenta; Yagi, Akiko; Segawa, Yasutomo; Itami, Kenichiro Six-fold C‒H borylation of hexa-peri-hexabenzocoronene Beilstein Journal of Organic Chemistry, 2020, 16, 391-397 |
| 4038951 | CIF | C109 H28 N12 S6 | P a -3 | 18.9035; 18.9035; 18.9035 90; 90; 90 | 6755 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045 |
| 4038952 | CIF | C113 H16 N12 S12 | P a -3 | 19.504; 19.504; 19.504 90; 90; 90 | 7419.4 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045 |
| 4061560 | CIF | C26 H45 P3 Ru | P a -3 | 17.555; 17.555; 17.555 90; 90; 90 | 5410.1 | Organometallics, 2005 |
| 4062043 | CIF | C7 H17 Li O P2 | P a -3 | 19.067; 19.067; 19.067 90; 90; 90 | 6931.7 | Organometallics, 2003 |
| 4062477 | CIF | C21 H15 F3 Ge | P a -3 | 15.2629; 15.2629; 15.2629 90; 90; 90 | 3555.6 | Brisdon, Alan K.; Crossley, Ian R.; Pritchard, Robin G.; Sadiq, Ghazala; Warren, John E. Preparation and Functionalization of a Range of Main-Group Trifluoropropynyl Organometallic Compounds: The Application of Metalloid-Directed Carbolithiation to the Selective Synthesis of Novel Fluorocarbon Fragments. Organometallics, 2003, 22, 5534-5542 |
| 4062478 | CIF | C21 H15 F3 Si | P a -3 | 15.1654; 15.1654; 15.1654 90; 90; 90 | 3487.9 | Brisdon, Alan K.; Crossley, Ian R.; Pritchard, Robin G.; Sadiq, Ghazala; Warren, John E. Preparation and Functionalization of a Range of Main-Group Trifluoropropynyl Organometallic Compounds: The Application of Metalloid-Directed Carbolithiation to the Selective Synthesis of Novel Fluorocarbon Fragments. Organometallics, 2003, 22, 5534-5542 |
| 4063340 | CIF | C258 H330 N18 O6 Sr6 | P a -3 | 28.6787; 28.6787; 28.6787 90; 90; 90 | 23587.3 | Merle Arrowsmith; Michael S. Hill; Gabriele Kociok-Kḧon Dearomatization and C‒H Deprotonation with Heavier Group 2 Alkyls: Does Size Matter? Organometallics, 2010, 29, 4203-4206 |
| 4063341 | CIF | C43 H55 Ba N3 O | P a -3 | 28.7452; 28.7452; 28.7452 90; 90; 90 | 23751.8 | Merle Arrowsmith; Michael S. Hill; Gabriele Kociok-Kḧon Dearomatization and C–H Deprotonation with Heavier Group 2 Alkyls: Does Size Matter? Organometallics, 2010, 29, 4203-4206 |
| 4068182 | CIF | C51 H66 Cr2 N3 P4 | P a -3 | 21.7483; 21.7483; 21.7483 90; 90; 90 | 10286.7 | Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Murugesu, Muralee; Budzelaar, Peter Isolation and Characterization of a Class II Mixed-Valence Chromium(I)/(II) Self-Activating Ethylene Trimerization Catalyst Organometallics, 2012, 31, 486 |
| 4075081 | CIF | C40 H51 Br3 Ge O3 | P a -3 | 19.7087; 19.7087; 19.7087 90; 90; 90 | 7655.5 | Iwanaga, Kohei; Kobayashi, Junji; Kawashima, Takayuki; Takagi, Nozomi; Nagase, Shigeru Syntheses, Structures, and Reactions of Heptacoordinate Trihalogermanes Bearing a Triarylmethyl-Type Tetradentate Ligand Organometallics, 2006, 25, 3388 |
| 4075082 | CIF | C37 H48 Ge I3 O3 | P a -3 | 19.9244; 19.9244; 19.9244 90; 90; 90 | 7909.6 | Iwanaga, Kohei; Kobayashi, Junji; Kawashima, Takayuki; Takagi, Nozomi; Nagase, Shigeru Syntheses, Structures, and Reactions of Heptacoordinate Trihalogermanes Bearing a Triarylmethyl-Type Tetradentate Ligand Organometallics, 2006, 25, 3388 |
| 4080465 | CIF | C28 H22 N6 Ni O2 | P a -3 | 25.029; 25.029; 25.029 90; 90; 90 | 15679 | Tan, Kel Vin; Dutton, Jason L.; Skelton, Brian W.; Wilson, David J. D.; Barnard, Peter J. Nickel(II) and Palladium(II) Complexes with Chelating N-Heterocyclic Carbene Amidate Ligands: Interplay between Normal and Abnormal Coordination Modes Organometallics, 2013, 32, 1913 |
| 4080468 | CIF | C29 H26 N6 O3 Pd | P a -3 | 25.205; 25.205; 25.205 90; 90; 90 | 16013 | Tan, Kel Vin; Dutton, Jason L.; Skelton, Brian W.; Wilson, David J. D.; Barnard, Peter J. Nickel(II) and Palladium(II) Complexes with Chelating N-Heterocyclic Carbene Amidate Ligands: Interplay between Normal and Abnormal Coordination Modes Organometallics, 2013, 32, 1913 |
| 4089392 | CIF | C48 H60 Al4 O6 | P a -3 | 21.0954; 21.0954; 21.0954 90; 90; 90 | 9387.8 | Bakthavachalam, K.; Reddy, N. Dastagiri Synthesis of Aluminum Complexes of Triaza Framework Ligands and Their Catalytic Activity toward Polymerization of ε-Caprolactone Organometallics, 2013, 32, 3174 |
| 4100374 | CIF | C84 H84 Cl5 F6 O3 P7 Ru3 | P a -3 | 26.0092; 26.0092; 26.0092 90; 90; 90 | 17594.7 | Chen, Yiyun; .; Ho, Douglas M.; .; Lee, Chulbom; . Ruthenium-Catalyzed Hydrative Cyclization of 1,5-Enynes Journal of the American Chemical Society, 2005 |
| 4101360 | CIF | Mg2.52 Sc11.18 Zn73.61 | P a -3 | 22.412; 22.412; 22.412 90; 90; 90 | 11257.5 | Lin, Qisheng; Corbett, John D The 1/1 and 2/1 approximants in the Sc-Mg-Zn quasicrystal system: triacontahedral clusters as fundamental building blocks. Journal of the American Chemical Society, 2006, 128, 13268-13273 |
| 4107383 | CIF | C32.55 H13 Co1.5 N2 O23.3 | P a -3 | 39.288; 39.288; 39.288 90; 90; 90 | 60643 | Amy J. Cairns; Jason A. Perman; Lukasz Wojtas; Victor Ch. Kravtsov; Mohamed H. Alkordi; Mohamed Eddaoudi; Michael J. Zaworotko Supermolecular Building Blocks (SBBs) and Crystal Design: 12-Connected Open Frameworks Based on a Molecular Cubohemioctahedron Journal of the American Chemical Society, 2008, 130, 1560-1561 |
| 4107626 | CIF | C30 H57 Cr2 N21 Ni3 O3 | P a -3 | 20.9742; 20.9742; 20.9742 90; 90; 90 | 9226.9 | Masaaki Ohba; Wakako Kaneko; Susumu Kitagawa; Takuho Maeda; Masaki Mito Pressure Response of Three-Dimensional Cyanide-Bridged Bimetallic Magnets Journal of the American Chemical Society, 2008, 130, 4475-4484 |
| 4108128 | CIF | C75 H96 S3 | P a -3 | 24.8817; 24.8817; 24.8817 90; 90; 90 | 15404.2 | Jin-Liang Wang; Jing Yan; Zheng-Ming Tang; Qi Xiao; Yuguo Ma; Jian Pei Gradient Shape-Persistent π-Conjugated Dendrimers for Light-Harvesting: Synthesis, Photophysical Properties, and Energy Funneling Journal of the American Chemical Society, 2008, 130, 9952-9962 |
| 4108982 | CIF | C49 H54 Cl2 D2 Ir2 O | P a -3 | 16.2538; 16.2538; 16.2538 90; 90; 90 | 4294.03 | Kevin C. Fortner; David S. Laitar; John Muldoon; Lihung Pu; Sonja B. Braun-Sand; Olaf Wiest; Seth N. Brown Ultrafast and Ultraslow Oxygen Atom Transfer Reactions between Late Metal Centers Journal of the American Chemical Society, 2007, 129, 588-600 |
| 4109449 | CIF | Au37 Ca12.6 In39.6 | P a -3 | 24.632; 24.632; 24.632 90; 90; 90 | 14945 | Qisheng Lin; John D. Corbett Development of the Ca-Au-In Icosahedral Quasicrystal and Two Crystalline Approximants: Practice via Pseudogap Electronic Tuning Journal of the American Chemical Society, 2007, 129, 6789-6797 |
| 4110725 | CIF | C39 H54 K2 N6 O12 Ti | P a -3 | 20.9569; 20.9569; 20.9569 90; 90; 90 | 9204.1 | Anna V. Davis; Timothy K. Firman; Benjamin P. Hay; Kenneth N. Raymond d-Orbital Effects on Stereochemical Non-Rigidity: Twisted TiIV Intramolecular Dynamics Journal of the American Chemical Society, 2006, 128, 9484-9496 |
| 4111647 | CIF | C42 H24 N2 O13 Zn4 | P a -3 | 22.393; 22.393; 22.393 90; 90; 90 | 11229 | Eun Young Lee; Seung Yeon Jang; Myunghyun Paik Suh Multifunctionality and Crystal Dynamics of a Highly Stable, Porous Metal-Organic Framework [Zn4O(NTB)2] Journal of the American Chemical Society, 2005, 127, 6374-6381 |
| 4112907 | CIF | C8 H8 Co2 O13.33 | P a -3 | 20.5213; 20.5213; 20.5213 90; 90; 90 | 8642 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112908 | CIF | C8 H6 O15.67 Zn3.06 | P a -3 | 20.7929; 20.7929; 20.7929 90; 90; 90 | 8989.7 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112909 | CIF | C8 H6 Co2 O10 | P a -3 | 20.329; 20.329; 20.329 90; 90; 90 | 8401.3 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112910 | CIF | C8 H8 Co2 O13.33 | P a -3 | 20.448; 20.448; 20.448 90; 90; 90 | 8549.7 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112911 | CIF | C8 H4 Co2 O10 | P a -3 | 20.273; 20.273; 20.273 90; 90; 90 | 8332.1 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112912 | CIF | C8 H8 Co2 O13.33 | P a -3 | 20.495; 20.495; 20.495 90; 90; 90 | 8608.8 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112913 | CIF | C8 H4 O11.08 Zn3.02 | P a -3 | 20.482; 20.482; 20.482 90; 90; 90 | 8592.5 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112914 | CIF | C8 H4 O10.5 Zn3 | P a -3 | 20.483; 20.483; 20.483 90; 90; 90 | 8593.7 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4112915 | CIF | C8 H4 O15.06 Zn3.01 | P a -3 | 20.713; 20.713; 20.713 90; 90; 90 | 8886.5 | Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure Journal of the American Chemical Society, 2004, 126, 10502-10503 |
| 4113398 | CIF | C4 H6 Au F6 N2 P | P a -3 | 9.8097; 9.8097; 9.8097 90; 90; 90 | 943.99 | Rochelle L. White-Morris; Marilyn M. Olmstead; Alan L. Balch Aurophilic Interactions in Cationic Gold Complexes with Two Isocyanide Ligands. Polymorphic Yellow and Colorless Forms of [(Cyclohexyl Isocyanide)2AuI](PF6) with Distinct Luminescence Journal of the American Chemical Society, 2003, 125, 1033-1040 |
| 4114486 | CIF | C87 H180 Cu6 F27 N30 O27 Os2 Re4 S9 Se8 | P a -3 | 27.1909; 27.1909; 27.1909 90; 90; 90 | 20103.5 | Eric G. Tulsky; Nathan R. M. Crawford; Stéphane A. Baudron; Patrick Batail; Jeffrey R. Long Cluster-to-Metal Magnetic Coupling: Synthesis and Characterization of 25-Electron [Re6-nOsnSe8(CN)6](5-n)- (n = 1, 2) Clusters and {Re6-nOsnSe8[CNCu(Me6tren)]6}9+ (n = 0, 1, 2) Assemblies Journal of the American Chemical Society, 2003, 125, 15543-15553 |
| 4114487 | CIF | C115 H222 Cu6 F27 N44 O27 Os2 Re4 S9 Se8 | P a -3 | 27.2115; 27.2115; 27.2115 90; 90; 90 | 20149.2 | Eric G. Tulsky; Nathan R. M. Crawford; Stéphane A. Baudron; Patrick Batail; Jeffrey R. Long Cluster-to-Metal Magnetic Coupling: Synthesis and Characterization of 25-Electron [Re6-nOsnSe8(CN)6](5-n)- (n = 1, 2) Clusters and {Re6-nOsnSe8[CNCu(Me6tren)]6}9+ (n = 0, 1, 2) Assemblies Journal of the American Chemical Society, 2003, 125, 15543-15553 |
| 4116775 | CIF | C49 H57 Co N3 O3 P Si4 Zr | P a -3 | 22.013; 22.013; 22.013 90; 90; 90 | 10666.9 | Georg Jansen; Martin Schubart; Bernd Findeis; Lutz H. Gade; Ian J. Scowen; Mary McPartlin Unsupported Ti-Co and Zr-Co Bonds in Heterobimetallic Complexes: A Theoretical Description of Metal-Metal Bond Polarity Journal of the American Chemical Society, 1998, 120, 7239-7251 |
| 4117098 | CIF | C6 H18 Cl6 P2 Re2 | P a -3 | 12.3336; 12.3336; 12.3336 90; 90; 90 | 1876.2 | F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina Mixed Chloride Phosphine Complexes of Dirhenium Cores. 1. New Reactions and Unprecedented Structures Involving Trimethylphosphine Journal of the American Chemical Society, 1997, 119, 12541-12549 |
| 4117816 | CIF | C143 H139 Cl2 N23 O23 S6 Zn6 | P a -3 | 24.349; 24.349; 24.349 90; 90; 90 | 14435.9 | Anuj K. Sharma; Stephanie T. Pavlova; Jaekwang Kim; Darren Finkelstein; Nicholas J. Hawco; Nigam P. Rath; Jungsu Kim; Liviu M. Mirica Bifunctional Compounds for Controlling Metal-Mediated Aggregation of the Aβ42 Peptide Journal of the American Chemical Society, 2012, 134, 6625-6636 |
| 4119631 | CIF | C60 H30 F12 I14 S2 | P a -3 | 22.431; 22.431; 22.431 90; 90; 90 | 11286.2 | Julien Lieffrig; Olivier Jeannin; Marc Fourmigué Expanded Halogen-Bonded Anion Organic Networks with Star-Shaped Iodoethynyl-Substituted Molecules: From Corrugated 2D Hexagonal Lattices to Pyrite-Type 2-Fold Interpenetrated Cubic Lattices Journal of the American Chemical Society, 2013, 135, 6200-6210 |
| 4119779 | CIF HKL | C2 N2 Zn | P a -3 | 12.48147; 12.48147; 12.48147 90; 90; 90 | 1944.45 | Saul H. Lapidus; Gregory J. Halder; Peter J. Chupas; Karena W. Chapman Exploiting High Pressures to Generate Porosity, Polymorphism, And Lattice Expansion in the Nonporous Molecular Framework Zn(CN)2 Journal of the American Chemical Society, 2013, 135, 7621-7628 |
| 4119780 | CIF HKL | C2 N2 Zn | P a -3 | 12.46007; 12.46007; 12.46007 90; 90; 90 | 1934.47 | Saul H. Lapidus; Gregory J. Halder; Peter J. Chupas; Karena W. Chapman Exploiting High Pressures to Generate Porosity, Polymorphism, And Lattice Expansion in the Nonporous Molecular Framework Zn(CN)2 Journal of the American Chemical Society, 2013, 135, 7621-7628 |
| 4120318 | CIF | C18 H30 Fe Li0.33 N2.33 O Si | P a -3 | 23.0569; 23.0569; 23.0569 90; 90; 90 | 12257.5 | Tamara M. Powers; Theodore A. Betley Testing the Polynuclear Hypothesis: Multielectron Reduction of Small Molecules by Triiron Reaction Sites Journal of the American Chemical Society, 2013, 135, 12289-12296 |
| 4123452 | CIF | C54 H36 N6 O13 Zn4 | P a -3 | 25.888; 25.888; 25.888 90; 90; 90 | 17350 | Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society, 2015, 137, 2641-2650 |
| 4123925 | CIF | C165 H157 Ag29 N7 O7 P4 S24 | P a -3 | 34.2011; 34.2011; 34.2011 90; 90; 90 | 40005.5 | AbdulHalim, Lina G.; Bootharaju, Megalamane S.; Tang, Qing; Del Gobbo, Silvano; AbdulHalim, Rasha G.; Eddaoudi, Mohamed; Jiang, De-En; Bakr, Osman M. Ag29(BDT)12(TPP)4: A Tetravalent Nanocluster. Journal of the American Chemical Society, 2015, 137, 11970-11975 |
| 4124648 | CIF | Rh Te2 | P a -3 | 6.441; 6.441; 6.441 90; 90; 90 | 267.214 | Geller, S. The Crystal Structures of Rh Te and Rh Te2 Journal of the American Chemical Society, 1955, 77, 2641-2644 |
| 4124754 | CIF | C52 H60 Fe4 N6 O20.33 S1.73 | P a -3 | 17.8048; 17.8048; 17.8048 90; 90; 90 | 5644.3 | Nguyen, Nhung T. T.; Furukawa, Hiroyasu; Gándara, Felipe; Trickett, Christopher A.; Jeong, Hyung Mo; Cordova, Kyle E.; Yaghi, Omar M. Three-Dimensional Metal-Catecholate Frameworks and Their Ultrahigh Proton Conductivity. Journal of the American Chemical Society, 2015, 137, 15394-15397 |
| 4125038 | CIF | C48 H48.87 Ag3 Cd N7 O3.44 P2 | P a -3 | 21.7394; 21.7394; 21.7394 90; 90; 90 | 10274.1 | Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society, 2016, 138, 5886-5896 |
| 4128899 | CIF | C20 H112 Mo2 N10 Na O96 P Se W22 | P a -3 | 22.557; 22.557; 22.557 90; 90; 90 | 11477.4 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4130622 | CIF | C30 H18 N0 O13 Zn4 | P a -3 | 21.2832; 21.2832; 21.2832 90; 90; 90 | 9640.7 | Jiang, Juncong; Furukawa, Hiroyasu; Zhang, Yue-Biao; Yaghi, Omar M. High Methane Storage Working Capacity in Metal-Organic Frameworks with Acrylate Links. Journal of the American Chemical Society, 2016, 138, 10244-10251 |
| 4131322 | CIF | C48 H60 Fe N3 Nb P4 | P a -3 | 21.1756; 21.1756; 21.1756 90; 90; 90 | 9495.3 | Culcu, Gursu; Iovan, Diana A.; Krogman, Jeremy P.; Wilding, Matthew J. T.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. Heterobimetallic Complexes Comprised of Nb and Fe: Isolation of a Coordinatively Unsaturated Nb<sup>III</sup>/Fe<sup>0</sup> Bimetallic Complex Featuring a Nb≡Fe Triple Bond. Journal of the American Chemical Society, 2017, 139, 9627-9636 |
| 4132715 | CIF | C17 H8 Cu N O4 | P a -3 | 40.52; 40.52; 40.52 90; 90; 90 | 66529 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132716 | CIF | C20.25 H8 Cu D13 N O4 | P a -3 | 40.53; 40.53; 40.53 90; 90; 90 | 66578 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132719 | CIF | C18.89 H8 Cu D7.56 N O4 | P a -3 | 40.519; 40.519; 40.519 90; 90; 90 | 66524 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132829 | CIF | C56 H40 O2 | P a -3 | 15.389; 15.389; 15.389 90; 90; 90 | 3644.4 | Povie, Guillaume; Segawa, Yasutomo; Nishihara, Taishi; Miyauchi, Yuhei; Itami, Kenichiro Synthesis and Size-Dependent Properties of [12], [16], and [24]Carbon Nanobelts. Journal of the American Chemical Society, 2018, 140, 10054-10059 |
| 4134359 | CIF | C39 H63 La N3 Ni P3 | P a -3 | 20.8114; 20.8114; 20.8114 90; 90; 90 | 9013.7 | Ramirez, Bianca L.; Lu, Connie C. Rare-Earth Supported Nickel Catalysts for Alkyne Semihydrogenation: Chemo- and Regioselectivity Impacted by the Lewis Acidity and Size of the Support. Journal of the American Chemical Society, 2020 |
| 4134525 | CIF | C90 H114 N26 O22.33 P1.33 | P a -3 | 42.4955; 42.4955; 42.4955 90; 90; 90 | 76741 | Li, Boyang; Zheng, Bo; Zhang, Wenyao; Zhang, Dan; Yang, Xiao-Juan; Wu, Biao Site-Selective Binding of Peripheral Chiral Guests Induces Stereospecificity in A<sub>4</sub>L<sub>6</sub> Tetrahedral Anion Cages. Journal of the American Chemical Society, 2020, 142, 6304-6311 |
| 4134526 | CIF | C90 H110 N26 O22.33 P1.33 | P a -3 | 42.271; 42.271; 42.271 90; 90; 90 | 75531 | Li, Boyang; Zheng, Bo; Zhang, Wenyao; Zhang, Dan; Yang, Xiao-Juan; Wu, Biao Site-Selective Binding of Peripheral Chiral Guests Induces Stereospecificity in A<sub>4</sub>L<sub>6</sub> Tetrahedral Anion Cages. Journal of the American Chemical Society, 2020, 142, 6304-6311 |
| 4301558 | CIF | C31 H47 La O | P a -3 | 17.7403; 17.7403; 17.7403 90; 90; 90 | 5583.2 | William J. Evans; Sara E. Lorenz; Joseph W. Ziller Investigating Metal Size Effects in the Ln2(μ-η2:η2-N2) Reduction System: Reductive Reactivity with Complexes of the Largest and Smallest Trivalent Lanthanide Ions, La3+ and Lu3+ Inorganic Chemistry, 2009, 48, 2001-2009 |
| 4301617 | CIF | C6 H6 K4 O12 Re6 S8 | P a -3 | 17.6324; 17.6324; 17.6324 90; 90; 90 | 5481.94 | Konstantin A. Brylev; Yuri V. Mironov; Svetlana G. Kozlova; Vladimir E. Fedorov; Sung-Jin Kim; Hans-Jürgen Pietzsch; Holger Stephan; Akitaka Ito; Shoji Ishizaka; Noboru Kitamura The First Octahedral Cluster Complexes With Terminal Formate Ligands: Synthesis, Structure, and Properties of K4[Re6S8(HCOO)6] and Cs4[Re6S8(HCOO)6] Inorganic Chemistry, 2009, 48, 2309-2315 |
| 4302886 | CIF | C36 H162 Fe8 N12 Na2 O100 P24 | P a -3 | 24.453; 24.453; 24.453 90; 90; 90 | 14622 | Zi-Yi Du; Yu-Hui Sun; Qing-Yan Liu; Yong-Rong Xie; He-Rui Wen Octanuclear Aluminum(III) and Iron(III) Phosphonate Cages Encapsulating Two NaI Ions Inorganic Chemistry, 2009, 48, 7015-7017 |
| 4302887 | CIF | C36 H158 Al8 N12 Na2 O98 P24 | P a -3 | 24.1955; 24.1955; 24.1955 90; 90; 90 | 14164.6 | Zi-Yi Du; Yu-Hui Sun; Qing-Yan Liu; Yong-Rong Xie; He-Rui Wen Octanuclear Aluminum(III) and Iron(III) Phosphonate Cages Encapsulating Two NaI Ions Inorganic Chemistry, 2009, 48, 7015-7017 |
| 4303520 | CIF | C4 H6 As F6 I N2 | P a -3 | 10.1087; 10.1087; 10.1087 90; 90; 90 | 1032.97 | Margaret-Jane Crawford; Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Jan M. Welch Does [I3]+ Act as an "[I]+" Donor to CH3CN and N2O? Structure of [H3CCN-I-NCCH3]+[AsF6]- Inorganic Chemistry, 2009, 48, 9983-9985 |
| 4304553 | CIF | C22 H60 La4 N9 Na Ni5 O58 | P a -3 | 33.8871; 33.8871; 33.8871 90; 90; 90 | 38914 | Xiang-Jian Kong; Yan-Ping Ren; La-Sheng Long; Zhiping Zheng; Gary Nichol; Rong-Bin Huang; Lan-Sun Zheng Dual Shell-like Magnetic Clusters Containing NiII and LnIII (Ln = La, Pr, and Nd) Ions Inorganic Chemistry, 2008, 47, 2728-2739 |
| 4304620 | CIF | C114 H158 Fe2 K2 N14 O14 | P a -3 | 22.3171; 22.3171; 22.3171 90; 90; 90 | 11115.1 | Remle Çelenligil-Çetin; Patrina Paraskevopoulou; Rupam Dinda; Richard J. Staples; Ekkehard Sinn; Nigam P. Rath; Pericles Stavropoulos Synthesis, Characterization, and Reactivity of Iron Trisamidoamine Complexes That Undergo Both Metal- and Ligand-Centered Oxidative Transformations Inorganic Chemistry, 2008, 47, 1165-1172 |
| 4304962 | CIF | Au3 Ca Ga | P a -3 | 9.0882; 9.0882; 9.0882 90; 90; 90 | 750.64 | Qisheng Lin; John D. Corbett Interpenetrating Networks of Three-Dimensional Penrose Tiles in CaAu3Ga, the Structurally Simplest Cubic Approximant of an Icosahedral Quasicrystal Inorganic Chemistry, 2008, 47, 3462-3464 |
| 4304963 | CIF | Au3.11 Ca Ga0.89 | P a -3 | 9.1107; 9.1107; 9.1107 90; 90; 90 | 756.23 | Qisheng Lin; John D. Corbett Interpenetrating Networks of Three-Dimensional Penrose Tiles in CaAu3Ga, the Structurally Simplest Cubic Approximant of an Icosahedral Quasicrystal Inorganic Chemistry, 2008, 47, 3462-3464 |
| 4304964 | CIF | Au3.13 Ca Ga0.87 | P a -3 | 9.1022; 9.1022; 9.1022 90; 90; 90 | 754.12 | Qisheng Lin; John D. Corbett Interpenetrating Networks of Three-Dimensional Penrose Tiles in CaAu3Ga, the Structurally Simplest Cubic Approximant of an Icosahedral Quasicrystal Inorganic Chemistry, 2008, 47, 3462-3464 |
| 4305718 | CIF | Au57.11 Ca13 Ga23.4 | P a -3 | 23.9377; 23.9377; 23.9377 90; 90; 90 | 13716.6 | Qisheng Lin; John D. Corbett Approximant Phases and an Icosahedral Quasicrystal in the Ca-Au-Ga System: The Influence of Size of Gallium versus Indium Inorganic Chemistry, 2008, 47, 7651-7659 |
| 4305871 | CIF | C105 H74 Br3 Cd7 N37 O19 P2 | P a -3 | 29.7407; 29.7407; 29.7407 90; 90; 90 | 26305.9 | Ai-Xin Zhu; Jie-Peng Zhang; Yan-Yong Lin; Xiao-Ming Chen Pentanuclear and Heptanuclear Helicates By Self-Assembly of d10 Metal Ions and a Rigid Aromatic Bis-Bidentate Chelator Inorganic Chemistry, 2008, 47, 7389-7395 |
| 4306523 | CIF | B12 H12 Li2 | P a -3 | 9.57713; 9.57713; 9.57713 90; 90; 90 | 878.43 | Jae-Hyuk Her; Muhammed Yousufuddin; Wei Zhou; Satish S. Jalisatgi; James G. Kulleck; Jason A. Zan; Son-Jong Hwang; Robert C. Bowman; Terrence J. Udovic Crystal Structure of Li2B12H12: a Possible Intermediate Species in the Decomposition of LiBH4 Inorganic Chemistry, 2008, 47, 9757-9759 |
| 4308067 | CIF | C24 H58 Al2 N2 P2 | P a -3 | 14.486; 14.486; 14.486 90; 90; 90 | 3039.8 | Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides Inorganic Chemistry, 2007, 46, 3623-3631 |
| 4308069 | CIF | C24 H54 B2 F4 N2 P2 | P a -3 | 14.298; 14.298; 14.298 90; 90; 90 | 2923 | Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides Inorganic Chemistry, 2007, 46, 3623-3631 |
| 4308624 | CIF | C7 H11 Cl N O12 Pr | P a -3 | 20.506; 20.506; 20.506 90; 90; 90 | 8623 | Bin Zhao; Long Yi; Yan Dai; Xiao-Yan Chen; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan; Zong-Hui Jiang Systematic Investigation of the Hydrothermal Syntheses of Pr(III)-PDA (PDA = Pyridine-2,6-dicarboxylate Anion) Metal-Organic Frameworks Inorganic Chemistry, 2005, 44, 911-920 |
| 4308801 | CIF | C7 H11 Cl La N O8 | P a -3 | 19.9818; 19.9818; 19.9818 90; 90; 90 | 7978.2 | Sujit K. Ghosh; Parimal K. Bharadwaj Coordination Polymers of La(III) as Bunched Infinite Nanotubes and Their Conversion into an Open-Framework Structure Inorganic Chemistry, 2005, 44, 3156-3161 |
| 4308802 | CIF | C7 H11 La N2 O11 | P a -3 | 20.3661; 20.3661; 20.3661 90; 90; 90 | 8447.4 | Sujit K. Ghosh; Parimal K. Bharadwaj Coordination Polymers of La(III) as Bunched Infinite Nanotubes and Their Conversion into an Open-Framework Structure Inorganic Chemistry, 2005, 44, 3156-3161 |
| 4308932 | CIF | C3 H3 Cl Cu N3 S3 | P a -3 | 11.7472; 11.7472; 11.7472 90; 90; 90 | 1621.07 | Dan Li; Wen-Juan Shi; Lei Hou Coordination Polymers of Copper(I) Halides and Neutral Heterocyclic Thiones with New Coordination Modes Inorganic Chemistry, 2005, 44, 3907-3913 |
| 4308933 | CIF | C3 H3 Br Cu N3 S3 | P a -3 | 11.8847; 11.8847; 11.8847 90; 90; 90 | 1678.67 | Dan Li; Wen-Juan Shi; Lei Hou Coordination Polymers of Copper(I) Halides and Neutral Heterocyclic Thiones with New Coordination Modes Inorganic Chemistry, 2005, 44, 3907-3913 |
| 4308934 | CIF | C3 H3 Cu I N3 S3 | P a -3 | 12.0266; 12.0266; 12.0266 90; 90; 90 | 1739.52 | Dan Li; Wen-Juan Shi; Lei Hou Coordination Polymers of Copper(I) Halides and Neutral Heterocyclic Thiones with New Coordination Modes Inorganic Chemistry, 2005, 44, 3907-3913 |
| 4310020 | CIF | C54 H102 Cr Li3 O6 Si6 | P a -3 | 19.0415; 19.0415; 19.0415 90; 90; 90 | 6904.04 | Louise A. Berben; Jeffrey R. Long Homoleptic Trimethylsilylacetylide Complexes of Chromium(III), Iron(II), and Cobalt(III): Syntheses, Structures, and Ligand Field Parameters Inorganic Chemistry, 2005, 44, 8459-8468 |
| 4310022 | CIF | C42 H84 Co Li3 O3 Si6 | P a -3 | 18.8534; 18.8534; 18.8534 90; 90; 90 | 6701.5 | Louise A. Berben; Jeffrey R. Long Homoleptic Trimethylsilylacetylide Complexes of Chromium(III), Iron(II), and Cobalt(III): Syntheses, Structures, and Ligand Field Parameters Inorganic Chemistry, 2005, 44, 8459-8468 |
| 4310183 | CIF | C90 H78 Cu3 N6 O21 | P a -3 | 19.99; 19.99; 19.99 90; 90; 90 | 7988 | Xian-He Bu; Ming-Liang Tong; Ya-Bo Xie; Jian-Rong Li; Ho-Chol Chang; Susumu Kitagawa; Joan Ribas Synthesis, Structures, and Magnetic Properties of the Copper(II), Cobalt(II), and Manganese(II) Complexes with 9-Acridinecarboxylate and 4-Quinolinecarboxylate Ligands Inorganic Chemistry, 2005, 44, 9837-9846 |
| 4310184 | CIF | C90 H78 Mn3 N6 O21 | P a -3 | 20.205; 20.205; 20.205 90; 90; 90 | 8248.5 | Xian-He Bu; Ming-Liang Tong; Ya-Bo Xie; Jian-Rong Li; Ho-Chol Chang; Susumu Kitagawa; Joan Ribas Synthesis, Structures, and Magnetic Properties of the Copper(II), Cobalt(II), and Manganese(II) Complexes with 9-Acridinecarboxylate and 4-Quinolinecarboxylate Ligands Inorganic Chemistry, 2005, 44, 9837-9846 |
| 4310185 | CIF | C90 H78 Co3 N6 O21 | P a -3 | 20.007; 20.007; 20.007 90; 90; 90 | 8008 | Xian-He Bu; Ming-Liang Tong; Ya-Bo Xie; Jian-Rong Li; Ho-Chol Chang; Susumu Kitagawa; Joan Ribas Synthesis, Structures, and Magnetic Properties of the Copper(II), Cobalt(II), and Manganese(II) Complexes with 9-Acridinecarboxylate and 4-Quinolinecarboxylate Ligands Inorganic Chemistry, 2005, 44, 9837-9846 |
| 4310788 | CIF | In K Se4 Sn | P a -3 | 13.7849; 13.7849; 13.7849 90; 90; 90 | 2619.5 | Seong-Ju Hwang; Ratnasabapathy G. Iyer; Pantelis N. Trikalitis; Andrew G. Ogden; Mercouri G. Kanatzidis Cooling of Melts: Kinetic Stabilization and Polymorphic Transitions in the KInSnSe4 System Inorganic Chemistry, 2004, 43, 2237-2239 |
| 4312648 | CIF | C48 H45 Ag Au B2 F8 N6 P3 | P a -3 | 21.535; 21.535; 21.535 90; 90; 90 | 9987 | Vincent J. Catalano; Stephen J. Horner Luminescent Gold(I) and Silver(I) Complexes of 2-(Diphenylphosphino)-1-methylimidazole (dpim): Characterization of a Three-Coordinate Au(I)-Ag(I) Dimer with a Short Metal-Metal Separation Inorganic Chemistry, 2003, 42, 8430-8438 |
| 4314341 | CIF | C24 H110 N6 O64 P6 Zn9 | P a -3 | 20.1198; 20.1198; 20.1198 90; 90; 90 | 8144.6 | Chong Lei; Jiang-Gao Mao; Yan-Qiong Sun; Hui-Yi Zeng; Abraham Clearfield {Zn6[MeN(CH2CO2)(CH2PO3)]6(Zn)}4- Anion: The First Example of the Oxo-Bridged Zn6 Octahedron with a Centered Zn(II) Cation Inorganic Chemistry, 2003, 42, 6157-6159 |
| 4315757 | CIF | C63 H63 Au Cl O4 Sb3 | P a -3 | 22.1544; 22.1544; 22.1544 90; 90; 90 | 10873.8 | Vilma R. Bojan; Eduardo J. Fernández; Antonio Laguna; José M. López-de-Luzuriaga; Miguel Monge; M. Elena Olmos; Raquel C. Puelles; Cristian Silvestru Study of the Coordination Abilities of Stibine Ligands to Gold(I) Inorganic Chemistry, 2010, 49, 5530-5541 |
| 4316269 | CIF | C60 H12 Cu12 K4 Mn4 O117.12 | P a -3 | 18.346; 18.346; 18.346 90; 90; 90 | 6174.8 | Beatriz Gil-Hernández; Pedro Gili; Jana K. Vieth; Christoph Janiak; Joaquín Sanchiz Magnetic Ordering in Two Molecule-Based (10,3)-a Nets Prepared from a Copper(II) Trinuclear Secondary Building Unit Inorganic Chemistry, 2010, 49, 7478-7490 |
| 4316474 | CIF | C60 H90 Cd6 Cl14 N24 O20 | P a -3 | 20.95; 20.95; 20.95 90; 90; 90 | 9195 | Xing Feng; Zhong-Fei Li; Sai-Feng Xue; Zhu Tao; Qian-Jiang Zhu; Yun-Qian Zhang; Jing-Xin Liu Complexation of Cyclohexanocucurbit[6]uril with Cadmium Ions: X-ray Crystallographic and Electrochemical Study Inorganic Chemistry, 2010, 49, 7638-7640 |
| 4316968 | CIF | C51 H54 Gd2 N20 O21 | P a -3 | 18.2412; 18.2412; 18.2412 90; 90; 90 | 6069.6 | Ji-Jun Jiang; Mei Pan; Jun-Min Liu; Wei Wang; Cheng-Yong Su Assembly of Robust and Porous Hydrogen-Bonded Coordination Frameworks: Isomorphism, Polymorphism, and Selective Adsorption Inorganic Chemistry, 2010, 49, 10166-10173 |
| 4316969 | CIF | C51 H54 Er2 N20 O21 | P a -3 | 18.3775; 18.3775; 18.3775 90; 90; 90 | 6206.7 | Ji-Jun Jiang; Mei Pan; Jun-Min Liu; Wei Wang; Cheng-Yong Su Assembly of Robust and Porous Hydrogen-Bonded Coordination Frameworks: Isomorphism, Polymorphism, and Selective Adsorption Inorganic Chemistry, 2010, 49, 10166-10173 |
| 4317015 | CIF | Au47.2 Ca13 Sn28.1 | P a -3 | 24.444; 24.444; 24.444 90; 90; 90 | 14605.5 | Qisheng Lin; John D. Corbett Development of an Icosahedral Quasicrystal and Two Approximants in the Ca-Au-Sn System: Syntheses and Structural Analyses Inorganic Chemistry, 2010, 49, 10436-10444 |
| 4317359 | CIF | C48 H30 N12 O13 Zn4 | P a -3 | 27.26; 27.26; 27.26 90; 90; 90 | 20257 | Qian-Rong Fang; Da-Qian Yuan; Julian Sculley; Jian-Rong Li; Zheng-Bo Han; Hong-Cai Zhou Functional Mesoporous Metal-Organic Frameworks for the Capture of Heavy Metal Ions and Size-Selective Catalysis Inorganic Chemistry, 2010, 49, 11637-11642 |
| 4317360 | CIF | C54 H36 N6 O13 Zn4 | P a -3 | 27.3; 27.3; 27.3 90; 90; 90 | 20346 | Qian-Rong Fang; Da-Qian Yuan; Julian Sculley; Jian-Rong Li; Zheng-Bo Han; Hong-Cai Zhou Functional Mesoporous Metal-Organic Frameworks for the Capture of Heavy Metal Ions and Size-Selective Catalysis Inorganic Chemistry, 2010, 49, 11637-11642 |
| 4317623 | CIF | C24 H49 N18 O0.5 S16 W4 | P a -3 | 22.76; 22.76; 22.76 90; 90; 90 | 11790 | Maxim N. Sokolov; Danil N. Dybtsev; Alexander V.Virovets; Vladimir P.Fedin; Pedro Esparza; Rita Hernandez-Molina; Dieter Fenske; A. Geoffrey Sykes Preparation and Properties of the Aqua Ions [W4S4(H2O)12]n+ (n= 5, 6) and Crystal Structure of (Me2NH2)6[W4S4(NCS)12].0.5H2O# Inorganic Chemistry, 2002, 41, 1136-1139 |
| 4318825 | CIF | C42 H46 B4 F16 N12 O2 Zn2 | P a -3 | 22.0634; 22.0634; 22.0634 90; 90; 90 | 10740.3 | Guo Dong; Pang Ke-liang; Duan Chun-ying; He Cheng; Meng Qing-jin Design and Crystal Structures of Triple Helicates with Crystallographic Idealized D3 Symmetry: The Role of Side Chain Effect on Crystal Packing Inorganic Chemistry, 2002, 41, 5978-5985 |
| 4318826 | CIF | C42 H44 B4 Co2 F16 N12 O | P a -3 | 21.982; 21.982; 21.982 90; 90; 90 | 10622 | Guo Dong; Pang Ke-liang; Duan Chun-ying; He Cheng; Meng Qing-jin Design and Crystal Structures of Triple Helicates with Crystallographic Idealized D3 Symmetry: The Role of Side Chain Effect on Crystal Packing Inorganic Chemistry, 2002, 41, 5978-5985 |
| 4318827 | CIF | C42 H42 B4 F16 N12 Ni2 | P a -3 | 21.98; 21.98; 21.98 90; 90; 90 | 10619 | Guo Dong; Pang Ke-liang; Duan Chun-ying; He Cheng; Meng Qing-jin Design and Crystal Structures of Triple Helicates with Crystallographic Idealized D3 Symmetry: The Role of Side Chain Effect on Crystal Packing Inorganic Chemistry, 2002, 41, 5978-5985 |
| 4318828 | CIF | C21 H21 B2 Cu F8 N6 | P a -3 | 21.973; 21.973; 21.973 90; 90; 90 | 10609 | Guo Dong; Pang Ke-liang; Duan Chun-ying; He Cheng; Meng Qing-jin Design and Crystal Structures of Triple Helicates with Crystallographic Idealized D3 Symmetry: The Role of Side Chain Effect on Crystal Packing Inorganic Chemistry, 2002, 41, 5978-5985 |
| 4319200 | CIF | C12 H18 Ga N3 O6 | P a -3 | 14.0762; 14.0762; 14.0762 90; 90; 90 | 2789.05 | Hongyan Luo; Natashia Eberly; Robin D. Rogers; Martin W. Brechbiel Syntheses and Characterizations of Metal Complexes Derived from cis,cis-1,3,5-Triaminocyclohexane-N,N',N''-triacetic Acid Inorganic Chemistry, 2001, 40, 493-498 |
| 4319285 | CIF | C110 H158 O6 Zn6 | P a -3 | 21.8012; 21.8012; 21.8012 90; 90; 90 | 10361.9 | Maarten B. Dinger; Michael J. Scott Synthesis, Characterization, and Reactivity of Multinuclear Zinc(II) Alkyl Derivatives of Linked Phenoxides Inorganic Chemistry, 2001, 40, 1029-1036 |
| 4319289 | CIF | C65 H108 O7 Zn3 | P a -3 | 23.604; 23.604; 23.604 90; 90; 90 | 13150.9 | Maarten B. Dinger; Michael J. Scott Synthesis, Characterization, and Reactivity of Multinuclear Zinc(II) Alkyl Derivatives of Linked Phenoxides Inorganic Chemistry, 2001, 40, 1029-1036 |
| 4320271 | CIF | C36 H106 Cl8 Mo6 N24 O50 P2 Pd2 S8 | P a -3 | 21.669; 21.669; 21.669 90; 90; 90 | 10175 | Maxim N. Sokolov; Alexander V.Virovets; Danil N. Dybtsev; Elena V. Chubarova; Vladimir P.Fedin; Dieter Fenske Phosphorous Acid and Arsenious Acid as Ligands Inorganic Chemistry, 2001, 40, 4816-4817 |
| 4320272 | CIF | C36 H104 As2 Cl8 Mo6 N24 O49 Pd2 S8 | P a -3 | 21.7016; 21.7016; 21.7016 90; 90; 90 | 10220.6 | Maxim N. Sokolov; Alexander V.Virovets; Danil N. Dybtsev; Elena V. Chubarova; Vladimir P.Fedin; Dieter Fenske Phosphorous Acid and Arsenious Acid as Ligands Inorganic Chemistry, 2001, 40, 4816-4817 |
| 4321173 | CIF | C115 H150 Eu8 O26 | P a -3 | 29.9377; 29.9377; 29.9377 90; 90; 90 | 26832 | William J. Evans; Michael A. Greci; Joseph W. Ziller Reactivity of "Eu(OiPr)2" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes Inorganic Chemistry, 2000, 39, 3213-3220 |
| 4321641 | CIF | C2 H3 Ag B11 Cl11 | P a -3 | 12.4887; 12.4887; 12.4887 90; 90; 90 | 1947.8 | Chi-Wing Tsang; Qingchuan Yang; Eric Tung-Po Sze; Thomas C. W. Mak; Dominic T. W. Chan; Zuowei Xie Weakly Coordinating Nature of a Carborane Cage Bearing Different Halogen Atoms. Synthesis and Structural Characterization of Icosahedral Mixed Halocarborane Anions, 1-H-CB11Y5X6- (X, Y = Cl, Br, I) Inorganic Chemistry, 2000, 39, 5851-5858 |
| 4322436 | CIF | C114 H108 Br15 Cu8 P6 | P a -3 | 23.0997; 23.0997; 23.0997 90; 90; 90 | 12325.9 | Graham A. Bowmaker; Peter D. W. Boyd; Clifton E. F. Rickard; Marcia L. Scudder; Ian G. Dance The [Cu8Br15]6- Ion, A Crystal-Stabilized High-Symmetry Mixed-Valence Copper Complex with a Linear Halogen Bridge Inorganic Chemistry, 1999, 38, 5476-5477 |
| 4322880 | CIF | C39 H45 Fe2 N22 O15 | P a -3 | 21.0024; 21.0024; 21.0024 90; 90; 90 | 9264.18 | Zhiqiang Xu; Laurence K. Thompson; David O. Miller; Howard J. Clase; Judith A. K. Howard; Andrés E. Goeta Spiral Dinuclear Complexes of Tetradentate N4 Diazine Ligands with Mn(II), Fe(II), Fe(III), Co(III), and Ni(II) Salts Inorganic Chemistry, 1998, 37, 3620-3627 |
| 4322948 | CIF | C149 H159 O13 P9 Ru3 Ti3 | P a -3 | 30.83; 30.83; 30.83 90; 90; 90 | 29304 | Thomas Rüther; Ulli Englert; Ulrich Koelle Synthesis and Complexation Properties of the Anions (η5-C5Me5)Ru(PR2O)32- as Ligands Inorganic Chemistry, 1998, 37, 4265-4271 |
| 4323398 | CIF | C24 H56 Ag4 F24 N12 O4 P4 | P a -3 | 21.85; 21.85; 21.85 90; 90; 90 | 10432 | Lucia Carlucci; Gianfranco Ciani; Davide M. Proserpio; Angelo Sironi A Novel 3D Three-Connected cubic Network Containing [Ag6(hmt)6]6+ hexagonal Units (hmt = Hexamethylenetetramine) Inorganic Chemistry, 1997, 36, 1736-1737 |
| 4325112 | CIF | C45 H51 Cl Co Hf I N3 P3 | P a -3 | 20.818; 20.818; 20.818 90; 90; 90 | 9022.3 | Vinay N. Setty; Wen Zhou; Bruce M. Foxman; Christine M. Thomas Subtle Differences Between Zr and Hf in Early/Late Heterobimetallic Complexes with Cobalt Inorganic Chemistry, 2011, 50, 4647-4655 |
| 4326250 | CIF | Mo0.5 O7.25 V1.5 Zr | P a -3 | 8.8895; 8.8895; 8.8895 90; 90; 90 | 702.48 | Prangya Parimita Sahoo; S. Sumithra; Giridhar Madras; T. N. Guru Row Synthesis, Structure, Negative Thermal Expansion, and Photocatalytic Property of Mo Doped ZrV2O7 Inorganic Chemistry, 2011, 50, 8774-8781 |
| 4326251 | CIF | Mo0.5 O7.25 V1.5 Zr | P a -3 | 8.8969; 8.8969; 8.8969 90; 90; 90 | 704.23 | Prangya Parimita Sahoo; S. Sumithra; Giridhar Madras; T. N. Guru Row Synthesis, Structure, Negative Thermal Expansion, and Photocatalytic Property of Mo Doped ZrV2O7 Inorganic Chemistry, 2011, 50, 8774-8781 |
| 4326252 | CIF | Mo0.5 O7.25 V1.5 Zr | P a -3 | 8.9004; 8.9004; 8.9004 90; 90; 90 | 705.06 | Prangya Parimita Sahoo; S. Sumithra; Giridhar Madras; T. N. Guru Row Synthesis, Structure, Negative Thermal Expansion, and Photocatalytic Property of Mo Doped ZrV2O7 Inorganic Chemistry, 2011, 50, 8774-8781 |
| 4326534 | CIF | Ba3.97 Fe3 K1.03 O9 | P a -3 | 16.7644; 16.7644; 16.7644 90; 90; 90 | 4711.55 | Qingbiao Zhao; Saritha Nellutla; Won-Joon Son; Shae A. Vaughn; Longfei Ye; Mark D. Smith; Vincent Caignaert; Michael Lufaso; Thomas M. Pekarek; Alex I. Smirnov; Myung-Hwan Whangbo; Hans-Conrad zur Loye Ba4KFe3O9: A Novel Ferrite Containing Discrete 6-Membered Rings of Corner-Sharing FeO4 Tetrahedra Inorganic Chemistry, 2011, 50, 10310-10318 |
| 4326598 | CIF | C61 H110 Cl2 Cu4 I4 P4 | P a -3 | 23.922; 23.922; 23.922 90; 90; 90 | 13689.7 | Sandrine Perruchas; Cédric Tard; Xavier F. Le Goff; Alexandre Fargues; Alain Garcia; Samia Kahlal; Jean-Yves Saillard; Thierry Gacoin; Jean-Pierre Boilot Thermochromic Luminescence of Copper Iodide Clusters: The Case of Phosphine Ligands Inorganic Chemistry, 2011, 50, 10682-10692 |
| 4328642 | CIF | N2 O4 Si2 Sr3 | P a -3 | 15.62209; 15.62209; 15.62209 90; 90; 90 | 3812.57 | Xiao-Ming Wang; Chun-Hai Wang; Xiao-Jun Kuang; Ru-Qiang Zou; Ying-Xia Wang; Xi-Ping Jing Promising Oxonitridosilicate Phosphor Host Sr3Si2O4N2: Synthesis, Structure, and Luminescence Properties Activated by Eu2+ and Ce3+/Li+ for pc-LEDs Inorganic Chemistry, 2012, 51, 3540-3547 |
| 4329332 | CIF | Cu12 K6 S15 U2 | P a -3 | 18.552; 18.552; 18.552 90; 90; 90 | 6385.17 | Christos D. Malliakas; Jiyong Yao; Daniel M. Wells; Geng Bang Jin; S. Skanthakumar; Eun Sang Choi; Mahalingam Balasubramanian; L. Soderholm; Donald E. Ellis; Mercouri G. Kanatzidis; James A. Ibers Oxidation State of Uranium in A6Cu12U2S15 (A = K, Rb, Cs) Compounds Inorganic Chemistry, 2012, 51, 6153-6163 |
| 4329960 | CIF | K0.5 S2 Sn0.75 Zn0.25 | P a -3 | 13.126; 13.126; 13.126 90; 90; 90 | 2261.5 | Zohreh Hassanzadeh Fard; Mercouri G. Kanatzidis Phase-Change Materials Exhibiting Tristability: Interconverting Forms of Crystalline α-, β-, and Glassy K2ZnSn3S8 Inorganic Chemistry, 2012, 51, 7963-7965 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!