Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1010202 | CIF | Ag Au Cl6 Cs2 | I 4/m m m | 7.38; 7.38; 11.01 90; 90; 90 | 599.7 | Elliott, N; Pauling, L The Crystal Structure of Cesium Aurous Auric Chloride, Cs~2~ Au Au Cl~6~, and Cesium Argentous Auric Chloride, Cs~2~ Ag Au Cl~6~ Journal of the American Chemical Society, 1938, 60, 1846-1851 |
| 4119062 | CIF | Ag Ba0.67 K0.33 Te2 | I 4/m m m | 4.624; 4.624; 23.326 90; 90; 90 | 498.742 | Kannewurf, C.R.; Kanatzidis, M.G.; Guo, H.-Y.; Zhang, X.; Hogan, T.; Li, J.; Lee, S.; Foran, B. Distorted square nets of tellurium in the novel quaternary polytelluride K0.33 Ba0.67 Ag Te2 Journal of the American Chemical Society, 1995, 117, 10513-10520 |
| 4131244 | CIF | Ag Bi Br6 Cs2 | F m -3 m | 11.2322; 11.2322; 11.2322 90; 90; 90 | 1417.08 | Slavney, Adam H.; Leppert, Linn; Bartesaghi, Davide; Gold-Parker, Aryeh; Toney, Michael F.; Savenije, Tom J.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Defect-Induced Band-Edge Reconstruction of a Bismuth-Halide Double Perovskite for Visible-Light Absorption. Journal of the American Chemical Society, 2017, 139, 5015-5018 |
| 6000558 | CIF | Ag F3 | P 61 2 2 | 5.0782; 5.0782; 15.4524 90; 90; 120 | 345.1 | Zemva, B.; Lutar, K.; Jesih, A.; Casteel, W. J.; Wilkinson, A. P.; Cox, D. E.; Vondreele, R. B.; Borrmann, H.; Bartlett, N. Silver trifluoride - preparation, crystal-structure, some properties, and comparison with AuF3 Journal of The American Chemical Society, 1991, 113, 4192-4198 |
| 4119063 | CIF | Ag F3 Zn | P m -3 m | 3.89; 3.89; 3.89 90; 90; 90 | 58.864 | Roy, R.; de Vries, R.C. Fluoride Models for Oxide Systems of Dielectric Interest. The Systems K F - Mg F2 and Ag F - Zn F2 Journal of the American Chemical Society, 1953, 75, 2479-2484 |
| 4120041 | CIF | Ag F4 Li O4 V2 | P 1 2/c 1 | 9.9951; 5.6771; 4.868 90; 90.596; 90 | 276.211 | Martin D. Donakowski; Arno Görne; John T. Vaughey; Kenneth R. Poeppelmeier AgNa(VO2F2)2: A Trioxovanadium Fluoride with Unconventional Electrochemical Properties Journal of the American Chemical Society, 2013, 135, 9898-9906 |
| 4120040 | CIF | Ag F4 Na O4 V2 | P 1 2/c 1 | 10.3826; 5.8079; 4.9429 90; 90.072; 90 | 298.06 | Martin D. Donakowski; Arno Görne; John T. Vaughey; Kenneth R. Poeppelmeier AgNa(VO2F2)2: A Trioxovanadium Fluoride with Unconventional Electrochemical Properties Journal of the American Chemical Society, 2013, 135, 9898-9906 |
| 4111757 | CIF | Ag Fe3 H6 O14 S2 | R -3 m :H | 7.33; 7.33; 16.497 90; 90; 120 | 767.62 | Bart M. Bartlett; Daniel G. Nocera Long-Range Magnetic Ordering in Iron Jarosites Prepared by Redox-Based Hydrothermal Methods Journal of the American Chemical Society, 2005, 127, 8985-8993 |
| 4111782 | CIF | Ag Sb Te2 | P m -3 m | 6.0667; 6.0667; 6.0667 90; 90; 90 | 223.28 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111783 | CIF | Ag Sb Te2 | P 4/m m m | 4.2898; 4.2898; 6.0667 90; 90; 90 | 111.64 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111784 | CIF | Ag Sb Te2 | R -3 m :H | 4.2898; 4.2898; 21.016 90; 90; 120 | 334.93 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111792 | CIF | Ag0.13 Pb1.75 Sb0.13 Te2 | P 4/m m m | 4.5538; 4.5538; 6.4404 90; 90; 90 | 133.56 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111790 | CIF | Ag0.19 Pb1.62 Sb0.19 Te2 | P 4/m m m | 4.5453; 4.5453; 6.428 90; 90; 90 | 132.8 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4119061 | CIF | Ag0.24 Al6 Br1.88 Na7.76 O24 Si6 | P -4 3 n | 8.9289; 8.9289; 8.9289 90; 90; 90 | 711.859 | Ozin, G.A.; MacDonald, P.M.; Stucky, G.D.; Stein, A.; Jelinek, R. Silver, sodium halosodalites: class A sodalites Journal of the American Chemical Society, 1992, 114, 5171-5186 |
| 4111788 | CIF | Ag0.25 Pb1.5 Sb0.25 Te2 | P 4/m m m | 4.5377; 4.5377; 6.4173 90; 90; 90 | 132.14 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111791 | CIF | Ag0.25 Pb3.5 Sb0.25 Te4 | P m -3 m | 6.4404; 6.4404; 6.4404 90; 90; 90 | 267.14 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111789 | CIF | Ag0.38 Pb3.23 Sb0.38 Te4 | P m -3 m | 6.428; 6.428; 6.428 90; 90; 90 | 265.6 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111787 | CIF | Ag0.5 Pb3 Sb0.5 Te4 | P m -3 m | 6.4173; 6.4173; 6.4173 90; 90; 90 | 264.28 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4111786 | CIF | Ag0.67 Pb0.67 Sb0.67 Te2 | P 4/m m m | 4.3963; 4.3963; 6.2173 90; 90; 90 | 120.16 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4120251 | CIF | Ag0.86 Ca0.87 Pr0.14 Sb | P 63 m c | 4.7057; 4.7057; 7.788 90; 90; 120 | 149.35 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
| 4120252 | CIF | Ag0.87 Ca0.86 Nd0.14 Sb | P 63 m c | 4.6931; 4.6931; 7.753 90; 90; 120 | 147.88 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
| 4120253 | CIF | Ag0.88 Ca0.83 Sb Sm0.17 | P 63 m c | 4.7008; 4.7008; 7.759 90; 90; 120 | 148.48 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
| 4120250 | CIF | Ag0.9 Ca0.84 Ce0.16 Sb | P 63 m c | 4.7023; 4.7023; 7.7951 90; 90; 120 | 149.27 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
| 4120249 | CIF | Ag0.92 Ca0.89 La0.11 Sb | P 63 m c | 4.7029; 4.7029; 7.7921 90; 90; 120 | 149.25 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
| 4120248 | CIF | Ag0.93 Ca0.91 La0.09 Sb | C m c 21 | 4.7028; 8.146; 7.7921 90; 90; 90 | 298.51 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
| 4111785 | CIF | Ag1.33 Pb1.33 Sb1.33 Te4 | P m -3 m | 6.2173; 6.2173; 6.2173 90; 90; 90 | 240.33 | Eric Quarez; Kuei-Fang Hsu; Robert Pcionek; N. Frangis; E. K. Polychroniadis; Mercouri G. Kanatzidis Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions Journal of the American Chemical Society, 2005, 127, 9177-9190 |
| 4117413 | CIF | Ag1.5 F3 Mo Na1.5 O3 | R -3 :H | 5.754547; 5.754547; 28.503915 90; 90; 120 | 817.443 | Allyson M. Fry; Harry A. Seibel; Indunil N. Lokuhewa; Patrick M. Woodward Na1.5Ag1.5MO3F3(M = Mo, W): An Ordered Oxyfluoride Derivative of the LiNbO3Structure Journal of the American Chemical Society, 2012, 134, 2621-2625 |
| 4117414 | CIF | Ag1.5 F3 Na1.5 O3 W | R -3 :H | 5.741466; 5.741466; 28.63794 90; 90; 120 | 817.557 | Allyson M. Fry; Harry A. Seibel; Indunil N. Lokuhewa; Patrick M. Woodward Na1.5Ag1.5MO3F3(M = Mo, W): An Ordered Oxyfluoride Derivative of the LiNbO3Structure Journal of the American Chemical Society, 2012, 134, 2621-2625 |
| 4119064 | CIF | Ag11.48 Al12 O48 Si12 | P m -3 m | 12.248; 12.248; 12.248 90; 90; 90 | 1837.36 | Kim, Y.; Seff, K. The octahedral hexasilver molecule. Seven crystal structures of variously vacuum-dehydrated fully Ag+ -exchanged zeolite A Journal of the American Chemical Society, 1978, 100, 6989-6997 |
| 4119065 | CIF | Ag11.888 Al12 O48 Si12 | P m -3 m | 12.333; 12.333; 12.333 90; 90; 90 | 1875.89 | Seff, K.; Kim, Y. The octahedral hexasilver molecule. Seven crystal structures of variously vacuum-dehydrated fully Ag+ -exchanged zeolite A Journal of the American Chemical Society, 1978, 100, 6989-6997 |
| 4124443 | CIF | Ag12 Al12 Cl14.248 H2.25 O48 Si12 | P m -3 m | 12.244; 12.244; 12.244 90; 90; 90 | 1835.57 | Kim, Y.; Seff, K. Oxidation of hexasilver to silver chloride by dichlorine. Crystal structure of H2.25 Ag12 Cl2.25 Si12 Al12 O48 * (Cl2)6 a chlorine sorption complex of partially dehydrated fully Ag+ -exchanged ... Journal of the American Chemical Society, 1978, 100, 3801-3805 |
| 4119066 | CIF | Ag12 Al12 O48 Si12 | P m -3 m | 12.295; 12.295; 12.295 90; 90; 90 | 1858.6 | Kim, Y.; Seff, K. Structure of a very small piece of silver metal. The octahedral Ag6 molecule. Two crystal structures of partially decomposed vacuum-dehydrated fully Ag+ -exchanged zeolite A Journal of the American Chemical Society, 1977, 99, 7055-7057 |
| 4108613 | CIF | Ag2 Ba2 O2 Se2 Zn0.953 | C m c a | 19.8377; 6.0562; 6.057 90; 90; 90 | 727.69 | Sebastian J. C. Herkelrath; Ian Saratovsky; Joke Hadermann; Simon J. Clarke Fragmentation of an Infinite ZnO2 Square Plane into Discrete [ZnO2]2- Linear Units in the Oxyselenide Ba2ZnO2Ag2Se2 Journal of the American Chemical Society, 2008, 130, 14426-14427 |
| 4108614 | CIF | Ag2 Ba2 O2 Se2 Zn0.955 | I 4/m m m | 4.2849; 4.2849; 19.8793 90; 90; 90 | 364.99 | Sebastian J. C. Herkelrath; Ian Saratovsky; Joke Hadermann; Simon J. Clarke Fragmentation of an Infinite ZnO2 Square Plane into Discrete [ZnO2]2- Linear Units in the Oxyselenide Ba2ZnO2Ag2Se2 Journal of the American Chemical Society, 2008, 130, 14426-14427 |
| 4119067 | CIF | Ag2 Ca1.5 Nb3 O10 | I 4/m m m | 3.8994; 3.8994; 29.015 90; 90; 90 | 441.182 | Woodward, P.M.; Bhuvanesh, N.S.P. Thermally induced A' - A site exchange in novel layered perovskitesAg2 (Ca1.5 M3 O10) (M = Nb, Ta) Journal of the American Chemical Society, 2002, 124, 14294-14295 |
| 4119068 | CIF | Ag2 Cs2 Te4 Zr | C 2 2 2 | 6.508; 15.164; 6.518 90; 90; 90 | 643.244 | Ibers, J.A.; Pell, M.A. Cs2 Ag2 Zr Te4 : a new layered telluride containing tetrahedrally coordinated zirconium Journal of the American Chemical Society, 1995, 117, 6284-6286 |
| 1010623 | CIF | Ag2 Mo O4 | F d -3 m :1 | 9.26; 9.26; 9.26 90; 90; 90 | 794 | Wyckoff, R W G The crystal structure of silver molybdate Journal of the American Chemical Society, 1922, 44, 1994-1997 |
| 4124775 | CIF | Ag2 Mo O4 | F d -3 m :1 | 9.26; 9.26; 9.26 90; 90; 90 | 794.023 | Donohue, J.; Shand, W. The determination of the interatomic distances in silver molybdate, Ag2 Mo O4 Journal of the American Chemical Society, 1947, 69, 222-223 |
| 4112388 | CIF | Ag3 Li17 Sn6 | P 3 1 m | 8.063; 8.063; 8.51 90; 90; 120 | 479.1 | Corina Lupu; Craig Downie; Arnold M. Guloy; Thomas A. Albright; Jiang-Gao Mao Li17Ag3Sn6: A Polar Intermetallic π-System with Carbonate-like [AgSn3]11- Anions and Trefoil Aromatic [Ag2Sn3]6- Layers Journal of the American Chemical Society, 2004, 126, 4386-4397 |
| 4111653 | CIF | Ag4 F2 O6 V2 | P 1 21/n 1 | 5.5937; 10.5483; 12.4593 90; 90.314; 90 | 735.14 | Erin M. Sorensen; Heather K. Izumi; John T. Vaughey; Charlotte L. Stern; Kenneth R. Poeppelmeier Ag4V2O6F2: An Electrochemically Active and High Silver Density Phase Journal of the American Chemical Society, 2005, 127, 6347-6352 |
| 4115680 | CIF | Ag4 I4 O24 U4 | P 1 21/n 1 | 15.04; 8.051; 18.332 90; 100.738; 90 | 2180.9 | Amanda C. Bean; Charles F. Campana; Ohyun Kwon; Thomas E. Albrecht-Schmitt A New Oxoanion: [IO4]3- Containing I(V) with a Stereochemically Active Lone-Pair in the Silver Uranyl Iodate Tetraoxoiodate(V), Ag4(UO2)4(IO3)2(IO4)2O2 Journal of the American Chemical Society, 2001, 123, 8806-8810 |
| 4124777 | CIF | Ag66.31 Al96.9 H27 O384 Si96 | F m -3 c | 24.548; 24.548; 24.548 90; 90; 90 | 14792.7 | Gellens, L.R.; Pluth, J.J.; Smith, J.V. Crystal structure of vacuum-dehydrated silver hydrogen zeolite A Journal of the American Chemical Society, 1983, 105, 51-55 |
| 4124444 | CIF | Ag7.48 Al12 O48 Si12 | P m -3 m | 12.279; 12.279; 12.279 90; 90; 90 | 1851.35 | Kim, Y.; Seff, K. The octahedral hexasilver molecule. Seven crystal structures of variously vacuum-dehydrated fully Ag+ -exchanged zeolite A Journal of the American Chemical Society, 1978, 100, 6989-6997 |
| 4124442 | CIF | Ag8 Al12 H45 N27 O48 Si12 | P m -3 m | 12.295; 12.295; 12.295 90; 90; 90 | 1858.6 | Kim, Y.; Gilje, J.W.; Seff, K. Synthesis and structures of two new hydrides of nitrogen, triazane (N3 H5) and cyclotriazane (N3 H3). Crystallographic ... analyses of vacuum-dehydrated patially decomposed fully Ag+ -exchanged Zeolite A ... Journal of the American Chemical Society, 1977, 99, 7057-7059 |
| 4119069 | CIF | Ag9.26 Al12 O48 Si12 | P m -3 m | 12.148; 12.148; 12.148 90; 90; 90 | 1792.73 | Kim, Y.; Seff, K. The octahedral hexasilver molecule. Seven crystal structures of variously vacuum-dehydrated fully Ag+ -exchanged zeolite A Journal of the American Chemical Society, 1978, 100, 6989-6997 |
| 4105867 | CIF | Al B5 H38 Li2 N6 | P -3 c 1 | 7.79779; 7.79779; 15.96933 90; 90; 120 | 840.931 | Yanhui Guo; Hui Wu; Wei Zhou; Xuebin Yu Dehydrogenation Tuning of Ammine Borohydrides Using Double-Metal Cations Journal of the American Chemical Society, 2011, 133, 4690-4693 |
| 4120551 | CIF | Al Ba N5 O3 Si4 | A 21 a m | 9.48461; 13.47194; 5.773234 90; 90; 90 | 737.681 | Park, Woon Bae; Singh, Satendra Pal; Sohn, Kee-Sun Discovery of a phosphor for light emitting diode applications and its structural determination, ba(si,al)5(o,n)8:eu(2+). Journal of the American Chemical Society, 2014, 136, 2363-2373 |
| 4135474 | CIF | Al Bi11 Ca13.9 La0.1 | I 41/a c d :2 | 17.029; 17.029; 22.689 90; 90; 90 | 6579.5 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4103367 | CIF | Al Bi2 Br Cl4 Te2 | C 1 2/c 1 | 21.2247; 8.4778; 13.2264 90; 99.28; 90 | 2348.8 | Kanishka Biswas; Qichun Zhang; In Chung; Jung-Hwan Song; John Androulakis; Arthur J. Freeman; Mercouri G. Kanatzidis Synthesis in Ionic Liquids: [Bi2Te2Br](AlCl4), a Direct Gap Semiconductor with a Cationic Framework Journal of the American Chemical Society, 2010, 132, 14760-14762 |
| 4103366 | CIF | Al Br Cl4 Sb2 Te2 | C 1 2/c 1 | 21.216; 8.2816; 13.126 90; 98.71; 90 | 2279.7 | Kanishka Biswas; Qichun Zhang; In Chung; Jung-Hwan Song; John Androulakis; Arthur J. Freeman; Mercouri G. Kanatzidis Synthesis in Ionic Liquids: [Bi2Te2Br](AlCl4), a Direct Gap Semiconductor with a Cationic Framework Journal of the American Chemical Society, 2010, 132, 14760-14762 |
| 4124695 | CIF HKL | Al Ca4 Mg1.5 O14 Si3.5 | P -4 21 m | 7.79644; 7.79644; 5.0119 90; 90; 90 | 304.65 | Zhiguo Xia; C.-G. Ma; Maxim Molokeev; Quanlin Liu; Karl Rickert; Kenneth Poeppelmeier Chemical Unit Cosubstitution and Tuning of Photoluminescence in the Ca2(Al1-xMgx)(Al1-xSi1+x)O7:Eu2+ Phosphor Journal of the American Chemical Society, 2015, 137, 12494-12497 |
| 4124466 | CIF | Al Cs0.69 I14 Zr6 | C m c a | 15.907; 14.284; 12.973 90; 90; 90 | 2947.67 | Smith, J.D.; Corbett, J.D. Four zirconium iodide cluster phases centered by boron, aluminum, or silicon Journal of the American Chemical Society, 1986, 108, 1927-1934 |
| 4124633 | CIF | Al F1.5 H2.25 O1.875 | F d -3 m :1 | 9.829; 9.829; 9.829 90; 90; 90 | 949.572 | Cowley, J.M.; Scott, R.T. Basic Fluorides of Aluminum Journal of the American Chemical Society, 1948, 70, 105-109 |
| 1010086 | CIF | Al F6 H12 N3 | F -4 3 m | 8.4; 8.4; 8.4 90; 90; 90 | 592.7 | Pauling, L The Crystal Structures of Ammonium Fluoferrate, Fluoaluminate and Oxyfluomolybdate Journal of the American Chemical Society, 1924, 46, 2738-2751 |
| 4116390 | CIF | Al K5 O57 W12 | P 62 2 2 | 19.072; 19.072; 12.5658 90; 90; 120 | 3958.34 | Ira A. Weinstock; Jennifer J. Cowan; Elena M. G. Barbuzzi; Huadong Zeng; Craig L. Hill Equilibria between α and β Isomers of Keggin Heteropolytungstates Journal of the American Chemical Society, 1999, 121, 4608-4617 |
| 4125060 | CIF | Al Nd9.906 O26 Si5 | P 63/m | 9.553; 9.553; 7.0496 90; 90; 120 | 557.153 | An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society, 2016, 138, 4468-4483 |
| 4124784 | CIF | Al O | F m -3 m | 5.67; 5.67; 5.67 90; 90; 90 | 182.284 | Hoch, M.; Johnston, H.L. Formation, Stability and Crystal Structure of the Solid Aluminium Suboxides. Al2 O and Al O Journal of the American Chemical Society, 1954, 76, 2560-2561 |
| 4123961 | CIF | Al O4 P | P -1 | 8.784; 8.784; 12.85 110.43; 98.5; 104.92 | 866.319 | Loiseau, T.; Mellot-Draznieks, C.; Taulelle, F.; Girard, S.; Sassoye, C.; Ferey, G.; Huguenard, C.; Guillou, N. Chemistry - structure - simulation or chemistry - simulation - structure sequences? the case of MIL-34, a new porous aluminophosphate Journal of the American Chemical Society, 2001, 123, 9642-9651 |
| 4118799 | CIF HKL | Al0.1 Na0.09 O Si0.4 | I -4 3 m | 14.41336; 14.41336; 14.41336 90; 90; 90 | 2994.3 | Magdalena M. Lozinska; Enzo Mangano; John P. S. Mowat; Ashley M. Shepherd; Russell F. Howe; Stephen P. Thompson; Julia E. Parker; Stefano Brandani; Paul A. Wright Understanding Carbon Dioxide Adsorption on Univalent Cation Forms of the Flexible Zeolite Rho at Conditions Relevant to Carbon Capture from Flue Gases Journal of the American Chemical Society, 2012, 134, 17628-17642 |
| 4125061 | CIF | Al0.5 Nd9.652 O26 Si5.5 | P 63/m | 9.5515; 9.5515; 7.042 90; 90; 120 | 556.378 | An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society, 2016, 138, 4468-4483 |
| 4135471 | CIF | Al0.85 Bi11 Ca13.96 Lu0.18 | I 41/a c d :2 | 17.0165; 17.0165; 22.73 90; 90; 90 | 6581.7 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4135472 | CIF | Al0.86 Bi11 Ca13.95 Lu0.19 | I 41/a c d :2 | 17.026; 17.026; 22.735 90; 90; 90 | 6590.5 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4135470 | CIF | Al0.88 Bi11 Ca13.95 Lu0.17 | I 41/a c d :2 | 17.0115; 17.0115; 22.696 90; 90; 90 | 6568 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4135469 | CIF | Al0.89 Bi11 Ca13.95 Lu0.16 | I 41/a c d :2 | 17.0092; 17.0092; 22.7001 90; 90; 90 | 6567.4 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4135468 | CIF | Al0.9 Bi11 Ca13.94 Lu0.16 | I 41/a c d :2 | 16.9893; 16.9893; 22.6602 90; 90; 90 | 6540.6 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4135473 | CIF | Al0.93 Bi11 Ca13.91 Tm0.17 | I 41/a c d :2 | 17.019; 17.019; 22.714 90; 90; 90 | 6579 | Baranets, Sviatoslav; Bobev, Svilen Caught in Action. The Late Rare Earths Thulium and Lutetium Substituting Aluminum Atoms in the Structure of Ca14AlBi11 Journal of the American Chemical Society, 2020 |
| 4125057 | CIF | Al1.5 Nd9.959 O26 Si4.5 | P 63/m | 9.5611; 9.5611; 7.0607 90; 90; 120 | 558.977 | An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society, 2016, 138, 4468-4483 |
| 4120618 | CIF | Al1.67 Au7.33 Sr2 | C 1 2/c 1 | 14.956; 8.5641; 8.6718 90; 123.86; 90 | 922.3 | Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society, 2014, 136, 3108 |
| 4120617 | CIF | Al1.95 Au5.05 Sr | P n m a | 8.9424; 7.232; 9.9182 90; 90; 90 | 641.42 | Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society, 2014, 136, 3108 |
| 4124702 | CIF | Al12 Ca3.4 D5.2 O96 Si36 | I -4 3 m | 13.9645; 13.9645; 13.9645 90; 90; 90 | 2723.18 | Corbin, D.R.; Abrams, L.; Stucky, G.D.; Jones, G.A.; Eddy, M.M.; Harrison, W.T.A.; Cox, D.E. Flexibility of the zeolite RHO framework. In situ X-ray and neutron powder structural characterization of divalent cation-exchanged zeolite RHO Journal of the American Chemical Society, 1990, 112, 4821-4830 |
| 4124701 | CIF | Al12 Ca3.948 O96 Si36 | I -4 3 m | 14.11; 14.11; 14.11 90; 90; 90 | 2809.19 | Corbin, D.R.; Abrams, L.; Stucky, G.D.; Eddy, M.M.; Harrison, W.T.A.; Jones, G.A.; Cox, D.E. Flexibility of the zeolite RHO framework. In situ X-ray and neutron powder structural characterization of divalent cation-exchanged zeolite RHO Journal of the American Chemical Society, 1990, 112, 4821-4830 |
| 4124433 | CIF | Al12 Ca6 O48 Si12 | P m -3 m | 12.278; 12.278; 12.278 90; 90; 90 | 1850.9 | Firor, R.L.; Seff, K. Near zero coordinate Ca2+ and Sr2+ in zeolite A. Crystal structures of dehydrated Ca6-A and Sr6-A Journal of the American Chemical Society, 1978, 100, 3091-3096 |
| 4124797 | CIF | Al12 Cd6 H6 O51 Si12 | P m -3 m | 12.291; 12.291; 12.291 90; 90; 90 | 1856.79 | McCusker, L.B.; Seff, K. Cadmium(I) and dicadmium(I). Crystal structures of cadmium(II) exchanged zeolite A evacuated at 500 C and of its cadmium sorption complex Journal of the American Chemical Society, 1979, 101, 5235-5239 |
| 4124793 | CIF | Al12 Cd8 H6 O51 Si12 | P m -3 m | 12.242; 12.242; 12.242 90; 90; 90 | 1834.67 | McCusker, L.B.; Seff, K. Cadmium(I) and dicadmium(I). Crystal structures of cadmium(II) exchanged zeolite A evacuated at 500 C and of its cadmium sorption complex Journal of the American Chemical Society, 1979, 101, 5235-5239 |
| 4124448 | CIF | Al12 Cd9.5 Cl4 H11 O55 Si12 | P m -3 m | 12.219; 12.219; 12.219 90; 90; 90 | 1824.34 | McCusker, L.B.; Seff, K. Zero-coordinate cadmium(II). Over ion exchange. Crystal structures of hydrated and dehydrated zeolite A exchanged with Cd Cl2 to give Cd9.5 Cl4 (O H)3 -A Journal of the American Chemical Society, 1978, 100, 5052-5057 |
| 4124447 | CIF | Al12 Cd9.5 Cl4 H3 O51 Si12 | P m -3 m | 12.269; 12.269; 12.269 90; 90; 90 | 1846.83 | McCusker, L.B.; Seff, K. Zero-coordinate cadmium(II). Over ion exchange. Crystal structures of hydrated and dehydrated zeolite A exchanged with Cd Cl2 to give Cd9.5 Cl4 (O H)3 -A Journal of the American Chemical Society, 1978, 100, 5052-5057 |
| 4124467 | CIF | Al12 Cl8 Co4 Na4 O48 Si12 | P m -3 m | 12.099; 12.099; 12.099 90; 90; 90 | 1771.12 | Subramanian, V.; Seff, K.; Ottersen, T. A molecular chlorine complex of cobalt(II). The crystal structure of a dichlorine sorption complex of dehydrated cobalt(II)- exchanged sodium zeolite A, Co4 Na4 - A (Cl2)4 Journal of the American Chemical Society, 1978, 100, 2911-2913 |
| 4124432 | CIF | Al12 Cl8 Eu5.48 Na O48 Si12 | P m -3 m | 12.251; 12.251; 12.251 90; 90; 90 | 1838.72 | Firor, R.L.; Seff, K. Five-coordinate europium(IV) and zero-coordinate europium(II). Crystal structure of dehydrated near-fully europium(II)-exchanged zeolite A, Eu5.5 Na-A partially oxidized by chlorine Journal of the American Chemical Society, 1978, 100, 978-980 |
| 4124439 | CIF | Al12 Cs12.48 O48 Si12 | P m -3 m | 12.279; 12.279; 12.279 90; 90; 90 | 1851.35 | Heo, N.-H.; Seff, K. Reaction of dehydrated Na12-A with cesium. Synthesis and crystal structure of fully dehydrated, fully Cs+ -exchanged Zeolite A Journal of the American Chemical Society, 1987, 109, 7986-7992 |
| 4124427 | CIF | Al12 Cs7 K5 O48 Si12 | P m -3 m | 12.266; 12.266; 12.266 90; 90; 90 | 1845.48 | Firor, R.L.; Seff, K. Zero-coordinate K+: Crystal structure of dehydrated cesium and potassium exchanged zeolite A. Cs7 K5 - A Journal of the American Chemical Society, 1977, 99, 6249-6253 |
| 4124438 | CIF | Al12 Cs9.08 Na3.52 O48 Si12 | P m -3 m | 12.252; 12.252; 12.252 90; 90; 90 | 1839.17 | Heo, N.-H.; Seff, K. Reaction of dehydrated Na12-A with cesium. Synthesis and crystal structure of fully dehydrated, fully Cs+ -exchanged Zeolite A Journal of the American Chemical Society, 1987, 109, 7986-7992 |
| 4124431 | CIF | Al12 Eu4.504 Na0.9996 O50.752 Si12 | P m -3 m | 12.238; 12.238; 12.238 90; 90; 90 | 1832.87 | Firor, R.L.; Seff, K. Europium(IV), a new oxidation state for europium. crystal structure of dehydrated europium(II)-exchanged sodium zeolite A, Eu4.5 Na3-A, partially oxidized by oxygen Journal of the American Chemical Society, 1978, 100, 976-978 |
| 4124428 | CIF | Al12 Eu5.75 Na0.5 O48 Si12 | P m -3 m | 12.296; 12.296; 12.296 90; 90; 90 | 1859.05 | Firor, R.L.; Seff, K. Near-zero-coordinate, three-coordinate, and four-coordinate europium(II). Bonding effects involving europium(II) valence orbitals. Crystal structure of dehydrated near-fully europium(II)- exchanged zeolite A Journal of the American Chemical Society, 1977, 99, 7059-7061 |
| 4124426 | CIF | Al12 H14 Na O55 Rb11 Si12 | P m -3 m | 12.321; 12.321; 12.321 90; 90; 90 | 1870.42 | Firor, R.L.; Seff, K. Zero-coordinate Rb+. The dehydrated and hydrated crystal structures of eleven-twelfths rubidium-exchanged zeolite A Journal of the American Chemical Society, 1977, 99, 1112-1117 |
| 4124429 | CIF | Al12 H19 O58 Si12 Tl13 | P m -3 m | 12.38; 12.38; 12.38 90; 90; 90 | 1897.41 | Firor, R.L.; Seff, K. Near-zero-coordinate thallium(I). The crystal structures of hydrated and dehydrated zeolite A fully exchanged with Tl O H Journal of the American Chemical Society, 1977, 99, 4039-4044 |
| 4124675 | CIF | Al12 Li8 Na4 O48 Si12 | P m -3 m | 12.04; 12.04; 12.04 90; 90; 90 | 1745.34 | Reed, T.B.; Breck, D.W. Crystalline zeolites. II. Crystal structure of synthetic zeolite, type A Journal of the American Chemical Society, 1956, 78, 5972-5977 |
| 4124700 | CIF | Al12 N4.104 O96 Si36 | I -4 3 m | 14.41; 14.41; 14.41 90; 90; 90 | 2992.21 | Corbin, D.R.; Cox, D.E.; Abrams, L.; Jones, G.A.; Harrison, W.T.A.; Eddy, M.M.; Stucky, G.D. Flexibility of the zeolite RHO framework. In situ X-ray and neutron powder structural characterization of divalent cation-exchanged zeolite RHO Journal of the American Chemical Society, 1990, 112, 4821-4830 |
| 4124425 | CIF | Al12 Na O48 Rb11 Si12 | P m -3 m | 12.261; 12.261; 12.261 90; 90; 90 | 1843.22 | Firor, R.L.; Seff, K. Zero-coordinate Rb+. The dehydrated and hydrated crystal structures of eleven-twelfths rubidium-exchanged zeolite A Journal of the American Chemical Society, 1977, 99, 1112-1117 |
| 4124673 | CIF | Al12 Na12 O48 Si12 | P m -3 m | 12.32; 12.32; 12.32 90; 90; 90 | 1869.96 | Reed, T.B.; Breck, D.W. Crystalline zeolites. II. Crystal structure of synthetic zeolite, type A Journal of the American Chemical Society, 1956, 78, 5972-5977 |
| 4124674 | CIF | Al12 Na4 O48 Si12 Tl8 | P m -3 m | 12.33; 12.33; 12.33 90; 90; 90 | 1874.52 | Reed, T.B.; Breck, D.W. Crystalline zeolites. II. Crystal structure of synthetic zeolite, type A Journal of the American Chemical Society, 1956, 78, 5972-5977 |
| 4124430 | CIF | Al12 O48 Si12 Tl12 | P m -3 m | 12.18; 12.18; 12.18 90; 90; 90 | 1806.93 | Firor, R.L.; Seff, K. Near-zero-coordinate thallium(I). The crystal structures of hydrated and dehydrated zeolite A fully exchanged with Tl O H Journal of the American Chemical Society, 1977, 99, 4039-4044 |
| 4123932 | CIF | Al15 H132.4 Mo12 O118.7 | C 1 2/c 1 | 28.24919; 15.7094; 24.424 90; 102.337; 90 | 10588.5 | Son, J.-H.; Kwon, Y.-U.; Choi, H. Porous crystal formation from polyoxometalate building blocks: single-crystal structure of (Al O4 Al12 (O H)12 (H2 O)24) (Al (O H)6 No6 O18)2 (O H) . 29.5(H2 O) Journal of the American Chemical Society, 2000, 122, 7432-7433 |
| 4124503 | CIF | Al16 H32 Na16 O96 Si24 | F d d 2 | 18.226; 18.583; 6.579 90; 90; 90 | 2228.27 | Lee, Y.; Vogt, T.; Parise, J.B.; Hriljac, J.A.; Artioli, G. Pressure-induced volume expansion of zeolites in the natrolite family Journal of the American Chemical Society, 2002, 124, 5466-5475 |
| 4124504 | CIF | Al16 H64 Na16 O112 Si24 | F d d 2 | 18.39; 18.829; 6.547 90; 90; 90 | 2267 | Lee, Y.; Vogt, T.; Hriljac, J.A.; Parise, J.B.; Artioli, G. Pressure-induced volume expansion of zeolites in the natrolite family Journal of the American Chemical Society, 2002, 124, 5466-5475 |
| 4124505 | CIF | Al16 H64 Na16 O112 Si24 | F d d 2 | 17.924; 18.325; 6.487 90; 90; 90 | 2130.7 | Lee, Y.; Vogt, T.; Hriljac, J.A.; Parise, J.B.; Artioli, G. Pressure-induced volume expansion of zeolites in the natrolite family Journal of the American Chemical Society, 2002, 124, 5466-5475 |
| 4123227 | CIF | Al18 O111 P18 | P 63 | 18.9377; 18.9377; 8.0529 90; 90; 120 | 2501.1 | Alabarse, Frederico G.; Rouquette, Jérôme; Coasne, Benoît; Haidoux, Abel; Paulmann, Carsten; Cambon, Olivier; Haines, Julien Mechanism of H2O Insertion and Chemical Bond Formation in AlPO4-54·xH2O at High Pressure. Journal of the American Chemical Society, 2015, 137, 584-587 |
| 4123228 | CIF | Al18 O111 P18 | P 63 | 18.7342; 18.7342; 7.8979 90; 90; 120 | 2400.56 | Alabarse, Frederico G.; Rouquette, Jérôme; Coasne, Benoît; Haidoux, Abel; Paulmann, Carsten; Cambon, Olivier; Haines, Julien Mechanism of H2O Insertion and Chemical Bond Formation in AlPO4-54·xH2O at High Pressure. Journal of the American Chemical Society, 2015, 137, 584-587 |
| 4123229 | CIF | Al18 O111 P18 | P 63 | 18.822; 18.822; 7.9759 90; 90; 120 | 2447 | Alabarse, Frederico G.; Rouquette, Jérôme; Coasne, Benoît; Haidoux, Abel; Paulmann, Carsten; Cambon, Olivier; Haines, Julien Mechanism of H2O Insertion and Chemical Bond Formation in AlPO4-54·xH2O at High Pressure. Journal of the American Chemical Society, 2015, 137, 584-587 |
| 4123230 | CIF | Al18 O111 P18 | P 63 | 18.956; 18.956; 8.086 90; 90; 120 | 2516.3 | Alabarse, Frederico G.; Rouquette, Jérôme; Coasne, Benoît; Haidoux, Abel; Paulmann, Carsten; Cambon, Olivier; Haines, Julien Mechanism of H2O Insertion and Chemical Bond Formation in AlPO4-54·xH2O at High Pressure. Journal of the American Chemical Society, 2015, 137, 584-587 |
| 4123231 | CIF | Al18 O111 P18 | P 63 | 18.8821; 18.8821; 8.0281 90; 90; 120 | 2478.8 | Alabarse, Frederico G.; Rouquette, Jérôme; Coasne, Benoît; Haidoux, Abel; Paulmann, Carsten; Cambon, Olivier; Haines, Julien Mechanism of H2O Insertion and Chemical Bond Formation in AlPO4-54·xH2O at High Pressure. Journal of the American Chemical Society, 2015, 137, 584-587 |
| 4101096 | CIF | Al19.2 Co12.8 O128 P32 | C 1 2/c 1 | 10.2959; 14.3715; 28.599 90; 91.094; 90 | 4231 | Morris, Russell Journal of the American Chemical Society, 2006 |
| 4120552 | CIF | Al2 Ba N4 O4 Si3 | A 21 a m | 9.47791; 13.45426; 5.7694 90; 90; 90 | 735.704 | Park, Woon Bae; Singh, Satendra Pal; Sohn, Kee-Sun Discovery of a phosphor for light emitting diode applications and its structural determination, ba(si,al)5(o,n)8:eu(2+). Journal of the American Chemical Society, 2014, 136, 2363-2373 |
| 4124699 | CIF HKL | Al2 Ca2 O7 Si | P -4 21 m | 7.67231; 7.67231; 5.05923 90; 90; 90 | 297.81 | Zhiguo Xia; C.-G. Ma; Maxim Molokeev; Quanlin Liu; Karl Rickert; Kenneth Poeppelmeier Chemical Unit Cosubstitution and Tuning of Photoluminescence in the Ca2(Al1-xMgx)(Al1-xSi1+x)O7:Eu2+ Phosphor Journal of the American Chemical Society, 2015, 137, 12494-12497 |
| 9014359 | CIF | Al2 Ca3 O6 | P m -3 m | 7.624; 7.624; 7.624 90; 90; 90 | 443.148 | Steele, F. A.; Davey, W. P. The crystal structure of tricalcium aluminate Journal of the American Chemical Society, 1929, 51, 2283-2293 |
| 4124696 | CIF HKL | Al2 Ca4 Mg O14 Si3 | P -4 21 m | 7.73707; 7.73707; 5.02948 90; 90; 90 | 301.08 | Zhiguo Xia; C.-G. Ma; Maxim Molokeev; Quanlin Liu; Karl Rickert; Kenneth Poeppelmeier Chemical Unit Cosubstitution and Tuning of Photoluminescence in the Ca2(Al1-xMgx)(Al1-xSi1+x)O7:Eu2+ Phosphor Journal of the American Chemical Society, 2015, 137, 12494-12497 |
| 4124783 | CIF | Al2 O | F m -3 m | 4.98; 4.98; 4.98 90; 90; 90 | 123.506 | Hoch, M.; Johnston, H.L. Formation, Stability and Crystal Structure of the Solid Aluminium Suboxides. Al2 O and Al O Journal of the American Chemical Society, 1954, 76, 2560-2561 |
| 1010914 | CIF | Al2 O3 | R -3 c :R | 5.12; 5.12; 5.12 55.28; 55.28; 55.28 | 84.5 | Pauling, L; Hendricks, S B Crystal Structures of Hematite and Corundum Journal of the American Chemical Society, 1925, 47, 781-790 |
| 4124434 | CIF | Al2 O8 Si2 Sr | P m -3 m | 12.316; 12.316; 12.316 90; 90; 90 | 1868.14 | Firor, R.L.; Seff, K. Near zero coordinate Ca2+ and Sr2+ in zeolite A. Crystal structures of dehydrated Ca6-A and Sr6-A Journal of the American Chemical Society, 1978, 100, 3091-3096 |
| 4120619 | CIF | Al2.82 Au6.18 Sr2 | R -3 c :H | 8.4475; 8.4475; 21.735 90; 90; 120 | 1343.2 | Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society, 2014, 136, 3108 |
| 4123413 | CIF | Al3 B3 F O10 Rb3 | P 3 1 c | 8.6819; 8.6819; 8.7423 90; 90; 120 | 570.67 | Zhao, Sangen; Gong, Pifu; Luo, Siyang; Liu, Sijie; Li, Lina; Asghar, Muhammad Adnan; Khan, Tariq; Hong, Maochun; Lin, Zheshuai; Luo, Junhua Beryllium-Free Rb3Al3B3O10F with Reinforced Interlayer Bonding as a Deep-Ultraviolet Nonlinear Optical Crystal. Journal of the American Chemical Society, 2015, 137, 2207-2210 |
| 4104728 | CIF | Al3 Br2 Cl12 S8 Sb7 | P 21 21 21 | 11.989; 16.896; 17.378 90; 90; 90 | 3520.2 | Qichun Zhang; In Chung; Joon I. Jang; John B. Ketterson; Mercouri G. Kanatzidis Chalcogenide Chemistry in Ionic Liquids: Nonlinear Optical Wave-Mixing Properties of the Double-Cubane Compound [Sb7S8Br2](AlCl4)3 Journal of the American Chemical Society, 2009, 131, 9896-9897 |
| 4124698 | CIF HKL | Al3 Ca4 Mg0.5 O14 Si2.5 | P -4 21 m | 7.69191; 7.69191; 5.04831 90; 90; 90 | 298.69 | Zhiguo Xia; C.-G. Ma; Maxim Molokeev; Quanlin Liu; Karl Rickert; Kenneth Poeppelmeier Chemical Unit Cosubstitution and Tuning of Photoluminescence in the Ca2(Al1-xMgx)(Al1-xSi1+x)O7:Eu2+ Phosphor Journal of the American Chemical Society, 2015, 137, 12494-12497 |
| 4123931 | CIF | Al3.53 Li2.05 Na1.61 O24 Si8.47 | R -3 m :R | 9.3385; 9.3385; 9.3385 93.482; 93.482; 93.482 | 809.686 | Smith, L.J.; Eckert, H.; Cheetham, A.K. Site preferences in the mixed cation zeolite, Li, Na-chabazite: a combined solid-state NMR and neutron diffraction study Journal of the American Chemical Society, 2000, 122, 1700-1708 |
| 4123930 | CIF | Al3.53 Li3.53 O24 Si8.47 | R -3 m :R | 9.3357; 9.3357; 9.3357 93.482; 93.482; 93.482 | 808.958 | Smith, L.J.; Eckert, H.; Cheetham, A.K. Site preferences in the mixed cation zeolite, Li, Na-chabazite: a combined solid-state NMR and neutron diffraction study Journal of the American Chemical Society, 2000, 122, 1700-1708 |
| 4123967 | CIF | Al52.996 Ru12 Si17.004 Sm8 | P m -3 m | 11.5101; 11.5101; 11.5101 90; 90; 90 | 1524.89 | Sieve, B.; Henning, R.; Chen, X.Z.; Kanatzidis, M.G.; Kannewurf, C.R.; Brazis, P.; Schultz, A.J.; Cowen, J.A. Cubic aluminium silicides RE8 Ru12 Al49 Si9 (Alx Si12-x) (RE = Pr, Sm) from liquid aluminum. Empty (Si, Al)12 cuboctahedral clusters and assignment of the Al/Si distribution with neutron diffraction Journal of the American Chemical Society, 2001, 123, 7040-7047 |
| 4123968 | CIF | Al53.44 Pr8 Ru12 Si16.56 | P m -3 m | 11.553; 11.553; 11.553 90; 90; 90 | 1542 | Sieve, B.; Chen, X.Z.; Henning, R.; Brazis, P.; Kannewurf, C.R.; Cowen, J.A.; Schultz, A.J.; Kanatzidis, M.G. Cubic aluminium silicides RE8 Ru12 Al49 Si9 (Alx Si12-x) (RE= Pr, Sm) from liquid aluminum. Empty (Si, Al)12 cuboctahedral clusters and assignment of the Al/Si distribution with neutron diffraction Journal of the American Chemical Society, 2001, 123, 7040-7047 |
| 4112389 | CIF | Al56 Ge3 Mn14 | P -3 | 11.098; 11.098; 10.3496 90; 90; 120 | 1103.9 | Li-Ming Wu; Dong-Kyun Seo Mn14Al56+xGe3-x (x= 0-0.6): A New Intermetallic Phase Containing Unprecedented "Half-Broken" Mackay Icosahedra as Building Units Journal of the American Chemical Society, 2004, 126, 4398-4403 |
| 4112390 | CIF | Al56.31 Ge2.69 Mn14 | P -3 | 11.1018; 11.1018; 10.3501 90; 90; 120 | 1104.7 | Li-Ming Wu; Dong-Kyun Seo Mn14Al56+xGe3-x (x= 0-0.6): A New Intermetallic Phase Containing Unprecedented "Half-Broken" Mackay Icosahedra as Building Units Journal of the American Chemical Society, 2004, 126, 4398-4403 |
| 4112391 | CIF | Al56.61 Ge2.39 Mn14 | P -3 | 11.103; 11.103; 10.3537 90; 90; 120 | 1105.4 | Li-Ming Wu; Dong-Kyun Seo Mn14Al56+xGe3-x (x= 0-0.6): A New Intermetallic Phase Containing Unprecedented "Half-Broken" Mackay Icosahedra as Building Units Journal of the American Chemical Society, 2004, 126, 4398-4403 |
| 4124691 | CIF | Al59 H48 Ni28.9 O408 Si133 | F d -3 m :2 | 24.45; 24.45; 24.45 90; 90; 90 | 14616.3 | Simpson, H.D.; Steinfink, H. An X-Ray diffraction study of the zeolite complex m-dichlorbenzene nickel faujasite Journal of the American Chemical Society, 1969, 91, 6225-6229 |
| 4120615 | CIF | Al7.62 Au13.38 Sr3 | P -6 2 m | 8.6644; 8.6644; 7.1068 90; 90; 120 | 462.04 | Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society, 2014, 136, 3108 |
| 4127194 | CIF | Al78 Fe23.78 Pt0.22 | C 1 2/m 1 | 15.4634; 8.0701; 12.4586 90; 107.686; 90 | 1481.24 | Yamada, Tsunetomo; Kojima, Takayuki; Abe, Eiji; Kameoka, Satoshi; Murakami, Yumi; Gille, Peter; Tsai, An Pang Probing Single Pt Atoms in Complex Intermetallic Al<sub>13</sub>Fe<sub>4</sub>. Journal of the American Chemical Society, 2018 |
| 4120616 | CIF | Al8.81 Au12.19 Sr3 | P -6 2 m | 8.633; 8.633; 7.0832 90; 90; 120 | 457.18 | Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society, 2014, 136, 3108 |
| 4123757 | CIF | Al9 B18 Cl2 O65.24 | P -3 c 1 | 14.58438; 14.58438; 12.22262 90; 90; 120 | 2251.49 | Chen, Hong; Ju, Jing; Meng, Qingpeng; Su, Jie; Lin, Cong; Zhou, Zhengyang; Li, Guobao; Wang, Weilu; Gao, Wenliang; Zeng, Chunmei; Tang, Chiu; Lin, Jianhua; Yang, Tao; Sun, Junliang PKU-3: An HCl-Inclusive Aluminoborate for Strecker Reaction Solved by Combining RED and PXRD. Journal of the American Chemical Society, 2015, 137, 7047-7050 |
| 4124454 | CIF | Al90.884 H2.25 O386 Si101.52 Sr45.44 | F m -3 c | 24.68; 24.68; 24.68 90; 90; 90 | 15032.6 | Pluth, J.J.; Smith, J.V. Crystal structure of dehydrated Sr-exchanged Zeolite A. Absence of near-zero-coordinate Sr2+. Presence of Al complex Journal of the American Chemical Society, 1982, 104, 6977-6982 |
| 4118156 | CIF | Am B9 O18 | P 1 21/n 1 | 7.703; 16.688; 9.872 90; 90.073; 90 | 1269 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4124687 | CIF | Am Cl O | P 4/n m m :1 | 4; 4; 6.78 90; 90; 90 | 108.48 | Templeton, D.H.; Dauben, C.H. Crystal Structures of Americium Compounds Journal of the American Chemical Society, 1953, 75, 4560-4562 |
| 4127110 | CIF | Am Cr2 Cs O8 | P -1 | 5.8341; 7.2548; 9.786 73.026; 88.581; 81.081 | 391.27 | Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E; Kaltsoyannis, Nikolas; Lanatà, Nicola Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis. Journal of the American Chemical Society, 2018 |
| 4127111 | CIF | Am Cr2 Cs O8 | P 1 2/c 1 | 9.1759; 5.5211; 7.7323 90; 98.691; 90 | 387.23 | Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E; Kaltsoyannis, Nikolas; Lanatà, Nicola Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis. Journal of the American Chemical Society, 2018 |
| 4124620 | CIF | Am F2 K O2 | R -3 m :R | 6.78; 6.78; 6.78 36.25; 36.25; 36.25 | 97.511 | Asprey, L.B.; Zachariasen, W.H.; Ellinger, F.H. Preparation, identification and crystal structure of a pentavalent americium compound, K Am O2 F2 Journal of the American Chemical Society, 1954, 76, 5235-5237 |
| 4124688 | CIF | Am2 O3 | I a -3 | 11.03; 11.03; 11.03 90; 90; 90 | 1341.92 | Templeton, D.H.; Dauben, C.H. Crystal Structures of Americium Compounds Journal of the American Chemical Society, 1953, 75, 4560-4562 |
| 4102049 | CIF | As Br F12 Kr2 O | P 1 21/c 1 | 5.7166; 13.6438; 15.1053 90; 111.446; 90 | 1096.6 | David S. Brock; Jonathan J. Casalis de Pury; Hélène P. A. Mercier; Gary J. Schrobilgen; Bernard Silvi A Rare Example of a Krypton Difluoride Coordination Compound: [BrOF2][AsF6].2KrF2 Journal of the American Chemical Society, 2010, 132, 3533-3542 |
| 4116386 | CIF | As Cl3 F6 | P 1 21/n 1 | 7.045; 11.001; 9.299 90; 94.42; 90 | 718.5 | Thomas Drews; Wolfram Koch; Konrad Seppelt The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11- Journal of the American Chemical Society, 1999, 121, 4379-4384 |
| 4101695 | CIF | As Cs3 S11 Ta2 | P 1 21/n 1 | 9.5967; 13.5926; 14.716 90; 98.876; 90 | 1896.6 | Bera, Tarun K.; Jang, Joon I.; Ketterson, John B.; Kanatzidis, Mercouri G. Strong second harmonic generation from the tantalum thioarsenates A3Ta2AsS11 (A = K and Rb). Journal of the American Chemical Society, 2009, 131, 75-77 |
| 4104434 | CIF | As F10 H2 N S | P -1 | 5.4447; 6.6457; 10.3063 89.484; 87.479; 74.955 | 359.79 | Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen Solid-State and Solution Rearrangements of F3S\τbNXeF+ Leading to the F4S=NXe+ Cation; Syntheses, HF Solvolyses, and Structural Characterizations of [F4S=NXe][AsF6] and [F4S=NH2][AsF6] Journal of the American Chemical Society, 2009, 131, 7272-7286 |
| 4105033 | CIF | As F10 H3 O Xe2 | I 4/m c m | 8.715; 8.715; 12.989 90; 90; 90 | 986.5 | Michael Gerken; Matthew D. Moran; Hélène P. A. Mercier; Bernard E. Pointner; Gary J. Schrobilgen; Berthold Hoge; Karl O. Christe; Jerry A. Boatz On the XeF+/H2O System: Synthesis and Characterization of the Xenon(II) Oxide Fluoride Cation, FXeOXeFXeF+ Journal of the American Chemical Society, 2009, 131, 13474-13489 |
| 4104433 | CIF | As F10 N S Xe | C 1 2/c 1 | 25.9305; 5.0875; 14.8171 90; 119.549; 90 | 1700.45 | Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen Solid-State and Solution Rearrangements of F3S\τbNXeF+ Leading to the F4S=NXe+ Cation; Syntheses, HF Solvolyses, and Structural Characterizations of [F4S=NXe][AsF6] and [F4S=NH2][AsF6] Journal of the American Chemical Society, 2009, 131, 7272-7286 |
| 4105031 | CIF | As F9 O Xe3 | P 1 c 1 | 6.7107; 9.115; 8.674 90; 96.851; 90 | 526.8 | Michael Gerken; Matthew D. Moran; Hélène P. A. Mercier; Bernard E. Pointner; Gary J. Schrobilgen; Berthold Hoge; Karl O. Christe; Jerry A. Boatz On the XeF+/H2O System: Synthesis and Characterization of the Xenon(II) Oxide Fluoride Cation, FXeOXeFXeF+ Journal of the American Chemical Society, 2009, 131, 13474-13489 |
| 4107570 | CIF | As Fe La O | P 4/n m m :2 | 4.03533; 4.03533; 8.7409 90; 90; 90 | 142.336 | Yoichi Kamihara; Takumi Watanabe; Masahiro Hirano; Hideo Hosono Iron-Based Layered Superconductor La[O1-xFx]FeAs (x = 0.05-0.12) with Tc = 26 K Journal of the American Chemical Society, 2008, 130, 3296-3297 |
| 4123962 | CIF | As H4 N O4 Zn | P 1 21 1 | 8.959; 5.6327; 9.13 90; 90.159; 90 | 460.729 | Feng, P.-Y.; Zhang, T.-Z.; Bu Xianhui Arsenate zeolite analogues with 11 topological types Journal of the American Chemical Society, 2001, 123, 8608-8609 |
| 4101693 | CIF | As K3 S11 Ta2 | C 1 c 1 | 14.2571; 12.4154; 9.4505 90; 100.12; 90 | 1646.78 | Bera, Tarun K.; Jang, Joon I.; Ketterson, John B.; Kanatzidis, Mercouri G. Strong second harmonic generation from the tantalum thioarsenates A3Ta2AsS11 (A = K and Rb). Journal of the American Chemical Society, 2009, 131, 75-77 |
| 4102046 | CIF | As Li Se2 | C 1 c 1 | 12.2872; 5.5419; 5.5533 90; 113.117; 90 | 347.79 | Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study Journal of the American Chemical Society, 2010, 132, 3484-3495 |
| 4102048 | CIF | As Li Se2 | P 1 | 5.55073; 5.58029; 5.57706 92.72; 90.8322; 91.516 | 172.471 | Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study Journal of the American Chemical Society, 2010, 132, 3484-3495 |
| 4102047 | CIF | As Na Se2 | P 1 c 1 | 11.682; 5.9021; 11.8231 90; 90.446; 90 | 815.2 | Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study Journal of the American Chemical Society, 2010, 132, 3484-3495 |
| 4101694 | CIF | As Rb3 S11 Ta2 | C 1 c 1 | 14.4397; 12.8013; 9.5687 90; 99.289; 90 | 1745.55 | Bera, Tarun K.; Jang, Joon I.; Ketterson, John B.; Kanatzidis, Mercouri G. Strong second harmonic generation from the tantalum thioarsenates A3Ta2AsS11 (A = K and Rb). Journal of the American Chemical Society, 2009, 131, 75-77 |
| 4102045 | CIF | As0.5 Li0.5 Se | F m -3 m | 5.557; 5.557; 5.557 90; 90; 90 | 171.6 | Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study Journal of the American Chemical Society, 2010, 132, 3484-3495 |
| 4112088 | CIF | As2 B H K2 O8 | P 41 21 2 | 7.3568; 7.3568; 15.4671 90; 90; 90 | 837.12 | Seth B. Wiggin; Mark T. Weller Boroarsenates: A Framework Motif and Family Templated on Cations and Anions Journal of the American Chemical Society, 2005, 127, 17172-17173 |
| 4123005 | CIF | As2 Ba Fe2 | I 4/m m m | 3.961; 3.961; 13.02 90; 90; 90 | 204.3 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4123009 | CIF | As2 Ba Fe2 | F m m m | 5.6139; 5.5746; 12.9594 90; 90; 90 | 405.568 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4123004 | CIF | As2 Ba0.32 Fe2 K0.68 | I 4/m m m | 3.88324; 3.88324; 13.53814 90; 90; 90 | 204.149 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4123007 | CIF | As2 Ba0.52 Fe2 K0.48 | I 4/m m m | 3.90675; 3.90675; 13.37425 90; 90; 90 | 204.127 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4123003 | CIF | As2 Ba0.83 Fe2 K0.17 | I 4/m m m | 3.94518; 3.94518; 13.13219 90; 90; 90 | 204.395 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4123006 | CIF | As2 Ba0.84 Fe2 K0.16 | I 4/m m m | 3.94518; 3.94518; 13.13219 90; 90; 90 | 204.395 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4123010 | CIF | As2 Ba0.84 Fe2 K0.16 | F m m m | 5.5864; 5.5564; 13.061 90; 90; 90 | 405.42 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4124925 | CIF | As2 Ca Co1.87 | I 4/m m m | 3.9927; 3.9927; 10.3133 90; 90; 90 | 164.411 | Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society, 2016, 138, 2724-2731 |
| 4120528 | CIF | As2 Ca0.73 Fe Pr0.27 | P 1 21/m 1 | 3.9163; 3.8953; 10.311 90; 90.788; 90 | 157.28 | Yakita, Hiroyuki; Ogino, Hiraku; Okada, Tomoyuki; Yamamoto, Akiyasu; Kishio, Kohji; Tohei, Tetsuya; Ikuhara, Yuichi; Gotoh, Yoshito; Fujihisa, Hiroshi; Kataoka, Kunimitsu; Eisaki, Hiroshi; Shimoyama, Jun-Ichi A New Layered Iron Arsenide Superconductor: (Ca,Pr)FeAs2. Journal of the American Chemical Society, 2014, 136, 846-849 |
| 4124926 | CIF | As2 Ca0.845 Co1.888 La0.155 | I 4/m m m | 4.0018; 4.0018; 10.3726 90; 90; 90 | 166.111 | Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society, 2016, 138, 2724-2731 |
| 4124924 | CIF | As2 Ca0.9 Co1.906 Eu0.1 | I 4/m m m | 3.9984; 3.9984; 10.3696 90; 90; 90 | 165.781 | Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society, 2016, 138, 2724-2731 |
| 4124927 | CIF | As2 Co2 Eu | I 4/m m m | 3.929; 3.929; 11.512 90; 90; 90 | 177.71 | Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society, 2016, 138, 2724-2731 |
| 4117335 | CIF | As2 Cs9 H74 Li3 Mo6 O109 S6 W18 | P -6 2 m | 22.818; 22.818; 21.265 90; 90; 120 | 9589 | Jérôme Marrot; Marie Anne Pilette; Mohamed Haouas; Sébastien Floquet; Francis Taulelle; Xavier López; Josep M. Poblet; Emmanuel Cadot Polyoxometalates Paneling through {Mo~2~O~2~S~2~} Coordination: Cation-Directed Conformations and Chemistry of a Supramolecular Hexameric Scaffold Journal of the American Chemical Society, 2012, 134, 1724-1737 |
| 4123008 | CIF | As2 Fe2 K | I 4/m m m | 3.849; 3.849; 13.867 90; 90; 90 | 205.44 | Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M. Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route. Journal of the American Chemical Society, 2014, 141121132150009 |
| 4119241 | CIF | As2 H26 Mn3 N10 S8 | C 1 2/c 1 | 24.312; 7.9301; 12.412 90; 93.21; 90 | 2389.2 | Wei-Wei Xiong; Eashwer Umesh Athresh; Yu Ting Ng; Junfeng Ding; Tom Wu; Qichun Zhang Growing Crystalline Chalcogenidoarsenates in Surfactants: From Zero-Dimensional Cluster to Three-Dimensional Framework Journal of the American Chemical Society, 2013, 135, 1256-1259 |
| 4112087 | CIF | As20 B16 Cl10 Cs6 H16 O80 | I 4/m | 8.966; 8.966; 25.244 90; 90; 90 | 2029.3 | Seth B. Wiggin; Mark T. Weller Boroarsenates: A Framework Motif and Family Templated on Cations and Anions Journal of the American Chemical Society, 2005, 127, 17172-17173 |
| 4104228 | CIF | As3 Ca Fe4 | P n m a | 11.8953; 3.743; 11.61 90; 90; 90 | 516.92 | Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties Journal of the American Chemical Society, 2009, 131, 5405-5407 |
| 4104229 | CIF | As3 Ca Fe4 | P n m a | 11.8649; 3.7309; 11.5611 90; 90; 90 | 511.77 | Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties Journal of the American Chemical Society, 2009, 131, 5405-5407 |
| 4104230 | CIF | As3 Ca Fe4 | P n m a | 11.8656; 3.7322; 11.5622 90; 90; 90 | 512.03 | Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties Journal of the American Chemical Society, 2009, 131, 5405-5407 |
| 4104231 | CIF | As3 Ca Fe4 | P n m a | 11.852; 3.7352; 11.549 90; 90; 90 | 511.27 | Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties Journal of the American Chemical Society, 2009, 131, 5405-5407 |
| 4119243 | CIF | As3 H4 Mn N S6 | R 3 :H | 9.1872; 9.1872; 10.8539 90; 90; 120 | 793.38 | Wei-Wei Xiong; Eashwer Umesh Athresh; Yu Ting Ng; Junfeng Ding; Tom Wu; Qichun Zhang Growing Crystalline Chalcogenidoarsenates in Surfactants: From Zero-Dimensional Cluster to Three-Dimensional Framework Journal of the American Chemical Society, 2013, 135, 1256-1259 |
| 4123963 | CIF | As3 H6 N O13 Zn4 | I 21 3 | 13.8527; 13.8527; 13.8527 90; 90; 90 | 2658.3 | Feng, P.-Y.; Zhang, T.-Z.; Bu Xianhui Arsenate zeolite analogues with 11 topological types Journal of the American Chemical Society, 2001, 123, 8608-8609 |
| 4127420 | CIF | As32 Eu15 Ga22 | C 1 2/c 1 | 22.8204; 22.8257; 19.7972 90; 98.237; 90 | 10205.8 | Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society, 2019, 141, 11245-11252 |
| 4127421 | CIF | As32 Eu15 In22 | C 1 2/c 1 | 23.703; 23.702; 22.337 90; 113.473; 90 | 11510.7 | Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society, 2019, 141, 11245-11252 |
| 4127419 | CIF | As32 Ga22 Sr15 | C 1 2/c 1 | 22.966; 22.9639; 19.8929 90; 98.229; 90 | 10383.3 | Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society, 2019, 141, 11245-11252 |
| 4127424 | CIF | As32 In22 Sr15 | C 1 2/c 1 | 23.838; 23.818; 20.763 90; 98.244; 90 | 11667 | Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society, 2019, 141, 11245-11252 |
| 4118469 | CIF | As4 Ba2 Fe2 O Ti2 | I 4/m m m | 4.0276; 4.02761; 27.3441 90; 90; 90 | 443.565 | Yun-Lei Sun; Hao Jiang; Hui-Fei Zhai; Jin-Ke Bao; Wen-He Jiao; Qian Tao; Chen-Yi Shen; Yue-Wu Zeng; Zhu-An Xu; Guang-Han Cao Ba2Ti2Fe2As4O: A New Superconductor Containing Fe2As2 Layers and Ti2O Sheets Journal of the American Chemical Society, 2012, 134, 12893-12896 |
| 4105722 | CIF | As4 Bi3 Cl13 Hg8 | P 31 2 1 | 11.3324; 11.3324; 42.768 90; 90; 120 | 4756.6 | Xiao-Ming Jiang; Ming-Jian Zhang; Hui-Yi Zeng; Guo-Cong Guo; Jin-Shun Huang Inorganic Supramolecular Compounds with 3-D Chiral Frameworks Show Potential as Both Mid-IR Second-Order Nonlinear Optical and Piezoelectric Materials Journal of the American Chemical Society, 2011, 133, 3410-3418 |
| 4121563 | CIF | As4 Co16 H120 Na28 O218 P4 W36 | F d -3 :2 | 35.514; 35.514; 35.514 90; 90; 90 | 44792 | Han, Xin-Bao; Zhang, Zhi-Ming; Zhang, Teng; Li, Yang-Guang; Lin, Wenbin; You, Wansheng; Su, Zhong-Min; Wang, En-Bo Polyoxometalate-based cobalt-phosphate molecular catalysts for visible light-driven water oxidation. Journal of the American Chemical Society, 2014, 136, 5359-5366 |
| 4117334 | CIF | As4 Cs15 H128 Li9 Mo12 O208 S12 W36 | C 1 2/c 1 | 47.2304; 18.6529; 36.3782 90; 126.753; 90 | 25678.1 | Jérôme Marrot; Marie Anne Pilette; Mohamed Haouas; Sébastien Floquet; Francis Taulelle; Xavier López; Josep M. Poblet; Emmanuel Cadot Polyoxometalates Paneling through {Mo~2~O~2~S~2~} Coordination: Cation-Directed Conformations and Chemistry of a Supramolecular Hexameric Scaffold Journal of the American Chemical Society, 2012, 134, 1724-1737 |
| 4117333 | CIF | As4 H214 Li10 Mo12 O246 Rb14 S12 W36 | C 1 2/c 1 | 47.4379; 18.6347; 36.2086 90; 127.567; 90 | 25370.9 | Jérôme Marrot; Marie Anne Pilette; Mohamed Haouas; Sébastien Floquet; Francis Taulelle; Xavier López; Josep M. Poblet; Emmanuel Cadot Polyoxometalates Paneling through {Mo~2~O~2~S~2~} Coordination: Cation-Directed Conformations and Chemistry of a Supramolecular Hexameric Scaffold Journal of the American Chemical Society, 2012, 134, 1724-1737 |
| 4119240 | CIF | As4 H32 Mn2 N8 S16 | P 1 2/n 1 | 9.2086; 8.8211; 20.7793 90; 96.047; 90 | 1678.51 | Wei-Wei Xiong; Eashwer Umesh Athresh; Yu Ting Ng; Junfeng Ding; Tom Wu; Qichun Zhang Growing Crystalline Chalcogenidoarsenates in Surfactants: From Zero-Dimensional Cluster to Three-Dimensional Framework Journal of the American Chemical Society, 2013, 135, 1256-1259 |
| 1010609 | CIF | As4 O6 | F d -3 m :1 | 11.06; 11.06; 11.06 90; 90; 90 | 1352.9 | Bozorth, R M The crystal structures of the cubic forms of arsenious and antimonous oxide Journal of the American Chemical Society, 1923, 45, 1621-1627 |
| 4102868 | CIF | As4 S4 | P 1 21/n 1 | 9.3204; 13.5483; 6.5794 90; 106.479; 90 | 796.69 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102869 | CIF | As4 S4 | P 1 21/n 1 | 9.3198; 13.548; 6.579 90; 106.475; 90 | 796.59 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102870 | CIF | As4 S4 | P 1 21/n 1 | 9.3198; 13.5479; 6.5789 90; 106.472; 90 | 796.58 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102871 | CIF | As4 S4 | P 1 21/n 1 | 9.3199; 13.548; 6.5788 90; 106.468; 90 | 796.6 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102872 | CIF | As4 S4 | P 1 21/n 1 | 9.3203; 13.5485; 6.5792 90; 106.466; 90 | 796.72 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102873 | CIF | As4 S4 | P 1 21/n 1 | 9.3201; 13.548; 6.5789 90; 106.464; 90 | 796.65 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102874 | CIF | As4 S4 | P 1 21/n 1 | 9.3204; 13.548; 6.5788 90; 106.46; 90 | 796.68 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102875 | CIF | As4 S4 | P 1 21/n 1 | 9.3208; 13.5481; 6.5791 90; 106.456; 90 | 796.77 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102876 | CIF | As4 S4 | P 1 21/n 1 | 9.3211; 13.5484; 6.579 90; 106.45; 90 | 796.83 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102877 | CIF | As4 S4 | P 1 21/n 1 | 9.3214; 13.5483; 6.5792 90; 106.446; 90 | 796.89 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102878 | CIF | As4 S4 | P 1 21/n 1 | 9.3218; 13.549; 6.5793 90; 106.44; 90 | 797 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102879 | CIF | As4 S4 | P 1 21/n 1 | 9.3218; 13.5491; 6.5792 90; 106.437; 90 | 797.01 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102880 | CIF | As4 S4 | P 1 21/n 1 | 9.3222; 13.549; 6.5794 90; 106.433; 90 | 797.07 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102881 | CIF | As4 S4 | P 1 21/n 1 | 9.3226; 13.5496; 6.5794 90; 106.427; 90 | 797.17 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102882 | CIF | As4 S4 | P 1 21/n 1 | 9.3231; 13.5498; 6.5795 90; 106.42; 90 | 797.26 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102883 | CIF | As4 S4 | P 1 21/n 1 | 9.3232; 13.5499; 6.5795 90; 106.417; 90 | 797.29 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102884 | CIF | As4 S4 | P 1 21/n 1 | 9.3231; 13.5497; 6.5793 90; 106.414; 90 | 797.26 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102885 | CIF | As4 S4 | P 1 21/n 1 | 9.3237; 13.55; 6.5797 90; 106.408; 90 | 797.4 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102886 | CIF | As4 S4 | P 1 21/n 1 | 9.324; 13.5505; 6.5797 90; 106.404; 90 | 797.47 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102887 | CIF | As4 S4 | P 1 21/n 1 | 9.3222; 13.5569; 6.5852 90; 106.507; 90 | 797.938 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102888 | CIF | As4 S4 | P 1 21/n 1 | 9.3252; 13.5608; 6.5854 90; 106.442; 90 | 798.72 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102889 | CIF | As4 S4 | P 1 21/n 1 | 9.3297; 13.5636; 6.5887 90; 106.349; 90 | 800.05 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102890 | CIF | As4 S4 | P 1 21/n 1 | 9.3348; 13.5692; 6.5881 90; 106.298; 90 | 800.95 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102891 | CIF | As4 S4 | P 1 21/n 1 | 9.3356; 13.5689; 6.5929 90; 106.24; 90 | 801.82 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102892 | CIF | As4 S4 | P 1 21/n 1 | 9.3409; 13.5708; 6.5947 90; 106.193; 90 | 802.8 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102893 | CIF | As4 S4 | P 1 21/n 1 | 9.3362; 13.5746; 6.6014 90; 106.262; 90 | 803.16 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102894 | CIF | As4 S4 | P 1 21/n 1 | 9.3425; 13.5732; 6.6003 90; 106.186; 90 | 803.79 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102895 | CIF | As4 S4 | P 1 21/n 1 | 9.346; 13.5777; 6.5936 90; 106.204; 90 | 803.47 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102896 | CIF | As4 S4 | P 1 21/n 1 | 9.3485; 13.583; 6.5934 90; 106.167; 90 | 804.13 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102897 | CIF | As4 S4 | P 1 21/n 1 | 9.3479; 13.5823; 6.5943 90; 106.151; 90 | 804.21 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102898 | CIF | As4 S4 | P 1 21/n 1 | 9.3502; 13.5844; 6.5948 90; 106.122; 90 | 804.71 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102899 | CIF | As4 S4 | P 1 21/n 1 | 9.3316; 13.5678; 6.5866 90; 106.178; 90 | 800.9 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102900 | CIF | As4 S4 | P 1 21/n 1 | 9.3235; 13.5573; 6.5865 90; 106.533; 90 | 798.12 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102901 | CIF | As4 S4 | P 1 21/n 1 | 9.3242; 13.5575; 6.5875 90; 106.517; 90 | 798.38 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102902 | CIF | As4 S4 | P 1 21/n 1 | 9.3244; 13.5579; 6.5877 90; 106.512; 90 | 798.47 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102903 | CIF | As4 S4 | P 1 21/n 1 | 9.3245; 13.5582; 6.5876 90; 106.504; 90 | 798.51 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102904 | CIF | As4 S4 | P 1 21/n 1 | 9.3249; 13.5583; 6.5875 90; 106.5; 90 | 798.56 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102905 | CIF | As4 S4 | P 1 21/n 1 | 9.3257; 13.5589; 6.5879 90; 106.496; 90 | 798.73 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102906 | CIF | As4 S4 | P 1 21/n 1 | 9.3253; 13.5586; 6.5877 90; 106.492; 90 | 798.67 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102907 | CIF | As4 S4 | P 1 21/n 1 | 9.3257; 13.5587; 6.5876 90; 106.487; 90 | 798.72 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102908 | CIF | As4 S4 | P 1 21/n 1 | 9.3265; 13.5596; 6.5879 90; 106.484; 90 | 798.89 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102909 | CIF | As4 S4 | P 1 21/n 1 | 9.3267; 13.5596; 6.588 90; 106.48; 90 | 798.93 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102910 | CIF | As4 S4 | P 1 21/n 1 | 9.3261; 13.5597; 6.5877 90; 106.475; 90 | 798.87 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102911 | CIF | As4 S4 | P 1 21/n 1 | 9.3268; 13.56; 6.5878 90; 106.472; 90 | 798.97 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102912 | CIF | As4 S4 | P 1 21/n 1 | 9.3264; 13.559; 6.5876 90; 106.471; 90 | 798.86 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102913 | CIF | As4 S4 | P 1 21/n 1 | 9.3266; 13.5579; 6.5869 90; 106.462; 90 | 798.77 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102914 | CIF | As4 S4 | P 1 21/n 1 | 9.3286; 13.5614; 6.5881 90; 106.447; 90 | 799.35 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102915 | CIF | As4 S4 | P 1 21/n 1 | 9.3294; 13.5627; 6.5886 90; 106.44; 90 | 799.58 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102916 | CIF | As4 S4 | P 1 21/n 1 | 9.3299; 13.5634; 6.5888 90; 106.436; 90 | 799.71 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102917 | CIF | As4 S4 | P 1 21/n 1 | 9.3301; 13.5634; 6.5888 90; 106.43; 90 | 799.75 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102918 | CIF | As4 S4 | P 1 21/n 1 | 9.3308; 13.5643; 6.589 90; 106.428; 90 | 799.9 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102919 | CIF | As4 S4 | P 1 21/n 1 | 9.3303; 13.5634; 6.5888 90; 106.422; 90 | 799.8 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102920 | CIF | As4 S4 | P 1 21/n 1 | 9.3298; 13.5627; 6.5882 90; 106.421; 90 | 799.65 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102921 | CIF | As4 S4 | P 1 21/n 1 | 9.3303; 13.5624; 6.5879 90; 106.411; 90 | 799.68 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4102922 | CIF | As4 S4 | P 1 21/n 1 | 9.3313; 13.5636; 6.5884 90; 106.402; 90 | 799.93 | Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar Journal of the American Chemical Society, 2010, 132, 11398-11401 |
| 4117332 | CIF | As6 H192 K34.5 Mo18 Na1.5 O312 S18 W54 | P 1 21/n 1 | 21.112; 44.991; 38.4158 90; 96.196; 90 | 36276 | Jérôme Marrot; Marie Anne Pilette; Mohamed Haouas; Sébastien Floquet; Francis Taulelle; Xavier López; Josep M. Poblet; Emmanuel Cadot Polyoxometalates Paneling through {Mo~2~O~2~S~2~} Coordination: Cation-Directed Conformations and Chemistry of a Supramolecular Hexameric Scaffold Journal of the American Chemical Society, 2012, 134, 1724-1737 |
| 4117330 | CIF | As6 H240 K3.5 Mo18 Na32.5 O336 S18 W54 | P -1 | 22.217; 25.49; 37.77 75.41; 85.28; 83.71 | 20542 | Jérôme Marrot; Marie Anne Pilette; Mohamed Haouas; Sébastien Floquet; Francis Taulelle; Xavier López; Josep M. Poblet; Emmanuel Cadot Polyoxometalates Paneling through {Mo~2~O~2~S~2~} Coordination: Cation-Directed Conformations and Chemistry of a Supramolecular Hexameric Scaffold Journal of the American Chemical Society, 2012, 134, 1724-1737 |
| 4117331 | CIF | As6 H392 K Li35 Mo18 O412 S18 W54 | P n m a | 39.7619; 37.8141; 25.0128 90; 90; 90 | 37608.3 | Jérôme Marrot; Marie Anne Pilette; Mohamed Haouas; Sébastien Floquet; Francis Taulelle; Xavier López; Josep M. Poblet; Emmanuel Cadot Polyoxometalates Paneling through {Mo~2~O~2~S~2~} Coordination: Cation-Directed Conformations and Chemistry of a Supramolecular Hexameric Scaffold Journal of the American Chemical Society, 2012, 134, 1724-1737 |
| 4127423 | CIF | As8 Eu3 Ga6 | C 1 2/c 1 | 22.74; 22.747; 25.505 90; 96.393; 90 | 13111 | Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society, 2019, 141, 11245-11252 |
| 4127422 | CIF | As8 Ga6 Sr3 | C 1 2/c 1 | 22.8363; 22.8335; 26.8169 90; 108.613; 90 | 13251.8 | Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society, 2019, 141, 11245-11252 |
| 4123416 | CIF | Au Bi Pb2 S3 Te2 | P m m n :2 | 12.3722; 4.0997; 9.3435 90; 90; 90 | 473.92 | Fang, Lei; Im, Jino; Stoumpos, Constantinos C.; Shi, Fengyuan; Dravid, Vinayak; Leroux, Maxime; Freeman, Arthur J.; Kwok, Wai-Kwong; Chung, Duck Young; Kanatzidis, Mercouri Two-Dimensional Mineral [Pb2BiS3][AuTe2]: High-Mobility Charge Carriers in Single-Atom-Thick Layers. Journal of the American Chemical Society, 2015, 137, 2311-2317 |
| 4123311 | CIF | Au Ce Sb | P 63/m m c | 4.61403; 4.61403; 16.6348 90; 90; 120 | 306.697 | Seibel, Elizabeth M.; Schoop, Leslie M.; Xie, Weiwei; Gibson, Quinn D.; Webb, James B.; Fuccillo, Michael K.; Krizan, Jason W.; Cava, Robert J. Gold-Gold Bonding: The Key to Stabilizing the 19-Electron Ternary Phases LnAuSb (Ln = La-Nd and Sm). Journal of the American Chemical Society, 2015, 137, 1282-1289 |
| 6000559 | CIF | Au F3 | P 61 2 2 | 5.1508; 5.1508; 16.2637 90; 90; 120 | 373.68 | Zemva, B.; Lutar, K.; Jesih, A.; Casteel, W. J.; Wilkinson, A. P.; Cox, D. E.; Vondreele, R. B.; Borrmann, H.; Bartlett, N. Silver trifluoride - preparation, crystal-structure, some properties, and comparison with AuF3 Journal of The American Chemical Society, 1991, 113, 4192-4198 |
| 4109877 | CIF | Au H54 K15 O95 P2 W18 | F d d d :2 | 28.594; 31.866; 38.241 90; 90; 90 | 34844 | Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill Terminal Gold-Oxo Complexes Journal of the American Chemical Society, 2007, 129, 11118-11133 |
| 4109880 | CIF | Au H57 K9 O93.5 P2 W18 | F d d d :2 | 28.605; 31.857; 38.273 90; 90; 90 | 34877 | Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill Terminal Gold-Oxo Complexes Journal of the American Chemical Society, 2007, 129, 11118-11133 |
| 4123309 | CIF | Au La Sb | P 63/m m c | 4.63839; 4.63839; 16.83143 90; 90; 120 | 313.607 | Seibel, Elizabeth M.; Schoop, Leslie M.; Xie, Weiwei; Gibson, Quinn D.; Webb, James B.; Fuccillo, Michael K.; Krizan, Jason W.; Cava, Robert J. Gold-Gold Bonding: The Key to Stabilizing the 19-Electron Ternary Phases LnAuSb (Ln = La-Nd and Sm). Journal of the American Chemical Society, 2015, 137, 1282-1289 |
| 4123310 | CIF | Au Nd Sb | P 63/m m c | 4.58003; 4.58003; 16.47753 90; 90; 120 | 299.336 | Seibel, Elizabeth M.; Schoop, Leslie M.; Xie, Weiwei; Gibson, Quinn D.; Webb, James B.; Fuccillo, Michael K.; Krizan, Jason W.; Cava, Robert J. Gold-Gold Bonding: The Key to Stabilizing the 19-Electron Ternary Phases LnAuSb (Ln = La-Nd and Sm). Journal of the American Chemical Society, 2015, 137, 1282-1289 |
| 4109881 | CIF HKL | Au0.88 H20 K12.5 O80 P2 W18 | F d d d :2 | 28.721; 31.61; 39.159 90; 90; 90 | 35551 | Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill Terminal Gold-Oxo Complexes Journal of the American Chemical Society, 2007, 129, 11118-11133 |
| 4109878 | CIF | Au1.05 H62 K7.5 O101 P2 W19.95 | P 63/m m c | 16.173; 16.173; 19.7659 90; 90; 120 | 4477.4 | Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill Terminal Gold-Oxo Complexes Journal of the American Chemical Society, 2007, 129, 11118-11133 |
| 4109448 | CIF | Au12.2 Ca3 In6.3 | I m -3 | 15.152; 15.152; 15.152 90; 90; 90 | 3478.6 | 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 |
| 4120322 | CIF HKL | Au16 Ba8 P30 | P b c n | 14.6362; 10.4655; 28.9836 90; 90; 90 | 4439.57 | James Fulmer; Oleg I. Lebedev; Vladimir Roddatis; Derrick C. Kaseman; Sabyasachi Sen; Juli-Anna Dolyniuk; Kathleen Lee; Andrei V. Olenev; Kirill Kovnir Clathrate Ba8Au16P30: The "Gold Standard" for Lattice Thermal Conductivity Journal of the American Chemical Society, 2013, 135, 12313-12323 |
| 4102302 | CIF | Au16 Bi4.78 Ca3.22 | F -4 3 m | 7.9046; 7.9046; 7.9046 90; 90; 90 | 493.9 | Qisheng Lin; John D. Corbett Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition Journal of the American Chemical Society, 2010, 132, 5662-5671 |
| 4102299 | CIF | Au19.4 Bi0.6 Ca4 | F -4 3 m | 7.7646; 7.7646; 7.7646 90; 90; 90 | 468.12 | Qisheng Lin; John D. Corbett Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition Journal of the American Chemical Society, 2010, 132, 5662-5671 |
| 1010201 | CIF | Au2 Cl6 Cs2 | I 4/m m m | 7.49; 7.49; 10.87 90; 90; 90 | 609.8 | Elliott, N; Pauling, L The Crystal Structure of Cesium Aurous Auric Chloride, Vs~2~ Au Au Cl~6~, and Cesium Argentous Auric Chloride, Cs~2~ Ag Au Cl~6~ Journal of the American Chemical Society, 1938, 60, 1846-1851 |
| 4117645 | CIF | Au3 Ge Sr | P 4/n m m :2 | 6.2741; 6.2741; 5.4944 90; 90; 90 | 216.28 | Qisheng Lin; John D Corbett Formation of Nets of Corner-Shared Bicapped Gold Squares in SrAu3Ge: How a BaAl4- Type Derivative Reconciles Fewer Valence Electrons and the Origin of Its Uniaxial Negative Thermal Expansion Journal of the American Chemical Society, 2012, 134, 4877-4884 |
| 4117646 | CIF | Au3 Ge Sr | P 4/n m m :2 | 6.2638; 6.2638; 5.5082 90; 90; 90 | 216.12 | Qisheng Lin; John D Corbett Formation of Nets of Corner-Shared Bicapped Gold Squares in SrAu3Ge: How a BaAl4- Type Derivative Reconciles Fewer Valence Electrons and the Origin of Its Uniaxial Negative Thermal Expansion Journal of the American Chemical Society, 2012, 134, 4877-4884 |
| 4117647 | CIF | Au3 Ge Sr | P 4/n m m :2 | 6.249; 6.249; 5.5104 90; 90; 90 | 215.18 | Qisheng Lin; John D Corbett Formation of Nets of Corner-Shared Bicapped Gold Squares in SrAu3Ge: How a BaAl4- Type Derivative Reconciles Fewer Valence Electrons and the Origin of Its Uniaxial Negative Thermal Expansion Journal of the American Chemical Society, 2012, 134, 4877-4884 |
| 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 |
| 4110908 | CIF | Au4 In2 K | I 4/m c m | 8.6675; 8.6675; 8.3684 90; 90; 90 | 628.68 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4110910 | CIF | Au4 In2 K0.65 Rb0.35 | I 4/m c m | 8.7852; 8.7852; 8.3259 90; 90; 90 | 642.59 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4110911 | CIF | Au4 In2 K0.87 Rb0.13 | I 4/m c m | 8.7032; 8.7032; 8.337 90; 90; 90 | 631.49 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4110909 | CIF | Au4 In2 Rb | I 4/m c m | 8.8349; 8.8349; 8.2736 90; 90; 90 | 645.8 | Bin Li; John D. Corbett Intermetallic Compounds with 1D Infinite Tunnels. Syntheses and Structures of AAu4In2 (A = K, Rb) Journal of the American Chemical Society, 2006, 128, 12392-12393 |
| 4119195 | CIF | Au5 Mn Y3 | R -3 :H | 8.4899; 8.4899; 18.144 90; 90; 120 | 1132.58 | Saroj L. Samal; Abhishek Pandey; David C. Johnston; John D. Corbett Y3MnAu5: Three Distinctived-Metal Functions in an Intergrown Cluster Phase Journal of the American Chemical Society, 2013, 135, 910-917 |
| 4120171 | CIF | Au6.4 Ba2 Zn2.6 | R -3 c :H | 8.6386; 8.6386; 21.963 90; 90; 120 | 1419.41 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4120177 | CIF | Au6.81 Ba2 Ga2.19 | R -3 c :H | 8.7186; 8.7186; 21.816 90; 90; 120 | 1436.1 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4120176 | CIF | Au6.94 Ba2 Cd2.06 | R -3 c :H | 8.8352; 8.8352; 22.51 90; 90; 120 | 1521.73 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4120178 | CIF | Au6.97 Ba2 In2.03 | R -3 c :H | 8.8478; 8.8478; 22.487 90; 90; 120 | 1524.5 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4120174 | CIF | Au7.11 Ba2 Zn1.89 | R -3 c :H | 8.6747; 8.6747; 22.004 90; 90; 120 | 1434 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4120175 | CIF | Au7.89 Ba2 Zn1.11 | R -3 c :H | 8.6762; 8.6762; 22.238 90; 90; 120 | 1449.72 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4120172 | CIF | Au7.97 Ba2 Zn1.03 | R -3 c :H | 8.6645; 8.6645; 22.325 90; 90; 120 | 1451.5 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4102303 | CIF | Au8 Bi2.64 Ca1.36 | F -4 3 m | 7.9505; 7.9505; 7.9505 90; 90; 90 | 502.55 | Qisheng Lin; John D. Corbett Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition Journal of the American Chemical Society, 2010, 132, 5662-5671 |
| 4120173 | CIF | Au8.06 Ba2 Sn0.94 | R -3 c :H | 8.8112; 8.8112; 22.308 90; 90; 120 | 1499.9 | Qisheng Lin; Trinath Mishra; John D. Corbett Hexagonal-Diamond-like Gold Lattices, Ba and (Au,T)3 Interstitials, and Delocalized Bonding in a Family of Intermetallic Phases Ba2Au6(Au,T)3 (T = Zn, Cd, Ga, In, or Sn) Journal of the American Chemical Society, 2013, 135, 11023-11031 |
| 4102301 | CIF | Au8.18 Bi1.82 Ca2 | F -4 3 m | 7.9199; 7.9199; 7.9199 90; 90; 90 | 496.77 | Qisheng Lin; John D. Corbett Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition Journal of the American Chemical Society, 2010, 132, 5662-5671 |
| 4102300 | CIF | Au9.34 Bi0.66 Ca2 | F -4 3 m | 7.8246; 7.8246; 7.8246 90; 90; 90 | 479.06 | Qisheng Lin; John D. Corbett Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition Journal of the American Chemical Society, 2010, 132, 5662-5671 |
| 9012288 | CIF | B | P -4 n 2 | 8.73; 8.73; 5.03 90; 90; 90 | 383.351 | Hoard, J. L.; Geller, S.; Hughes, R. E. On the structure of elementary boron Journal of the American Chemical Society, 1951, 73, 1892-1893 |
| 9012309 | CIF | B | P 42/n n m :1 | 8.74; 8.74; 5.068 90; 90; 90 | 387.132 | Hoard, J. L.; Hughes, R. E.; Sands, D. E. The structure of tetragonal boron Sample: needle III Journal of the American Chemical Society, 1958, 80, 4507-4515 |
| 9012310 | CIF | B | P 42/n n m :1 | 8.771; 8.771; 5.088 90; 90; 90 | 391.422 | Hoard, J. L.; Hughes, R. E.; Sands, D. E. The structure of tetragonal boron Sample: plate Journal of the American Chemical Society, 1958, 80, 4507-4515 |
| 4125285 | CIF | B Bi3 O9 Te | P 63 | 8.751; 8.751; 5.8981 90; 90; 120 | 391.16 | Xia, Mingjun; Jiang, Xingxing; Lin, Zheshuai; Li, Rukang "All-Three-in-One": A New Bismuth-Tellurium-Borate Bi3TeBO9 Exhibiting Strong Second Harmonic Generation Response. Journal of the American Chemical Society, 2016, 138, 14190-14193 |
| 4119072 | CIF | B Cl15 Cs K Zr6 | P m m a | 18.672; 14.026; 9.731 90; 90; 90 | 2548.49 | Corbett, J.D.; Ziebarth, R.P. Cation distributions within a cluster framework. Synthesis and structure of the carbon- and boron-centered zirconium cluster compounds Cs K Zr6 Cl15 C and Cs K Zr6 Cl15 B Journal of the American Chemical Society, 1987, 109, 4844-4850 |
| 4119073 | CIF | B Cl15 K2 Zr6 | C c c m | 11.386; 15.98; 14.008 90; 90; 90 | 2548.73 | Corbett, J.D.; Ziebarth, R.P. Cluster Framework Structures and Relationships. Two Compounds with a New Connectivity, K2 Zr6 Cl15 B and K3 Zr6 Cl15 Be Journal of the American Chemical Society, 1988, 110, 1132-1139 |
| 4119074 | CIF | B Cs I14 Zr6 | C m c a | 15.939; 14.263; 12.974 90; 90; 90 | 2949.48 | Corbett, J.D.; Smith, J.D. Four zirconium iodide cluster phases centered by boron, aluminum, or silicon Journal of the American Chemical Society, 1986, 108, 1927-1934 |
| 4114280 | CIF | B F4 Fe N3 O3 | P 1 21/n 1 | 9.167; 7.5255; 10.327 90; 97.571; 90 | 706.21 | Trevor W. Hayton; W. Stephen McNeil; Brian O. Patrick; Peter Legzdins Toward Binary Nitrosyls: Distinctly Bent Fe-N-O Linkages in Base-Stabilized Fe(NO)3+ Complexes Journal of the American Chemical Society, 2003, 125, 12935-12944 |
| 4124798 | CIF | B F4 H N4 S4 | P 1 21/n 1 | 6.563; 11.717; 11.409 90; 101.63; 90 | 859.325 | Cordes, A.W.; Noble, M.C.; Marcellus, C.G.; Pennington, W.T.; Oakley, R.T. Preparation and Crystal and Molecular Structure of S4 N4 H(+) B F4(-). Molecular Orbital Study of the Protonation of Tetrasulfur Tetranitride Journal of the American Chemical Society, 1983, 105, 6008-6012 |
| 1011135 | CIF | B F4 H4 N | P n m a | 9.06; 5.64; 7.23 90; 90; 90 | 369.4 | Hoard, J L; Blair, V The crystal structures of rubidium and ammonium fluoborates Journal of the American Chemical Society, 1935, 57, 1985-1988 |
| 1010094 | CIF | B F4 Rb | P n m a | 9.07; 5.6; 7.23 90; 90; 90 | 367.2 | Hoard, J L; Blair, V The Crystal Structures of Rubidium and Ammonium Fluoborates Journal of the American Chemical Society, 1935, 57, 1985-1988 |
| 4124794 | CIF | B H4 Na | F -4 3 m | 6.139; 6.139; 6.139 90; 90; 90 | 231.362 | Soldate, A.M. Crystal structure of sodium borohydride Journal of the American Chemical Society, 1947, 69, 987-988 |
| 4102947 | CIF | B H5 K N | P b c a | 9.349; 8.209; 17.192 90; 90; 90 | 1319.4 | Himashinie V. K. Diyabalanage; Tessui Nakagawa; Roshan P. Shrestha; Troy A. Semelsberger; Benjamin L. Davis; Brian L. Scott; Anthony K. Burrell; William I. F. David; Kate R. Ryan; Martin Owen Jones; Peter P. Edwards Potassium(I) Amidotrihydroborate: Structure and Hydrogen Release Journal of the American Chemical Society, 2010, 132, 11836-11837 |
| 4106960 | CIF | B H5 N Na | P b c a | 5.6446; 7.425; 14.514 90; 90; 90 | 608.3 | David J. Wolstenholme; James T. Titah; Franklin N. Che; Kyle T. Traboulsee; Jenna Flogeras; G. Sean McGrady Homopolar Dihydrogen Bonding in Alkali-Metal Amidoboranes and Its Implications for Hydrogen Storage Journal of the American Chemical Society, 2011, 133, 16598-16604 |
| 4116439 | CIF | B H6 N | P m n 21 | 5.395; 4.887; 4.986 90; 90; 90 | 131.46 | Wim T. Klooster; Thomas F. Koetzle; Per E. M. Siegbahn; Thomas B. Richardson; Robert H. Crabtree Study of the N-H...H-B Dihydrogen Bond Including the Crystal Structure of BH3NH3 by Neutron Diffraction Journal of the American Chemical Society, 1999, 121, 6337-6343 |
| 4124654 | CIF | B H6 N | I 4 m m | 5.255; 5.255; 5.048 90; 90; 90 | 139.401 | Hughes, E.W. The Crystal Structure of Ammonia-Borane, H3 N B H3 Journal of the American Chemical Society, 1956, 78, 502-503 |
| 4119075 | CIF | B I12 Zr6 | R -3 :H | 14.534; 14.534; 9.986 90; 90; 120 | 1826.81 | Smith, J.D.; Corbett, J.D. Four zirconium iodide cluster phases centered by boron, aluminum, or silicon Journal of the American Chemical Society, 1986, 108, 1927-1934 |
| 4127821 | CIF | B Na2 P2 | P n m a | 9.5672; 3.2014; 6.104 90; 90; 90 | 186.96 | Woo, Katherine E.; Wang, Jian; Mark, Justin; Kovnir, Kirill Directing Boron-Phosphorus Bonds in Crystalline Solid: Oxidative Polymerization of P═B═P Monomers into 1D Chains. Journal of the American Chemical Society, 2019, 141, 13017-13021 |
| 4119492 | CIF | B11 Ba4 F O20 | C m c 21 | 18.8112; 10.7151; 8.6031 90; 90; 90 | 1734.1 | Hongping Wu; Hongwei Yu; Zhihua Yang; Xueling Hou; Xin Su; Shilie Pan; Kenneth R. Poeppelmeier; James M. Rondinelli Designing a Deep-Ultraviolet Nonlinear Optical Material with a Large Second Harmonic Generation Response Journal of the American Chemical Society, 2013, 135, 4215-4218 |
| 4121299 | CIF | B12 Be12 Li Na5 O33 | P 1 c 1 | 8.8552; 22.8039; 12.669 90; 110.323; 90 | 2399 | Hongwei Huang; Lijuan Liu; Shifeng Jin; Wenjiao Yao; Yihe Zhang; Chuangtian Chen Deep-Ultraviolet Nonlinear Optical Materials: Na2Be4B4O11 and LiNa5Be12B12O33 Journal of the American Chemical Society, 2013, 135, 18319-18322 |
| 4114851 | CIF | B12 Co2 H4 Li2 O23 | I 1 2/a 1 | 17.4296; 4.5518; 19.5893 90; 103.91; 90 | 1508.56 | Jesse L. C. Rowsell; Nicholas J. Taylor; Linda F. Nazar Structure and Ion Exchange Properties of a New Cobalt Borate with a Tunnel Structure "Templated" by Na+ Journal of the American Chemical Society, 2002, 124, 6522-6523 |
| 4114850 | CIF | B12 Co2 Na2 O21 | I 1 2/a 1 | 17.1447; 4.553; 19.4408 90; 103.212; 90 | 1477.4 | Jesse L. C. Rowsell; Nicholas J. Taylor; Linda F. Nazar Structure and Ion Exchange Properties of a New Cobalt Borate with a Tunnel Structure "Templated" by Na+ Journal of the American Chemical Society, 2002, 124, 6522-6523 |
| 4103153 | CIF | B12 F12 H4 K2 O2 | P 1 21/c 1 | 7.2955; 11.2522; 9.2269 90; 103.73; 90 | 735.8 | Dmitry V. Peryshkov; Alexey A. Popov; Steven H. Strauss Latent Porosity in Potassium Dodecafluoro-closo-dodecaborate(2-). Structures and Rapid Room Temperature Interconversions of Crystalline K2B12F12, K2(H2O)2B12F12, and K2(H2O)4B12F12 in the Presence of Water Vapor Journal of the American Chemical Society, 2010, 132, 13902-13913 |
| 4103154 | CIF | B12 F12 H8 K2 O4 | P -1 | 8.3988; 8.5982; 12.7454 98.83; 102.056; 104.958 | 848.39 | Dmitry V. Peryshkov; Alexey A. Popov; Steven H. Strauss Latent Porosity in Potassium Dodecafluoro-closo-dodecaborate(2-). Structures and Rapid Room Temperature Interconversions of Crystalline K2B12F12, K2(H2O)2B12F12, and K2(H2O)4B12F12 in the Presence of Water Vapor Journal of the American Chemical Society, 2010, 132, 13902-13913 |
| 4119076 | CIF | B12 Ga2 O24 P2 Zn6 | I -4 3 m | 7.6139; 7.6139; 7.6139 90; 90; 90 | 441.389 | Eckert, H.; Moran, K.L.; Wasylishen, R.E.; Harrison, W.T.A.; Eichele, K.; Gier, T.E.; Stucky, G.D. Synthesis and characterization of mixed ZnSe/GaP semiconductor species included in the sodalite structure Journal of the American Chemical Society, 1993, 115, 10553-10558 |
| 4124319 | CIF | B12 H16 | P n a 21 | 10.686; 8.686; 11.351 90; 90; 90 | 1053.58 | Brewer, C.T.; Grimes, R.N. Metal-induced oxidative fusion of boranes. Synthesis of B12 H16, the first neutral dodecaborane Journal of the American Chemical Society, 1984, 106, 2722-2723 |
| 4119077 | CIF | B12 O24 Se2 Zn8 | I -4 3 m | 7.6801; 7.6801; 7.6801 90; 90; 90 | 453.003 | Eckert, H.; Moran, K.L.; Harrison, W.T.A.; Wasylishen, R.E.; Stucky, G.D.; Eichele, K.; Gier, T.E. Synthesis and characterization of mixed ZnSe/GaP semiconductor species included in the sodalite structure Journal of the American Chemical Society, 1993, 115, 10553-10558 |
| 4118155 | CIF | B13 Cl2 O27 Pu2 | P 1 21/n 1 | 8.0522; 14.568; 9.82 90; 90.12; 90 | 1151.9 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4118157 | CIF | B14 Cl Cm2 O29 | P 1 21/n 1 | 7.9561; 14.212; 9.836 90; 90.013; 90 | 1112.2 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4126816 | CIF | B15 Ba K7 Lu2 O30 | R 3 2 :H | 12.9705; 12.9705; 15.651 90; 90; 120 | 2280.3 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126821 | CIF | B15 Ba K7 O30 Y2 | R 3 2 :H | 12.9884; 12.9884; 15.718 90; 90; 120 | 2296.4 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126813 | CIF | B15 Bi2 K7 O30 Pb | R 3 2 :H | 13.331; 13.331; 14.91 90; 90; 120 | 2294.7 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126817 | CIF | B15 Bi2 K7 O30 Sr | R 3 2 :H | 13.2512; 13.2512; 15.288 90; 90; 120 | 2324.8 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126820 | CIF | B15 Ca Gd2 K7 O30 | R 3 2 :H | 13.31; 13.31; 15.005 90; 90; 120 | 2302.1 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126818 | CIF | B15 Ca K7 Lu2 O30 | R 3 2 :H | 13.1433; 13.1433; 14.905 90; 90; 120 | 2229.8 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126815 | CIF | B15 Ca K7 O30 Y2 | R 3 2 :H | 13.2182; 13.2182; 14.949 90; 90; 120 | 2262 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126822 | CIF | B15 Gd2 K7 O30 Sr | R 3 2 :H | 13.148; 13.148; 15.417 90; 90; 120 | 2308.1 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126819 | CIF | B15 Gd2.5 K7.5 O30 | R 3 2 :H | 13.265; 13.265; 15.282 90; 90; 120 | 2329 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126811 | CIF | B15 K7 Lu2 O30 Sr | R 3 2 :H | 13.0208; 13.0208; 15.297 90; 90; 120 | 2246 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126812 | CIF | B15 K7 O30 Sr Y2 | R 3 2 :H | 13.1142; 13.1142; 15.319 90; 90; 120 | 2281.6 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4126814 | CIF | B15 K7.5 O30 Y2.5 | R 3 2 :H | 13.142; 13.142; 15.099 90; 90; 120 | 2258.4 | Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017 |
| 4118152 | CIF | B18 Cl3 Eu4 O38 | P 1 2/c 1 | 10.4397; 6.4189; 23.0367 90; 97.196; 90 | 1531.56 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4118151 | CIF | B18 Cl3 O38 Sm4 | P 1 2/c 1 | 10.448; 6.4192; 23.051 90; 97.22; 90 | 1533.7 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4131154 | CIF | B2 H42 O6 | C 1 2/c 1 | 23.2609; 10.0529; 13.4445 90; 99.182; 90 | 3103.6 | Abdulkarim, Ali; Hinkel, Felix; Jänsch, Daniel; Freudenberg, Jan; Golling, Florian E.; Müllen, Klaus A New Solution to an Old Problem: Synthesis of Unsubstituted Poly(para-phenylene). Journal of the American Chemical Society, 2016, 138, 16208-16211 |
| 4128441 | CIF | B2 Li2 Na2 O5 | C m c m | 3.313; 9.985; 13.4 90; 90; 90 | 443.3 | Zhang, Min; An, Donghai; Hu, Cong; Chen, Xinglong; Yang, Zhihua; Pan, Shilie Rational Design via Synergistic Combination Leads to an Outstanding Deep-Ultraviolet Birefringent Li<sub>2</sub>Na<sub>2</sub>B<sub>2</sub>O<sub>5</sub> Material with an Unvalued B<sub>2</sub>O<sub>5</sub> Functional Gene. Journal of the American Chemical Society, 2019, 141, 3258-3264 |
| 4101313 | CIF | B2 O7 Se2 | P 21 21 21 | 7.4815; 7.8984; 9.0478 90; 90; 90 | 534.65 | Kong, Fang; Huang, Shu-Ping; Sun, Zhong-Ming; Mao, Jiang-Gao; Cheng, Wen-Dan Se2(B2O7): a new type of second-order NLO material. Journal of the American Chemical Society, 2006, 128, 7750-7751 |
| 4127432 | CIF | B20 Eu9 Mg O41 S2 | P 63/m | 8.2708; 8.2708; 24.919 90; 90; 120 | 1476.2 | Chi, Yang; Xu, Jing; Xue, Huai-Guo; Zhang, Yueping; Chen, Xiaolong; Whangbo, Myung-Hwan; Guo, Sheng-Ping; Deng, Shuiquan Triple-Kagomé-Layer Slabs of Mixed-Valence Rare-Earth Ions Exhibiting Quantum Spin Liquid Behaviors: Synthesis and Characterization of Eu<sub>9</sub>MgS<sub>2</sub>B<sub>20</sub>O<sub>41</sub>. Journal of the American Chemical Society, 2019, 141, 9533-9536 |
| 4124171 | CIF | B3 Ba3 Cl O9 Pb2 | C 2 2 21 | 10.4706; 14.4379; 7.9454 90; 90; 90 | 1201.1 | Dong, Xiaoyu; Jing, Qun; Shi, Yunjing; Yang, Zhihua; Pan, Shilie; Poeppelmeier, Kenneth R.; Young, Joshua; Rondinelli, James M. Pb2Ba3(BO3)3Cl: A Material with Large SHG Enhancement Activated by Pb-Chelated BO3 Groups. Journal of the American Chemical Society, 2015, 137, 9417-9422 |
| 4102581 | CIF | B3 Be Na O6 | P n a 21 | 9.153; 11.934; 4.372 90; 90; 90 | 477.6 | Shichao Wang; Ning Ye; Wei Li; Dan Zhao Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals Journal of the American Chemical Society, 2010, 132, 8779-8786 |
| 4102582 | CIF | B3 Be2 K O7 | C 1 2/c 1 | 10.405; 9.001; 6.559 90; 114.543; 90 | 558.8 | Shichao Wang; Ning Ye; Wei Li; Dan Zhao Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals Journal of the American Chemical Society, 2010, 132, 8779-8786 |
| 4102583 | CIF | B3 Be2 K O7 | P m n 21 | 7.639; 17.464; 4.376 90; 90; 90 | 583.8 | Shichao Wang; Ning Ye; Wei Li; Dan Zhao Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals Journal of the American Chemical Society, 2010, 132, 8779-8786 |
| 4102585 | CIF | B3 Be2 O7 Rb | P m n 21 | 7.687; 17.724; 4.393 90; 90; 90 | 598.5 | Shichao Wang; Ning Ye; Wei Li; Dan Zhao Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals Journal of the American Chemical Society, 2010, 132, 8779-8786 |
| 4101859 | CIF | B3 Bi Cd4 O10 | C 1 m 1 | 8.044; 15.913; 3.4891 90; 100.08; 90 | 439.7 | Wei-Long Zhang; Wen-Dan Cheng; Hao Zhang; Lei Geng; Chen-Sheng Lin; Zhang-Zhen He A Strong Second-Harmonic Generation Material Cd4BiO(BO3)3 Originating from 3-Chromophore Asymmetric Structures Journal of the American Chemical Society, 2010, 132, 1508-1509 |
| 4124632 | CIF | B3 Cl3 H3 N3 | P n m a | 14; 13.54; 3.95 90; 90; 90 | 748.762 | Coursen, D.L.; Hoard, J.L. The Structure of B-Trichloroborazole Journal of the American Chemical Society, 1952, 74, 1742-1750 |
| 4103784 | CIF | B3 H10 N | P 1 21/n 1 | 10.358; 4.8041; 9.967 90; 115.141; 90 | 449 | Chang Won Yoon; Patrick J. Carroll; Larry G. Sneddon Ammonia Triborane: A New Synthesis, Structural Determinations, and Hydrolytic Hydrogen-Release Properties Journal of the American Chemical Society, 2009, 131, 855-864 |
| 4119071 | CIF | B3 H7 N | P 1 21/n 1 | 10.4; 4.824; 9.997 90; 115.2; 90 | 453.812 | Reimann, C.; Nordman, C.E. The molecular and crystal structures of ammonia-triborane Journal of the American Chemical Society, 1959, 81, 3538-3543 |
| 4121298 | CIF | B4 Be4 Na2 O11 | P 1 | 8.8444; 15.2496; 12.7402 89.935; 110.35; 89.9883 | 1611.1 | Hongwei Huang; Lijuan Liu; Shifeng Jin; Wenjiao Yao; Yihe Zhang; Chuangtian Chen Deep-Ultraviolet Nonlinear Optical Materials: Na2Be4B4O11 and LiNa5Be12B12O33 Journal of the American Chemical Society, 2013, 135, 18319-18322 |
| 4118150 | CIF | B4 Ce Cl O8 | C 1 c 1 | 6.5079; 11.2082; 9.7133 90; 105.25; 90 | 683.56 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4118149 | CIF | B4 Cl La O8 | C 1 c 1 | 6.5109; 11.2402; 9.7941 90; 105.228; 90 | 691.6 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4118154 | CIF | B4 Cl O8 Pu | C 1 c 1 | 6.4898; 11.174; 9.6183 90; 105.15; 90 | 673.2 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4101578 | CIF | B4 Cu Li6 O10 | P 1 | 4.8131; 6.4288; 7.0223 83.369; 71.623; 73.364 | 197.5 | Pan, Shilie; Smit, Jared P; Watkins, Byron; Marvel, Michael R; Stern, Charlotte L; Poeppelmeier, Kenneth R Synthesis, crystal structure, and nonlinear optical properties of Li6CuB4O10: a congruently melting compound with isolated [CuB4O10]6- units. Journal of the American Chemical Society, 2006, 128, 11631-11634 |
| 4118392 | CIF | B4 Fe4 Li4 O12 | P 1 21/c 1 | 10.3362; 8.8687; 10.1656 90; 91.514; 90 | 931.54 | Yuri Janssen; Derek S. Middlemiss; Shou-Hang Bo; Clare P. Grey; Peter G. Khalifah Structural Modulation in the High Capacity Battery Cathode Material LiFeBO3 Journal of the American Chemical Society, 2012, 134, 12516-12527 |
| 4124316 | CIF | B4 H16 Np | P 42/n m c :1 | 8.559; 8.559; 6.017 90; 90; 90 | 440.784 | Banks, R.H.; Templeton, D.H.; Edelstein, N.M.; Spencer, B.; Zalkin, A. Volatility and molecular structure of neptunium(IV) borohydride Journal of the American Chemical Society, 1980, 102, 620-623 |
| 4123979 | CIF | B4 H16 U | P 41 21 2 | 7.49; 7.49; 13.24 90; 90; 90 | 742.765 | Bernstein, E.R.; Keiderling, T.A.; Lippard, S.J.; Mayerle, J.J. Structure of uranium borohydride by single-crystal X-Ray diffraction Journal of the American Chemical Society, 1972, 94, 2552-2553 |
| 4127852 | CIF | B4.27 K O3 | P -6 2 m | 6.072; 6.072; 3.469 90; 90; 120 | 110.764 | Kambe, Tetsuya; Hosono, Reina; Imaoka, Shotaro; Kuzume, Akiyoshi; Yamamoto, Kimihisa Solution Phase Mass Synthesis of 2D Atomic Layer with Hexagonal Boron Network. Journal of the American Chemical Society, 2019, 141, 12984-12988 |
| 4106477 | CIF | B5 Be6 Cs Na2 O15 | C 1 2 1 | 13.885; 4.4332; 10.874 90; 103.141; 90 | 651.8 | Shichao Wang; Ning Ye Na2CsBe6B5O15: An Alkaline Beryllium Borate as a Deep-UV Nonlinear Optical Crystal Journal of the American Chemical Society, 2011, 133, 11458-11461 |
| 4103070 | CIF | B5 I O9 Pb2 | P n n 2 | 11.561; 11.7; 6.524 90; 90; 90 | 882.5 | Yi-Zhi Huang; Li-Ming Wu; Xin-Tao Wu; Long-Hua Li; Ling Chen; Yong-Fan Zhang Pb2B5O9I: An Iodide Borate with Strong Second Harmonic Generation Journal of the American Chemical Society, 2010, 132, 12788-12789 |
| 4106144 | CIF | B6 Cl K3 O10 | R 3 m :H | 10.0624; 10.0624; 8.8361 90; 90; 120 | 774.8 | Hongping Wu; Shilie Pan; Kenneth R. Poeppelmeier; Hongyi Li; Dianzeng Jia; Zhaohui Chen; Xiaoyun Fan; Yun Yang; James M. Rondinelli; Haosu Luo K3B6O10Cl: A New Structure Analogous to Perovskite with a Large Second Harmonic Generation Response and Deep UV Absorption Edge Journal of the American Chemical Society, 2011, 133, 7786-7790 |
| 4112987 | CIF | B6 Cr H16 | P -1 | 4.3898; 5.694; 9.023 105.192; 93.81; 111.102 | 199.79 | Dean M. Goedde; Gregory S. Girolami A New Class of CVD Precursors to Metal Borides: Cr(B3H8)2 and Related Octahydrotriborate Complexes Journal of the American Chemical Society, 2004, 126, 12230-12231 |
| 4115016 | CIF | B6 Dy4 O15 | C 1 2/c 1 | 11.6938; 4.3777; 18.9304 90; 96.657; 90 | 962.6 | Hubert Huppertz; Benjamin von der Eltz Multianvil High-Pressure Synthesis of Dy4B6O15: The First Oxoborate with Edge-Sharing BO4 Tetrahedra Journal of the American Chemical Society, 2002, 124, 9376-9377 |
| 4119078 | CIF | B6 Dy4 O15 | C 1 2/c 1 | 11.6806; 4.3759; 18.9153 90; 96.703; 90 | 960.212 | von der Eltz, B.; Huppertz, H. Multianvil high-pressure synthesis of Dy4 B6 O15: the first oxoborate with edge-sharing B O4 tetrahedra Journal of the American Chemical Society, 2002, 124, 9376-9377 |
| 4119079 | CIF | B6 Ho O18 Sc Sr6 | R -3 :H | 12.285; 12.285; 9.268 90; 90; 120 | 1211.34 | Cox, J.R.; Douglas, A.K.; Alekel, T.; Schaffers, K.I.; Thompson, P.D. New structural class of solid-state oxide Journal of the American Chemical Society, 1990, 112, 7068-7069 |
| 4118153 | CIF | B6 O12 Y | R 3 c :H | 8.346; 8.346; 20.58 90; 90; 120 | 1241 | Matthew J. Polinski; Daniel J. Grant; Shuao Wang; Evgeny V. Alekseev; Justin N. Cross; Eric M. Villa; Wulf Depmeier; Laura Gagliardi; Thomas E. Albrecht-Schmitt Differentiating between Trivalent Lanthanides and Actinides Journal of the American Chemical Society, 2012, 134, 10682-10692 |
| 4102584 | CIF | B9 Be6 K3 O21 | P 1 21 1 | 7.4766; 13.2701; 9.3263 90; 111.272; 90 | 862.3 | Shichao Wang; Ning Ye; Wei Li; Dan Zhao Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals Journal of the American Chemical Society, 2010, 132, 8779-8786 |
| 4120491 | CIF | B9 Cs3 O21 Zn6 | C m c 21 | 8.4268; 19.2101; 14.5611 90; 90; 90 | 2357.1 | Yu, Hongwei; Wu, Hongping; Pan, Shilie; Yang, Zhihua; Hou, Xueling; Su, Xin; Jing, Qun; Poeppelmeier, Kenneth R.; Rondinelli, James M. Cs3Zn6B9O21: A Chemically Benign Member of the KBBF Family Exhibiting the Largest Second Harmonic Generation Response. Journal of the American Chemical Society, 2014, 136, 1264-1267 |
| 4114897 | CIF | B9 H14 K | P 1 21/c 1 | 7.717; 11.674; 10.054 90; 95.09; 90 | 902.2 | Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton Structural Chemistry of arachno-Nonaboranes Journal of the American Chemical Society, 2002, 124, 7429-7439 |
| 4107911 | CIF HKL | Ba Ca Fe3 Nd O8 | P m m a | 5.52075; 11.68876; 5.60301 90; 90; 90 | 361.566 | Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments Journal of the American Chemical Society, 2008, 130, 7570-7583 |
| 4103704 | CIF | Ba Co F4 | C m c 21 | 4.2173; 14.6573; 5.8656 90; 90; 90 | 362.58 | Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family Journal of the American Chemical Society, 2010, 132, 17684-17685 |
| 4124851 | CIF | Ba Co O2.23 | P m -3 m | 4.072; 4.072; 4.072 90; 90; 90 | 67.519 | Strauss, S.W.; Fankuchen, I.; Ward, R. Barium Cobalt Oxide of the Perowskite Type Journal of the American Chemical Society, 1951, 73, 5084-5086 |
| 4124649 | CIF | Ba Co O3 | P 63/m m c | 5.59; 5.59; 4.82 90; 90; 120 | 130.437 | Gushee, B.E.; Katz, L.; Ward, R. The preparation of a barium cobalt oxide and other phases with similar structures Journal of the American Chemical Society, 1957, 79, 5601-5603 |
| 4124015 | CIF | Ba D Ga Ge | P 3 m 1 | 4.3344; 4.3344; 5.1895 90; 90; 120 | 84.433 | Evans, M.J.; Garcia-Garcia, F.J.; Holland, G.P.; Haeussermann, U. Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn) Journal of the American Chemical Society, 2008, 130, 12139-12147 |
| 4124014 | CIF | Ba D Ga Si | P 3 m 1 | 4.2776; 4.2776; 5.1948 90; 90; 120 | 82.319 | Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U. Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn) Journal of the American Chemical Society, 2008, 130, 12139-12147 |
| 4124016 | CIF | Ba D Ga Sn | P 3 m 1 | 4.559; 4.559; 5.298 90; 90; 120 | 95.363 | Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U. Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn) Journal of the American Chemical Society, 2008, 130, 12139-12147 |
| 4123998 | CIF | Ba D2 Ga2 | P -3 m 1 | 4.5286; 4.5286; 4.8991 90; 90; 120 | 87.011 | Bjoerling, T.; Haeussermann, U. Polyanionic hydrides from polar intermetallics Ae E2 (Ae = Ca, Sr, Ba; E = Al, Ga, In) Journal of the American Chemical Society, 2006, 128, 817-824 |
| 4127882 | CIF | Ba F Mn0.5 Te | P 4/n m m :1 | 4.4704; 4.4704; 9.634 90; 90; 90 | 192.53 | Chen, Haijie; McClain, Rebecca; He, Jiangang; Zhang, Chi; Olding, Jack N.; Dos Reis, Roberto; Bao, Jin-Ke; Hadar, Ido; Spanopoulos, Ioannis; Malliakas, Christos D.; He, Yihui; Chung, Duck Young; Kwok, Wai-Kwong; Weiss, Emily A.; Dravid, Vinayak P.; Wolverton, Christopher; Kanatzidis, Mercouri G. Antiferromagnetic Semiconductor BaFMn<sub>0.5</sub>Te with Unique Mn Ordering and Red Photoluminescence. Journal of the American Chemical Society, 2019, 141, 17421-17430 |
| 4127883 | CIF | Ba F Mn0.5 Te | C m m a | 6.3205; 6.3233; 9.6379 90; 90; 90 | 385.19 | Chen, Haijie; McClain, Rebecca; He, Jiangang; Zhang, Chi; Olding, Jack N.; Dos Reis, Roberto; Bao, Jin-Ke; Hadar, Ido; Spanopoulos, Ioannis; Malliakas, Christos D.; He, Yihui; Chung, Duck Young; Kwok, Wai-Kwong; Weiss, Emily A.; Dravid, Vinayak P.; Wolverton, Christopher; Kanatzidis, Mercouri G. Antiferromagnetic Semiconductor BaFMn<sub>0.5</sub>Te with Unique Mn Ordering and Red Photoluminescence. Journal of the American Chemical Society, 2019, 141, 17421-17430 |
| 4103703 | CIF | Ba F4 Mn | C m c 21 | 4.237; 15.17; 6.0214 90; 90; 90 | 387 | Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family Journal of the American Chemical Society, 2010, 132, 17684-17685 |
| 4103705 | CIF | Ba F4 Ni | C m c 21 | 4.1591; 14.492; 5.8078 90; 90; 90 | 350.06 | Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family Journal of the American Chemical Society, 2010, 132, 17684-17685 |
| 1010206 | CIF | Ba F6 Ge | R -3 m :R | 4.83; 4.83; 4.83 98.02; 98.02; 98.02 | 109 | Hoard, J L; Vincent, W B Structures of Complex Fluorides. Barium Fluorosilicate and Barium Fluorogermanate Journal of the American Chemical Society, 1940, 62, 3126-3129 |
| 1010205 | CIF | Ba F6 Si | R -3 m :R | 4.75; 4.75; 4.75 97.97; 97.97; 97.97 | 103.7 | Hoard, J L; Vincent, W B Structures of Complex Fluorides. Barium Fluorosilicate and Barium Fluorogermanate Journal of the American Chemical Society, 1940, 62, 3126-3129 |
| 4124844 | CIF | Ba Fe O3 | P m -3 m | 4.02; 4.02; 4.02 90; 90; 90 | 64.965 | Erchak, M.; Fankuchen, I.; Ward, R. Reaction between Ferric Oxide and Barium Carbonate in the Solid Phase. Identification of Phases by X-Ray Diffraction Journal of the American Chemical Society, 1946, 68, 2085-2093 |
| 4113918 | CIF | Ba Fe2 Ho O5 | P m m a | 8.03183; 3.83589; 7.52198 90; 90; 90 | 231.746 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113920 | CIF | Ba Fe2 Ho O5 | P m m a | 8.02258; 3.84893; 7.54252 90; 90; 90 | 232.901 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113922 | CIF | Ba Fe2 Ho O5 | P m m m | 3.932787; 3.918529; 7.56186 90; 90; 90 | 116.534 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113924 | CIF | Ba Fe2 Ho O5 | P m m m | 3.93355; 3.92896; 7.57777 90; 90; 90 | 117.113 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113926 | CIF | Ba Fe2 Nd O5 | P 21 m a | 7.99949; 3.91587; 7.63343 90; 90; 90 | 239.117 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113929 | CIF | Ba Fe2 Nd O5 | P 21 m a | 8.00318; 3.92013; 7.64047 90; 90; 90 | 239.708 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113932 | CIF | Ba Fe2 Nd O5 | P m m m | 3.96584; 3.95339; 7.64046 90; 90; 90 | 119.791 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113934 | CIF | Ba Fe2 Nd O5 | P m m m | 3.969451; 3.958035; 7.64849 90; 90; 90 | 120.167 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113937 | CIF | Ba Fe2 Nd O5 | P m m m | 3.97079; 3.96456; 7.6583 90; 90; 90 | 120.56 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4113939 | CIF | Ba Fe2 Nd O5 | P m m m | 3.97431; 3.96949; 7.66813 90; 90; 90 | 120.972 | Patrick M. Woodward; Emmanuelle Suard; Pavel Karen Structural Tuning of Charge, Orbital, and Spin Ordering in Double-Cell Perovskite Series between NdBaFe2O5 and HoBaFe2O5 Journal of the American Chemical Society, 2003, 125, 8889-8899 |
| 4107896 | CIF HKL | Ba Fe2 O4 | B b 21 m | 18.99784; 5.38025; 8.43848 90; 90; 90 | 862.523 | Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments Journal of the American Chemical Society, 2008, 130, 7570-7583 |
| 4124024 | CIF | Ba Ga Ge H | P 3 m 1 | 4.3758; 4.3758; 5.2687 90; 90; 120 | 87.367 | Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U. Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn) Journal of the American Chemical Society, 2008, 130, 12139-12147 |
| 4124023 | CIF | Ba Ga H Si | P 3 m 1 | 4.3015; 4.3015; 5.2703 90; 90; 120 | 84.451 | Evans, M.J.; Holland, G.P.; Haeussermann, U.; Garcia-Garcia, F.J. Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn) Journal of the American Chemical Society, 2008, 130, 12139-12147 |
| 4124025 | CIF | Ba Ga H Sn | P 3 m 1 | 4.5914; 4.5914; 5.4257 90; 90; 120 | 99.055 | Evans, M.J.; Holland, G.P.; Haeussermann, U.; Garcia-Garcia, F.J. Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn) Journal of the American Chemical Society, 2008, 130, 12139-12147 |
| 4102830 | CIF | Ba Ge5 | P m n a | 10.727; 9.2844; 14.794 90; 90; 90 | 1473.4 | Umut Aydemir; Lev Akselrud; Wilder Carrillo-Cabrera; Christophe Candolfi; Niels Oeschler; Michael Baitinger; Frank Steglich; Yuri Grin BaGe5: A New Type of Intermetallic Clathrate Journal of the American Chemical Society, 2010, 132, 10984-10985 |
| 4125072 | CIF | Ba Hg Se2 | P m c 21 | 4.358; 14.881; 7.59 90; 90; 90 | 492.22 | Li, Chao; Yin, Wenlong; Gong, Pifu; Li, Xiaoshuang; Zhou, Molin; Mar, Arthur; Lin, Zheshuai; Yao, Jiyong; Wu, Yicheng; Chen, Chuangtian Trigonal Planar [HgSe3](4-) Unit: A New Kind of Basic Functional Group in IR Nonlinear Optical Materials with Large Susceptibility and Physicochemical Stability. Journal of the American Chemical Society, 2016, 138, 6135-6138 |
| 4104569 | CIF | Ba Hg2 Tl2 | P 42/m n m | 10.606; 10.606; 5.159 90; 90; 90 | 580.32 | Jing-Cao Dai; Shalabh Gupta; Olivier Gourdon; Hyun-Jeong Kim; John D. Corbett BaHg2Tl2. An Unusual Polar Intermetallic Phase with Strong Differentiation between the Neighboring Elements Mercury and Thallium Journal of the American Chemical Society, 2009, 131, 8677-8682 |
| 4104570 | CIF | Ba Hg2 Tl2 | P 42/m n m | 10.5933; 10.5933; 5.1594 90; 90; 90 | 578.98 | Jing-Cao Dai; Shalabh Gupta; Olivier Gourdon; Hyun-Jeong Kim; John D. Corbett BaHg2Tl2. An Unusual Polar Intermetallic Phase with Strong Differentiation between the Neighboring Elements Mercury and Thallium Journal of the American Chemical Society, 2009, 131, 8677-8682 |
| 4104672 | CIF | Ba I5 Nb O16 | C 1 c 1 | 13.9886; 7.4843; 14.8896 90; 112.969; 90 | 1435.27 | Chuan-Fu Sun; Chun-Li Hu; Xiang Xu; Ji-Bei Ling; Ting Hu; Fang Kong; Xi-Fa Long; Jiang-Gao Mao BaNbO(IO3)5: A New Polar Material with a Very Large SHG Response Journal of the American Chemical Society, 2009, 131, 9486-9487 |
| 4124002 | CIF | Ba Ir O2.94 | C 1 2/m 1 | 9.9554; 5.7434; 13.8049 90; 119.231; 90 | 688.819 | Cheng Jinguang; Alonso, J.A.; Zhou Jianshi; Suard, E.; Goodenough, J.B. A new perovskite polytype in the high-pressure sequence of Ba Ir O3 Journal of the American Chemical Society, 2009, 131, 7461-7469 |
| 4124001 | CIF | Ba Ir O3 | C 1 2/m 1 | 10.0046; 5.75362; 15.1839 90; 103.27; 90 | 850.689 | Cheng Jinguang; Alonso, J.A.; Suard, E.; Goodenough, J.B.; Zhou Jianshi A new perovskite polytype in the high-pressure sequence of Ba Ir O3 Journal of the American Chemical Society, 2009, 131, 7461-7469 |
| 4124003 | CIF | Ba Ir O3 | C 1 2/c 1 | 5.7483; 9.939; 14.3582 90; 91.319; 90 | 820.1 | Cheng Jinguang; Alonso, J.A.; Zhou Jianshi; Suard, E.; Goodenough, J.B. A new perovskite polytype in the high-pressure sequence of Ba Ir O3 Journal of the American Chemical Society, 2009, 131, 7461-7469 |
| 4124004 | CIF | Ba Ir O3 | P m -3 m | 4.0611; 4.0611; 4.0611 90; 90; 90 | 66.978 | Cheng Jinguang; Alonso, J.A.; Suard, E.; Zhou Jianshi; Goodenough, J.B. A new perovskite polytype in the high-pressure sequence of Ba Ir O3 Journal of the American Chemical Society, 2009, 131, 7461-7469 |
| 4113867 | CIF | Ba Mo2 O9 Te | P 1 21 1 | 5.5407; 7.4651; 8.8448 90; 90.841; 90 | 365.8 | Hyun-Seup Ra; Kang Min Ok; P. Shiv Halasyamani Combining Second-Order Jahn-Teller Distorted Cations to Create Highly Efficient SHG Materials: Synthesis, Characterization, and NLO Properties of BaTeM2O9 (M = Mo6+ or W6+) Journal of the American Chemical Society, 2003, 125, 7764-7765 |
| 4123984 | CIF | Ba Ni S2 | P 4/n m m :2 | 4.43; 4.43; 8.893 90; 90; 90 | 174.524 | Grey, I.E.; Steinfink, H. Crystal structure and properties of barium nickel sulfide, a square-pyramidal nickel(II) compound Journal of the American Chemical Society, 1970, 92, 5093-5095 |
| 4124842 | CIF | Ba O3 Ti | P m -3 m | 4.0335; 4.0335; 4.0335 90; 90; 90 | 65.622 | Edwards, J.W.; Speiser, R.; Johnston, H.L. Structure of Barium Titanate at Elevated Temperatures Journal of the American Chemical Society, 1951, 73, 2934-2935 |
| 4114760 | CIF | Ba O7 Te3 | P 1 21/n 1 | 10.2765; 5.251; 13.5499 90; 98.98; 90 | 722.22 | Magnus G. Johnston; William T. A. Harrison Lone-Pair Self-Containment in Tellurite Tubes: Hydrothermal Syntheses and Structures of BaTe3O7 and BaTe4O9 Journal of the American Chemical Society, 2002, 124, 4576-4577 |
| 4113868 | CIF | Ba O9 Te W2 | P 1 21 1 | 5.49; 7.446; 8.887 90; 90.37; 90 | 363.3 | Hyun-Seup Ra; Kang Min Ok; P. Shiv Halasyamani Combining Second-Order Jahn-Teller Distorted Cations to Create Highly Efficient SHG Materials: Synthesis, Characterization, and NLO Properties of BaTeM2O9 (M = Mo6+ or W6+) Journal of the American Chemical Society, 2003, 125, 7764-7765 |
| 4114761 | CIF | Ba O9 Te4 | C 1 2/c 1 | 19.5354; 4.5099; 23.3021 90; 112.961; 90 | 1890.32 | Magnus G. Johnston; William T. A. Harrison Lone-Pair Self-Containment in Tellurite Tubes: Hydrothermal Syntheses and Structures of BaTe3O7 and BaTe4O9 Journal of the American Chemical Society, 2002, 124, 4576-4577 |
| 4113101 | CIF | Ba Pt | P 63/m m c | 5.057; 5.057; 5.42 90; 90; 120 | 120.04 | Andrey Karpov; Jürgen Nuss; Ulrich Wedig; Martin Jansen Covalently Bonded [Pt]-Chains in BaPt: Extension of the Zintl-Klemm Concept to Anionic Transition Metals? Journal of the American Chemical Society, 2004, 126, 14123-14128 |
| 4102184 | CIF | Ba0.208 Co0.208 F0.042 O0.542 | P 63/m m c | 5.6995; 5.6995; 23.799 90; 90; 120 | 669.5 | Olivier Mentré; Houria Kabbour; Ghislaine Ehora; Grégory Tricot; Sylvie Daviero-Minaud; Myung-Hwan Whangbo Anion-Vacancy-Induced Magneto-Crystalline Anisotropy in Fluorine-Doped hexagonal Cobaltites Journal of the American Chemical Society, 2010, 132, 4865-4875 |
| 4107910 | CIF HKL | Ba0.41 Ca0.39 Fe1.25 Nd0.45 O3.25 | I m m a | 5.56053; 38.7107; 5.58133 90; 90; 90 | 1201.39 | Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments Journal of the American Chemical Society, 2008, 130, 7570-7583 |
| 4102185 | CIF | Ba0.417 Co0.417 F0.083 O1.083 | P 63/m m c | 5.71; 5.71; 23.925 90; 90; 120 | 675.5 | Olivier Mentré; Houria Kabbour; Ghislaine Ehora; Grégory Tricot; Sylvie Daviero-Minaud; Myung-Hwan Whangbo Anion-Vacancy-Induced Magneto-Crystalline Anisotropy in Fluorine-Doped hexagonal Cobaltites Journal of the American Chemical Society, 2010, 132, 4865-4875 |
| 4134320 | CIF | Ba0.5 F2 H O Te0.5 | P m n 21 | 7.5013; 8.6517; 4.2142 90; 90; 90 | 273.5 | Zhou, Jinjie; Wu, Hongping; Yu, Hongwei; Jiang, Shutong; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng; Halasyamani, P. Shiv BaF<sub>2</sub>TeF<sub>2</sub>(OH)<sub>2</sub>: A UV Nonlinear Optical Fluorotellurite Material Designed by Band-Gap Engineering. Journal of the American Chemical Society, 2020 |
| 4118236 | CIF | Ba0.8 Fe O2 Sr0.2 | P 4/m m m | 8.30167; 8.30167; 3.84632 90; 90; 90 | 265.08 | Takafumi Yamamoto; Yoji Kobayashi; Naoaki Hayashi; Cédric Tassel; Takashi Saito; Shoji Yamanaka; Mikio Takano; Kenji Ohoyama; Yuichi Shimakawa; Kazuyoshi Yoshimura; Hiroshi Kageyama (Sr1-xBax)FeO2 (0.4 <=x<= 1): A New Oxygen-Deficient Perovskite Structure Journal of the American Chemical Society, 2012, 134, 11444-11454 |
| 4107895 | CIF HKL | Ba0.81 Ca0.78 Fe2.5 Nd0.91 O6.43 | I m m a | 5.58392; 38.9909; 5.61065 90; 90; 90 | 1221.56 | Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments Journal of the American Chemical Society, 2008, 130, 7570-7583 |
| 4107909 | CIF HKL | Ba1.62 Ca1.56 Fe5 Nd1.82 O13 | I 2 m b | 5.56049; 38.71093; 5.58134 90; 90; 90 | 1201.39 | Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments Journal of the American Chemical Society, 2008, 130, 7570-7583 |
| 4119283 | CIF | Ba13.3 Ga36.4 Rb9.9 Sn99.6 | F d -3 m :2 | 17.0367; 17.0367; 17.0367 90; 90; 90 | 4944.9 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119284 | CIF | Ba14 Ga30.4 K2 Sn105.6 | F d -3 m :2 | 17.0136; 17.0136; 17.0136 90; 90; 90 | 4924.8 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119285 | CIF | Ba14 Ga30.4 K2 Sn105.6 | F d -3 m :2 | 17.0235; 17.0235; 17.0235 90; 90; 90 | 4933.4 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119287 | CIF | Ba14 Ga30.4 K2 Sn105.6 | F d -3 m :2 | 17.049; 17.049; 17.049 90; 90; 90 | 4955.6 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119286 | CIF | Ba15 Ga30.4 K2 Sn105.6 | F d -3 m :2 | 17.0292; 17.0292; 17.0292 90; 90; 90 | 4938.4 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119279 | CIF | Ba16 Cs8 Ga39.7 Sn96.3 | F d -3 m :2 | 17.0113; 17.0113; 17.0113 90; 90; 90 | 4922.8 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119280 | CIF | Ba16 Cs8 Ga39.7 Sn96.3 | F d -3 m :2 | 17.0145; 17.0145; 17.0145 90; 90; 90 | 4925.6 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119281 | CIF | Ba16 Cs8 Ga39.7 Sn96.3 | F d -3 m :2 | 17.0283; 17.0283; 17.0283 90; 90; 90 | 4937.6 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119282 | CIF | Ba16 Cs8 Ga39.7 Sn96.3 | F d -3 m :2 | 17.0347; 17.0347; 17.0347 90; 90; 90 | 4943.1 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4119288 | CIF | Ba16 Ga32.1 Na0 Sn103.9 | F d -3 m :2 | 16.9963; 16.9963; 16.9963 90; 90; 90 | 4909.8 | Marion C. Schäfer; Svilen Bobev Tin Clathrates with the Type II Structure Journal of the American Chemical Society, 2013, 135, 1696-1699 |
| 4114707 | CIF | Ba16 Na204 Sn309.48 | F -4 3 m | 25.1998; 25.1998; 25.1998 90; 90; 90 | 16002.6 | Svilen Bobev; Slavi C. Sevov Naked Clusters of 56 Tin Atoms in the Solid State Journal of the American Chemical Society, 2002, 124, 3359-3365 |
| 4114709 | CIF | Ba16 Na204 Sn309.5 | F -4 3 m | 25.2029; 25.2029; 25.2029 90; 90; 90 | 16008.5 | Svilen Bobev; Slavi C. Sevov Naked Clusters of 56 Tin Atoms in the Solid State Journal of the American Chemical Society, 2002, 124, 3359-3365 |
| 4114706 | CIF | Ba16 Na204 Sn309.95 | F -4 3 m | 25.2041; 25.2041; 25.2041 90; 90; 90 | 16010.8 | Svilen Bobev; Slavi C. Sevov Naked Clusters of 56 Tin Atoms in the Solid State Journal of the American Chemical Society, 2002, 124, 3359-3365 |
| 4114708 | CIF | Ba16 Na204 Sn322.38 | F -4 3 m | 25.0534; 25.0534; 25.0534 90; 90; 90 | 15725.3 | Svilen Bobev; Slavi C. Sevov Naked Clusters of 56 Tin Atoms in the Solid State Journal of the American Chemical Society, 2002, 124, 3359-3365 |
| 4106492 | CIF | Ba19 Cl12.54 N61.46 O10.54 P36 | F m -3 c | 26.8541; 26.8541; 26.8541 90; 90; 90 | 19365.6 | Stefan J. Sedlmaier; Markus Döblinger; Oliver Oeckler; Johannes Weber; Jörn Schmedt auf der Günne; Wolfgang Schnick Unprecedented Zeolite-Like Framework Topology Constructed from Cages with 3-Rings in a Barium Oxonitridophosphate Journal of the American Chemical Society, 2011, 133, 12069-12078 |
| 4107935 | CIF | Ba2 F2 Fe2 O S2 | I 4/m m m | 4.12377; 4.12377; 19.0885 90; 90; 90 | 324.609 | Houria Kabbour; Etienne Janod; Benoît Corraze; Michel Danot; Changhoon Lee; Myung-Hwan Whangbo; Laurent Cario Structure and Magnetic Properties of Oxychalcogenides A2F2Fe2OQ2 (A = Sr, Ba; Q = S, Se) with Fe2O Square Planar Layers Representing an Antiferromagnetic Checkerboard Spin Lattice Journal of the American Chemical Society, 2008, 130, 8261-8270 |
| 4107933 | CIF | Ba2 F2 Fe2 O Se2 | I 4/m m m | 4.1946; 4.1946; 19.522 90; 90; 90 | 343.48 | Houria Kabbour; Etienne Janod; Benoît Corraze; Michel Danot; Changhoon Lee; Myung-Hwan Whangbo; Laurent Cario Structure and Magnetic Properties of Oxychalcogenides A~2~F~2~Fe~2~OQ~2 (A = Sr, Ba; Q = S, Se) with Fe2O Square Planar Layers Representing an Antiferromagnetic Checkerboard Spin Lattice Journal of the American Chemical Society, 2008, 130, 8261-8270 |
| 4124486 | CIF | Ba2 N O3 V | P n m a | 7.70736; 5.92871; 10.50584 90; 90; 90 | 480.061 | Clarke, S.J.; Puyet, M.; Chalker, P.R.; Holman, J.; Michie, C.W.; Rosseinsky, M.J. A first transition series pseudotetrahedral oxynitride anion: synthesis and characterization of Ba2 V O3 N Journal of the American Chemical Society, 2002, 124, 3337-3342 |
| 4116209 | CIF | Ba2 Ni Si3 | P -6 2 m | 11.392; 11.392; 3.938 90; 90; 120 | 442.6 | Joanna Goodey; Jianggao Mao; Arnold M. Guloy Ba2NiSi3: A One-Dimensional Solid-State Metallocene Analog Journal of the American Chemical Society, 2000, 122, 10478-10479 |
| 4121993 | CIF | Ba2 O15 P5 Rb | P 1 c 1 | 8.6814; 7.3122; 13.837 90; 128.498; 90 | 687.44 | Zhao, Sangen; Gong, Pifu; Luo, Siyang; Bai, Lei; Lin, Zheshuai; Ji, Chengmin; Chen, Tianliang; Hong, Maochun; Luo, Junhua Deep-Ultraviolet Transparent Phosphates RbBa2(PO3)5 and Rb2Ba3(P2O7)2 Show Nonlinear Optical Activity from Condensation of [PO4](3-) Units. Journal of the American Chemical Society, 2014, 136, 8560-8563 |
| 4128550 | CIF | Ba2 P6 Si3 | P n a 21 | 9.6272; 9.1437; 11.9261 90; 90; 90 | 1049.83 | Mark, Justin; Wang, Jian; Wu, Kui; Lo, Jeane Gladys; Lee, Shannon; Kovnir, Kirill Ba<sub>2</sub>Si<sub>3</sub>P<sub>6</sub>: 1D Nonlinear Optical Material with Thermal Barrier Chains. Journal of the American Chemical Society, 2019, 141, 11976-11983 |
| 4117781 | CIF | Ba23 Ga8 S38 Sb2 | C m c 21 | 9.611; 32.246; 12.883 90; 90; 90 | 3993 | Mei-Chun Chen; Li-Ming Wu; Hua Lin; Liu-Jiang Zhou; Ling Chen Disconnection Enhances the Second Harmonic Generation Response: Synthesis and Characterization of Ba23Ga8Sb2S38 Journal of the American Chemical Society, 2012, 134, 6058-6060 |
| 4117481 | CIF HKL | Ba3 Bi Ir2 O9 | C 1 2/c 1 | 5.94197; 10.24152; 14.97189 90; 92.3182; 90 | 910.366 | Wojciech Miiller; Maxim Avdeev; Qingdi Zhou; Brendan J. Kennedy; Neeraj Sharma; Ramzi Kutteh; Gordon J. Kearley; Siegber Schmid; Kevin S. Knight; Peter E. R. Blanchard; Chris D. Ling Giant Magnetoelastic Effect at the Opening of a Spin-Gap in Ba3BiIr2O9 Journal of the American Chemical Society, 2012, 134, 3265-3270 |
| 4117483 | CIF HKL | Ba3 Bi Ir2 O9 | C 1 2/c 1 | 5.94251; 10.24416; 14.972 90; 92.2969; 90 | 910.704 | Wojciech Miiller; Maxim Avdeev; Qingdi Zhou; Brendan J. Kennedy; Neeraj Sharma; Ramzi Kutteh; Gordon J. Kearley; Siegber Schmid; Kevin S. Knight; Peter E. R. Blanchard; Chris D. Ling Giant Magnetoelastic Effect at the Opening of a Spin-Gap in Ba3BiIr2O9 Journal of the American Chemical Society, 2012, 134, 3265-3270 |
| 4117484 | CIF HKL | Ba3 Bi Ir2 O9 | C 1 2/c 1 | 5.93816; 10.24207; 14.85187 90; 92.2902; 90 | 902.555 | Wojciech Miiller; Maxim Avdeev; Qingdi Zhou; Brendan J. Kennedy; Neeraj Sharma; Ramzi Kutteh; Gordon J. Kearley; Siegber Schmid; Kevin S. Knight; Peter E. R. Blanchard; Chris D. Ling Giant Magnetoelastic Effect at the Opening of a Spin-Gap in Ba3BiIr2O9 Journal of the American Chemical Society, 2012, 134, 3265-3270 |
| 4120695 | CIF | Ba3 Br O10 P3 | P 21 21 21 | 7.1722; 11.364; 13.998 90; 90; 90 | 1140.9 | Yu, Peng; Wu, Li-Ming; Zhou, Liu-Jiang; Chen, Ling Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). Journal of the American Chemical Society, 2014, 136, 480-487 |
| 4120694 | CIF | Ba3 Cl O10 P3 | P c a 21 | 14.2771; 5.5968; 14.1592 90; 90; 90 | 1131.41 | Yu, Peng; Wu, Li-Ming; Zhou, Liu-Jiang; Chen, Ling Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). Journal of the American Chemical Society, 2014, 136, 480-487 |
| 4117365 | CIF | Ba3 Cl2 Cs Ga5 Se10 | I -4 | 8.7348; 8.7348; 15.697 90; 90; 90 | 1197.6 | Peng Yu; Liu-Jiang Zhou; Ling Chen Noncentrosymmetric Inorganic Open-Framework Chalcohalides with Strong Middle IR SHG and Red Emission: Ba3AGa5Se10Cl2 (A = Cs, Rb, K) Journal of the American Chemical Society, 2012, 134, 2227-2235 |
| 4117367 | CIF | Ba3 Cl2 Ga5 K Se10 | I -4 | 8.6341; 8.6341; 15.644 90; 90; 90 | 1166.2 | Peng Yu; Liu-Jiang Zhou; Ling Chen Noncentrosymmetric Inorganic Open-Framework Chalcohalides with Strong Middle IR SHG and Red Emission: Ba3AGa5Se10Cl2 (A = Cs, Rb, K) Journal of the American Chemical Society, 2012, 134, 2227-2235 |
| 4117366 | CIF | Ba3 Cl2 Ga5 Rb Se10 | I -4 | 8.6629; 8.6629; 15.6379 90; 90; 90 | 1173.56 | Peng Yu; Liu-Jiang Zhou; Ling Chen Noncentrosymmetric Inorganic Open-Framework Chalcohalides with Strong Middle IR SHG and Red Emission: Ba3AGa5Se10Cl2 (A = Cs, Rb, K) Journal of the American Chemical Society, 2012, 134, 2227-2235 |
| 4115315 | CIF | Ba3 Li O9 Ru2 | P 63/m m c | 5.782; 5.782; 14.149 90; 90; 120 | 409.65 | Katharine E. Stitzer; Mark D. Smith; William R. Gemmill; Hans-Conrad zur Loye Novel Mixed-Valent (V/VI) Triple Perovskite Ruthenates: Observation of a Complex Low-Temperature Structural and Magnetic Transition Journal of the American Chemical Society, 2002, 124, 13877-13885 |
| 4115316 | CIF | Ba3 Na O9 Ru2 | P 63/m m c | 5.8729; 5.8729; 14.4676 90; 90; 120 | 432.15 | Katharine E. Stitzer; Mark D. Smith; William R. Gemmill; Hans-Conrad zur Loye Novel Mixed-Valent (V/VI) Triple Perovskite Ruthenates: Observation of a Complex Low-Temperature Structural and Magnetic Transition Journal of the American Chemical Society, 2002, 124, 13877-13885 |
| 4115317 | CIF | Ba3 Na O9 Ru2 | C m c m | 11.7282; 20.3541; 14.4856 90; 90; 90 | 3458 | Katharine E. Stitzer; Mark D. Smith; William R. Gemmill; Hans-Conrad zur Loye Novel Mixed-Valent (V/VI) Triple Perovskite Ruthenates: Observation of a Complex Low-Temperature Structural and Magnetic Transition Journal of the American Chemical Society, 2002, 124, 13877-13885 |
| 4125022 | CIF | Ba3 O14 P2 Te Zn3 | P 3 2 1 | 8.4744; 8.4744; 5.2818 90; 90; 120 | 328.5 | Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society, 2016, 138, 4984-4989 |
| 4121994 | CIF | Ba3 O14 P4 Rb2 | P 21 21 21 | 8.9487; 9.4087; 18.4277 90; 90; 90 | 1551.53 | Zhao, Sangen; Gong, Pifu; Luo, Siyang; Bai, Lei; Lin, Zheshuai; Ji, Chengmin; Chen, Tianliang; Hong, Maochun; Luo, Junhua Deep-Ultraviolet Transparent Phosphates RbBa2(PO3)5 and Rb2Ba3(P2O7)2 Show Nonlinear Optical Activity from Condensation of [PO4](3-) Units. Journal of the American Chemical Society, 2014, 136, 8560-8563 |
| 4124646 | CIF | Ba3 O9 Sr Ta2 | P -3 m 1 | 5.95; 5.95; 7.47 90; 90; 120 | 229.026 | Galasso, F.; Katz, L.; Barrante, J.R. Alkaline earth-tantalum-oxygen phases including the crystal structure of an ordered perovskite compound, Ba3 Sr Ta2 O9 Journal of the American Chemical Society, 1961, 83, 2830-2832 |
| 4105679 | CIF | Ba4 Co2 Cu3.89 O4 S4 | I 4/m m m | 4.0711; 4.0711; 18.9094 90; 90; 90 | 313.402 | Catherine F. Smura; Dinah R. Parker; Mohamed Zbiri; Mark R. Johnson; Zoltán A. Gál; Simon J. Clarke High-Spin Cobalt(II) Ions in Square Planar Coordination: Structures and Magnetism of the Oxysulfides Sr2CoO2Cu2S2 and Ba2CoO2Cu2S2 and Their Solid Solution Journal of the American Chemical Society, 2011, 133, 2691-2705 |
| 4124776 | CIF | Ba8 Fe8 O21 | F m -3 m | 8.05; 8.05; 8.05 90; 90; 90 | 521.66 | Erchak, M.; Ward, R.; Fankuchen, I. Reaction between Ferric Oxide and Barium Carbonate in the Solid Phase. Identification of Phases by X-Ray Diffraction Journal of the American Chemical Society, 1946, 68, 2085-2093 |
| 4124475 | CIF | Be Cl15 K3 Zr6 | C 1 2/c 1 | 16.372; 11.396; 14.071 90; 92.74; 90 | 2622.3 | Ziebarth, R.P.; Corbett, J.D. Cluster Framework Structures and Relationships. Two Compounds with a New Connectivity, K2 Zr6 Cl15 B and K3 Zr6 Cl15 Be Journal of the American Chemical Society, 1988, 110, 1132-1139 |
| 4124122 | CIF | Be Cl2 | I -4 3 m | 19.79146; 19.79146; 19.79146 90; 90; 90 | 7752.35 | Zwijnenburg, M.A.; Cora, F.; Bell, R.G. Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2 Journal of the American Chemical Society, 2008, 130, 11082-11087 |
| 4124123 | CIF | Be Cl2 | P 32 | 11.51593; 11.51593; 8.400845 90; 90; 120 | 964.832 | Zwijnenburg, M.A.; Cora, F.; Bell, R.G. Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2 Journal of the American Chemical Society, 2008, 130, 11082-11087 |
| 4124124 | CIF | Be Cl2 | P -4 3 n | 9.845269; 9.845269; 9.845269 90; 90; 90 | 954.295 | Zwijnenburg, M.A.; Cora, F.; Bell, R.G. Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2 Journal of the American Chemical Society, 2008, 130, 11082-11087 |
| 4124119 | CIF | Be F2 | C 1 2/c 1 | 6.97192; 12.02685; 6.96194 90; 120.02; 90 | 505.449 | Zwijnenburg, M.A.; Bell, R.G.; Cora, F. Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2 Journal of the American Chemical Society, 2008, 130, 11082-11087 |
| 4124120 | CIF | Be F2 | P -4 3 n | 8.529749; 8.529749; 8.529749 90; 90; 90 | 620.596 | Zwijnenburg, M.A.; Cora, F.; Bell, R.G. Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2 Journal of the American Chemical Society, 2008, 130, 11082-11087 |
| 4124121 | CIF | Be F2 | R -3 m :H | 13.1285; 13.1285; 14.42939 90; 90; 120 | 2153.82 | Zwijnenburg, M.A.; Cora, F.; Bell, R.G. Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2 Journal of the American Chemical Society, 2008, 130, 11082-11087 |
| 4103451 | CIF | Be H2 K2 O8 Si4 | C 1 c 1 | 12.1773; 7.0903; 12.8804 90; 104.209; 90 | 1078.08 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4103445 | CIF | Be Na2 O14 Si5 | I -4 3 d | 13.3184; 13.3184; 13.3184 90; 90; 90 | 2362.41 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4103444 | CIF | Be0.25 K0.5 O3.75 Si | C 2 2 21 | 9.6631; 12.2031; 9.9913 90; 90; 90 | 1178.17 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4103446 | CIF | Be12 Na4 O4 Si4 | I -4 | 9.8276; 9.8276; 9.6372 90; 90; 90 | 930.78 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4113113 | CIF | Be13 Ce | F m -3 c | 10.376; 10.376; 10.376 90; 90; 90 | 1117.1 | Zakiya S. Wilson; Robin T. Macaluso; E. D. Bauer; J. L. Smith; J. D. Thompson; Z. Fisk; George G. Stanley; Julia Y. Chan Rare Beryllium Icosahedra in the Intermediate Valence Compound CeBe13 Journal of the American Chemical Society, 2004, 126, 13926-13927 |
| 4103443 | CIF | Be2 Na5 O57 Si18 | P 21 21 2 | 9.6889; 10.0184; 11.8966 90; 90; 90 | 1154.77 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4103943 | CIF | Bi Cs5 P4 Se12 | P m c 21 | 7.5357; 13.7783; 28.0807 90; 90; 90 | 2915.59 | In Chung; Jung-Hwan Song; Joon I. Jang; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis Flexible Polar Nanowires of Cs5BiP4Se12 from Weak Interactions between Coordination Complexes: Strong Nonlinear Optical Second Harmonic Generation Journal of the American Chemical Society, 2009, 131, 2647-2656 |
| 4126512 | CIF | Bi Cu2 H3 O10 S Te | P 1 21/c 1 | 9.591; 6.323; 15.092 90; 115.38; 90 | 826.9 | Tang, Yingying; Peng, Cheng; Guo, Wenbin; Wang, Jun-Feng; Su, Gang; He, Zhangzhen The Octa-Kagomé Lattice Compounds Showing Quantum Critical Behaviors: Spin Gap Ground State versus Antiferromagnetic Ordering. Journal of the American Chemical Society, 2017 |
| 4126511 | CIF | Bi Cu2 O10 S Se | P 1 21/c 1 | 9.467; 6.3083; 14.775 90; 115.242; 90 | 798.1 | Tang, Yingying; Peng, Cheng; Guo, Wenbin; Wang, Jun-Feng; Su, Gang; He, Zhangzhen The Octa-Kagomé Lattice Compounds Showing Quantum Critical Behaviors: Spin Gap Ground State versus Antiferromagnetic Ordering. Journal of the American Chemical Society, 2017 |
| 4110814 | CIF | Bi Cu2 O6 P0.32 V0.68 | P n m a | 11.884; 5.237; 7.808 90; 90; 90 | 485.9 | Olivier Mentré; El Mostafa Ketatni; Marie Colmont; Marielle Huvé; Francis Abraham; Vaclav Petricek Structural Features of the Modulated BiCu2(P1-xVx)O6 Solid Solution; 4-D Treatment of x=0.87 Compound and Magnetic Spin-Gap to Gapless Transition in New Cu2+ Two-Leg Ladder Systems Journal of the American Chemical Society, 2006, 128, 10857-10867 |
| 4110815 | CIF | Bi Cu2 O6 P0.4 V0.6 | P n m a | 11.9736; 5.28702; 7.80964 90; 90; 90 | 494.387 | Olivier Mentré; El Mostafa Ketatni; Marie Colmont; Marielle Huvé; Francis Abraham; Vaclav Petricek Structural Features of the Modulated BiCu2(P1-xVx)O6 Solid Solution; 4-D Treatment of x=0.87 Compound and Magnetic Spin-Gap to Gapless Transition in New Cu2+ Two-Leg Ladder Systems Journal of the American Chemical Society, 2006, 128, 10857-10867 |
| 4106584 | CIF | Bi I O4 | P c a 21 | 5.6584; 11.0386; 5.7476 90; 90; 90 | 359 | Sau Doan Nguyen; Jeongho Yeon; Sang-Hwan Kim; P. Shiv Halasyamani BiO(IO3): A New Polar Iodate that Exhibits an Aurivillius-Type (Bi2O2)2+ Layer and a Large SHG Response Journal of the American Chemical Society, 2011, 133, 12422-12425 |
| 4123920 | CIF | Bi K P2 Se6 | P 1 21 1 | 6.9183; 7.663; 10.239 90; 91.508; 90 | 542.632 | Breshears, J.D.; Kanatzidis, M.G. beta-(K M P2 Se6) (M = Sb, Bi): kinetically accessible phases obtained from rapid crystallisation of amorphous precursors Journal of the American Chemical Society, 2000, 122, 7839-7840 |
| 4123993 | CIF | Bi O3 Sc | C 1 2 1 | 9.8906; 5.8222; 10.0467 90; 108.303; 90 | 549.271 | Belik, A.A.; Shamoto, S.; Kodama, K.; Igawa, N.; Iikubo, S.; Takayama-Muromachi, E.; Maie, M.; Matsui, Y.; Stefanovich, S.Yu.; Nagai, T.; Lazoryak, B.I. Bi Sc O3: Centrosymmetric Bi Mn O3-type oxide Journal of the American Chemical Society, 2006, 128, 706-707 |
| 4117463 | CIF HKL | Bi0.04 Na0.14 O2 Si | F d -3 m :2 | 24.60237; 24.60237; 24.60237 90; 90; 90 | 14891.2 | Hong-Tao Sun; Yoshitaka Matsushita; Yoshio Sakka; Naoto Shirahata; Masahiko Tanaka; Yoshio Katsuya; Hong Gao; Keisuke Kobayashi Synchrotron X-ray, Photoluminescence, and Quantum Chemistry Studies of Bismuth-Embedded Dehydrated Zeolite Y Journal of the American Chemical Society, 2012, 134, 2918-2921 |
| 4133771 | CIF | Bi1.07 Co3.5 K3.44 Li0.67 O131.08 P5 W30 | C m m a | 21.6852; 79.711; 26.2481 90; 90; 90 | 45371 | Chen, Linfeng; San, Khin A.; Turo, Michael J.; Gembicky, Milan; Fereidouni, Shelir; Kalaj, Mark; Schimpf, Alina M. Tunable Metal Oxide Frameworks via Coordination Assembly of Preyssler-Type Molecular Clusters. Journal of the American Chemical Society, 2019 |
| 4116198 | CIF | Bi2 Cs3 | C 1 2/c 1 | 10.078; 10.3207; 10.145 90; 105.21; 90 | 1018.24 | Franck Gascoin; Slavi C. Sevov Synthesis and Characterization of A3Bi2 (A = K, Rb, Cs) with Isolated Diatomic Dianion of Bismuth, [Bi2]2-, and an Extra Delocalized Electron Journal of the American Chemical Society, 2000, 122, 10251-10252 |
| 4116776 | CIF | Bi2 H102 Mn2 N4 Na6 O113 W20 | P 1 21/n 1 | 12.85; 25.1; 16.02 90; 95.08; 90 | 5146.7 | Michael Bösing; Andreas Nöh; Ina Loose; Bernt Krebs Highly Efficient Catalysts in Directed Oxygen-Transfer Processes: Synthesis, Structures of Novel Manganese-Containing Heteropolyanions, and Applications in Regioselective Epoxidation of Dienes with Hydrogen Peroxide Journal of the American Chemical Society, 1998, 120, 7252-7259 |
| 4118540 | CIF | Bi2 Mn Se4 | C 1 2/m 1 | 13.319; 4.0703; 15.179 90; 115.49; 90 | 742.8 | Kulugammana G. S. Ranmohotti; Honore Djieutedjeu; Pierre F. P. Poudeu Chemical Manipulation of Magnetic Ordering in Mn1-xSnxBi2Se4 Solid-Solutions Journal of the American Chemical Society, 2012, 134, 14033-14042 |
| 4135458 | CIF | Bi2 Mo | I 4/m c m | 6.4155; 6.4155; 5.488 90; 90; 90 | 225.88 | Altman, Alison B.; Tamerius, Alexandra D.; Koocher, Nathan Z.; Meng, Yue; Pickard, Chris J.; Walsh, James P. S.; Rondinelli, James M.; Jacobsen, Steven D.; Freedman, Danna E. Computationally Directed Discovery of MoBi2 Journal of the American Chemical Society, 2020 |
| 4126030 | CIF | Bi2.17 Cd1.83 K1.83 S6 | C m c m | 3.9986; 6.92; 23.184 90; 90; 90 | 641.5 | Zhao, Jing; Islam, Saiful M.; Kontsevoi, Oleg Y.; Tan, Gangjian; Stoumpos, Constantinos C.; Chen, Haijie; Li, Rukang; Kanatzidis, Mercouri G. The Two-Dimensional AxCdxBi4-xQ6 (A = K, Rb, Cs; Q = S, Se): Direct Bandgap Semiconductors and Ion-Exchange Materials. Journal of the American Chemical Society, 2017 |
| 4126031 | CIF | Bi2.46 Cd1.54 Rb1.53 S6 | C m c m | 3.9968; 6.9243; 23.7 90; 90; 90 | 655.9 | Zhao, Jing; Islam, Saiful M.; Kontsevoi, Oleg Y.; Tan, Gangjian; Stoumpos, Constantinos C.; Chen, Haijie; Li, Rukang; Kanatzidis, Mercouri G. The Two-Dimensional AxCdxBi4-xQ6 (A = K, Rb, Cs; Q = S, Se): Direct Bandgap Semiconductors and Ion-Exchange Materials. Journal of the American Chemical Society, 2017 |
| 4127955 | CIF | Bi2.72 Cs1.03 Mn1.28 S6 | P 63/m m c | 3.9548; 3.9548; 24.0993 90; 90; 120 | 326.43 | Wang, Ruiqi; Chen, Haijie; Xiao, Yi; Hadar, Ido; Bu, Kejun; Zhang, Xian; Pan, Jie; Gu, Yuhao; Guo, Zhongnan; Huang, Fuqiang; Kanatzidis, Mercouri G. K<sub> <i>x</i> </sub>[Bi<sub>4-<i>x</i></sub>Mn<sub> <i>x</i> </sub>S<sub>6</sub>], Design of a Highly Selective Ion Exchange Material and Direct Gap 2D Semiconductor. Journal of the American Chemical Society, 2019, 141, 16903-16914 |
| 4127957 | CIF | Bi2.72 K1.28 Mn1.28 S6 | P 63/m m c | 3.9521; 3.9521; 23.0937 90; 90; 120 | 312.38 | Wang, Ruiqi; Chen, Haijie; Xiao, Yi; Hadar, Ido; Bu, Kejun; Zhang, Xian; Pan, Jie; Gu, Yuhao; Guo, Zhongnan; Huang, Fuqiang; Kanatzidis, Mercouri G. K<sub> <i>x</i> </sub>[Bi<sub>4-<i>x</i></sub>Mn<sub> <i>x</i> </sub>S<sub>6</sub>], Design of a Highly Selective Ion Exchange Material and Direct Gap 2D Semiconductor. Journal of the American Chemical Society, 2019, 141, 16903-16914 |
| 4127956 | CIF | Bi2.72 Mn1.28 Rb0.88 S6 | P 63/m m c | 3.95293; 3.95293; 23.5976 90; 90; 120 | 319.33 | Wang, Ruiqi; Chen, Haijie; Xiao, Yi; Hadar, Ido; Bu, Kejun; Zhang, Xian; Pan, Jie; Gu, Yuhao; Guo, Zhongnan; Huang, Fuqiang; Kanatzidis, Mercouri G. K<sub> <i>x</i> </sub>[Bi<sub>4-<i>x</i></sub>Mn<sub> <i>x</i> </sub>S<sub>6</sub>], Design of a Highly Selective Ion Exchange Material and Direct Gap 2D Semiconductor. Journal of the American Chemical Society, 2019, 141, 16903-16914 |
| 4127958 | CIF | Bi2.72 Mn1.28 S6 Zn0.64 | P 63/m m c | 3.94702; 3.94702; 23.4271 90; 90; 120 | 316.07 | Wang, Ruiqi; Chen, Haijie; Xiao, Yi; Hadar, Ido; Bu, Kejun; Zhang, Xian; Pan, Jie; Gu, Yuhao; Guo, Zhongnan; Huang, Fuqiang; Kanatzidis, Mercouri G. K<sub> <i>x</i> </sub>[Bi<sub>4-<i>x</i></sub>Mn<sub> <i>x</i> </sub>S<sub>6</sub>], Design of a Highly Selective Ion Exchange Material and Direct Gap 2D Semiconductor. Journal of the American Chemical Society, 2019, 141, 16903-16914 |
| 4103008 | CIF | Bi3 Mn3 O10.5 | P n -3 :2 | 9.11919; 9.11919; 9.11919 90; 90; 90 | 758.348 | Alexei A. Belik; Eiji Takayama-Muromachi Effects of Oxygen Content on Bi3Mn3O11+δ: From 45 K Antiferromagnetism to Room-Temperature True Ferromagnetism Journal of the American Chemical Society, 2010, 132, 12426-12432 |
| 4103009 | CIF | Bi3 Mn3 O11.6 | P n -3 :2 | 9.11151; 9.11151; 9.11151 90; 90; 90 | 756.434 | Alexei A. Belik; Eiji Takayama-Muromachi Effects of Oxygen Content on Bi3Mn3O11+δ: From 45 K Antiferromagnetism to Room-Temperature True Ferromagnetism Journal of the American Chemical Society, 2010, 132, 12426-12432 |
| 4119563 | CIF | Bi3 O2 S3 | I 4/m m m | 3.967213; 3.967213; 41.2847 90; 90; 90 | 649.771 | W. Adam Phelan; David C. Wallace; Kathryn E. Arpino; James R. Neilson; Kenneth J. Livi; Che R. Seabourne; Andrew J. Scott; Tyrel M. McQueen Stacking Variants and Superconductivity in the Bi-O-S System Journal of the American Chemical Society, 2013, 135, 5372-5374 |
| 4114683 | CIF | Bi3.09 Cs0.91 Pb1.91 Te7 | C m c m | 4.3456; 32.476; 12.5075 90; 90; 90 | 1765.2 | Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures Journal of the American Chemical Society, 2002, 124, 2410-2411 |
| 4114685 | CIF | Bi3.12 Cs0.88 Sn1.88 Te7 | C m c m | 4.3881; 33.139; 12.6075 90; 90; 90 | 1833.3 | Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures Journal of the American Chemical Society, 2002, 124, 2410-2411 |
| 4114682 | CIF | Bi3.15 Cs0.85 Pb0.85 Te6 | C m c m | 6.3322; 28.667; 4.3637 90; 90; 90 | 792.12 | Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures Journal of the American Chemical Society, 2002, 124, 2410-2411 |
| 4114684 | CIF | Bi3.16 Cs0.84 Sn0.84 Te6 | C m c m | 6.2613; 28.479; 4.3207 90; 90; 90 | 770.45 | Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures Journal of the American Chemical Society, 2002, 124, 2410-2411 |
| 4112588 | CIF | Bi4 Cs Te6 | C 1 2/m 1 | 51.9205; 4.4025; 14.5118 90; 101.48; 90 | 3250.75 | Duck-Young Chung; Tim P. Hogan; Melissa Rocci-Lane; Paul Brazis; John R. Ireland; Carl R. Kannewurf; Marina Bastea; Ctirad Uher; Mercouri G. Kanatzidis A New Thermoelectric Material: CsBi4Te6 Journal of the American Chemical Society, 2004, 126, 6414-6428 |
| 4123274 | CIF | Bi4 Fe2 Se8 | C 1 2/m 1 | 13.372; 4.1277; 15.072 90; 115.046; 90 | 753.68 | Ranmohotti, Kulugammana G. S.; Djieutedjeu, Honore; Lopez, Juan; Page, Alexander; Haldolaarachchige, Neel; Chi, Hang; Sahoo, Pranati; Uher, Ctirad; Young, David; Poudeu, Pierre F. P. Coexistence of High-Tc Ferromagnetism and n-Type Electrical Conductivity in FeBi2Se4. Journal of the American Chemical Society, 2015, 137, 691-698 |
| 4123275 | CIF | Bi4 Fe2 Se8 | C 1 2/m 1 | 13.2972; 4.1037; 15.038 90; 114.931; 90 | 744.12 | Ranmohotti, Kulugammana G. S.; Djieutedjeu, Honore; Lopez, Juan; Page, Alexander; Haldolaarachchige, Neel; Chi, Hang; Sahoo, Pranati; Uher, Ctirad; Young, David; Poudeu, Pierre F. P. Coexistence of High-Tc Ferromagnetism and n-Type Electrical Conductivity in FeBi2Se4. Journal of the American Chemical Society, 2015, 137, 691-698 |
| 4123276 | CIF | Bi4 Fe2 Se8 | C 1 2/m 1 | 13.3533; 4.1171; 15.0687 90; 115.037; 90 | 750.59 | Ranmohotti, Kulugammana G. S.; Djieutedjeu, Honore; Lopez, Juan; Page, Alexander; Haldolaarachchige, Neel; Chi, Hang; Sahoo, Pranati; Uher, Ctirad; Young, David; Poudeu, Pierre F. P. Coexistence of High-Tc Ferromagnetism and n-Type Electrical Conductivity in FeBi2Se4. Journal of the American Chemical Society, 2015, 137, 691-698 |
| 4118541 | CIF | Bi4 Mn2 Se8 | C 1 2/m 1 | 13.384; 4.0925; 15.224 90; 115.54; 90 | 752.4 | Kulugammana G. S. Ranmohotti; Honore Djieutedjeu; Pierre F. P. Poudeu Chemical Manipulation of Magnetic Ordering in Mn1-xSnxBi2Se4 Solid-Solutions Journal of the American Chemical Society, 2012, 134, 14033-14042 |
| 4100269 | CIF | Bi4 Mn2.7 Ni1.3 O12 | P n 21 m | 5.4939; 11.115; 15.503 90; 90; 90 | 946.7 | Journal of the American Chemical Society, 2005 |
| 4126032 | CIF | Bi5.74 Cd2.26 Cs2.27 Se12 | C m c m | 4.1363; 7.1476; 25.047 90; 90; 90 | 740.5 | Zhao, Jing; Islam, Saiful M.; Kontsevoi, Oleg Y.; Tan, Gangjian; Stoumpos, Constantinos C.; Chen, Haijie; Li, Rukang; Kanatzidis, Mercouri G. The Two-Dimensional AxCdxBi4-xQ6 (A = K, Rb, Cs; Q = S, Se): Direct Bandgap Semiconductors and Ion-Exchange Materials. Journal of the American Chemical Society, 2017 |
| 4126648 | CIF | Bi8 Cl0.64 Cu3.46 O8 Se5.36 | I 4/m m m | 3.8979; 3.8979; 29.8291 90; 90; 90 | 453.21 | Gibson, Quinn D.; Dyer, Matthew S.; Whitehead, George F. S.; Alaria, Jonathan; Pitcher, Michael J.; Edwards, Holly J.; Claridge, John B.; Zanella, Marco; Dawson, Karl; Manning, Troy D.; Dhanak, Vin R.; Rosseinsky, Matthew J. Bi4O4Cu1.7Se2.7Cl0.3: Intergrowth of BiOCuSe and Bi2O2Se Stabilized by the Addition of a Third Anion. Journal of the American Chemical Society, 2017 |
| 4115838 | CIF | Bi8 I Ni8 S | P 4 | 9.774; 9.774; 4.197 90; 90; 90 | 400.94 | Alexey I. Baranov; Lars A. Kloo; Andrei V. Olenev; Boris A. Popovkin; Anatolii I. Romanenko; Andrei V. Shevelkov Unique Metallic Wires in a Novel Quasi-1D Compound. Synthesis, Crystal and Electronic Structure, and Properties of Ni8Bi8SI Journal of the American Chemical Society, 2001, 123, 12375-12379 |
| 4118542 | CIF | Bi8 Mn Se16 Sn3 | C 1 2/m 1 | 13.493; 4.126; 15.322 90; 115.52; 90 | 769.8 | Kulugammana G. S. Ranmohotti; Honore Djieutedjeu; Pierre F. P. Poudeu Chemical Manipulation of Magnetic Ordering in Mn1-xSnxBi2Se4 Solid-Solutions Journal of the American Chemical Society, 2012, 134, 14033-14042 |
| 4109760 | CIF | Bi9 Ca9 Cd4.06 | P b a m | 22.499; 12.7079; 4.7229 90; 90; 90 | 1350.3 | Sheng-qing Xia; Svilen Bobev Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi Journal of the American Chemical Society, 2007, 129, 10011-10018 |
| 4109765 | CIF | Bi9 Ca9 Zn4.09 | P b a m | 22.0688; 12.5898; 4.6336 90; 90; 90 | 1287.41 | Sheng-qing Xia; Svilen Bobev Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi Journal of the American Chemical Society, 2007, 129, 10011-10018 |
| 4109761 | CIF | Bi9 Cd4 Yb9 | P b a m | 22.426; 12.629; 4.72 90; 90; 90 | 1336.8 | Sheng-qing Xia; Svilen Bobev Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi Journal of the American Chemical Society, 2007, 129, 10011-10018 |
| 4109763 | CIF | Bi9 Cd4.21 Eu9 | P b a m | 23.1615; 13.0114; 4.8588 90; 90; 90 | 1464.27 | Sheng-qing Xia; Svilen Bobev Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi Journal of the American Chemical Society, 2007, 129, 10011-10018 |
| 4109762 | CIF | Bi9 Cd4.27 Sr9 | P b a m | 23.402; 13.186; 4.8906 90; 90; 90 | 1509.1 | Sheng-qing Xia; Svilen Bobev Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi Journal of the American Chemical Society, 2007, 129, 10011-10018 |
| 4115854 | CIF | Bi9 Yb9 Zn4 | P b a m | 12.5705; 22.028; 4.6401 90; 90; 90 | 1284.9 | Sung-Jin Kim; Jim Salvador; Daniel Bilc; S. D. Mahanti; Mercouri G. Kanatzidis Yb9Zn4Bi9: Extension of the Zintl Concept to the Mixed-Valent Spectator Cations Journal of the American Chemical Society, 2001, 123, 12704-12705 |
| 4109764 | CIF | Bi9 Yb9 Zn4.03 | P b a m | 21.997; 12.5243; 4.6283 90; 90; 90 | 1275.1 | Sheng-qing Xia; Svilen Bobev Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi Journal of the American Chemical Society, 2007, 129, 10011-10018 |
| 4126399 | CIF | Bk I4 O12 | P 4/n | 8.5604; 8.5604; 7.5746 90; 90; 90 | 555.07 | Silver, Mark A.; Cary, Samantha K.; Garza, Alejandro J.; Baumbach, Ryan E.; Arico, Alexandra A.; Galmin, Gregory A.; Chen, Kuan-Wen; Johnson, Jason A.; Wang, Jamie C.; Clark, Ronald J.; Chemey, Alexander; Eaton, Teresa M.; Marsh, Matthew L.; Seidler, Kevin; Galley, Shane S.; van de Burgt, Lambertus; Gray, Ashley L.; Hobart, David E.; Hanson, Kenneth; van Cleve, Shelley M.; Gendron, Frédéric; Autschbach, Jochen; Scuseria, Gustavo E.; Maron, Laurent; Speldrich, Manfred; Kögerler, Paul; Celis-Barros, Cristian; Paéz-Hernandéz, Dayán; Arratia-Perez, Ramiro; Ruf, Michael; Albrecht-Schmitt, Thomas E Departure from a Spherically Symmetric Ground State in a System with a Half-filled Shell: The Case Example of Berkelium(IV) Iodate. Journal of the American Chemical Society, 2017 |
| 4126398 | CIF | Bk2 I6 O18 | P 1 21/n 1 | 8.7475; 5.9029; 15.0832 90; 96.8723; 90 | 773.23 | Silver, Mark A.; Cary, Samantha K.; Garza, Alejandro J.; Baumbach, Ryan E.; Arico, Alexandra A.; Galmin, Gregory A.; Chen, Kuan-Wen; Johnson, Jason A.; Wang, Jamie C.; Clark, Ronald J.; Chemey, Alexander; Eaton, Teresa M.; Marsh, Matthew L.; Seidler, Kevin; Galley, Shane S.; van de Burgt, Lambertus; Gray, Ashley L.; Hobart, David E.; Hanson, Kenneth; van Cleve, Shelley M.; Gendron, Frédéric; Autschbach, Jochen; Scuseria, Gustavo E.; Maron, Laurent; Speldrich, Manfred; Kögerler, Paul; Celis-Barros, Cristian; Paéz-Hernandéz, Dayán; Arratia-Perez, Ramiro; Ruf, Michael; Albrecht-Schmitt, Thomas E Departure from a Spherically Symmetric Ground State in a System with a Half-filled Shell: The Case Example of Berkelium(IV) Iodate. Journal of the American Chemical Society, 2017 |
| 1010096 | CIF | Br | C m c a | 16.67; 4.48; 8.72 90; 90; 90 | 651.2 | Vonnegut, B; Warren, B E The Structure of Crystalline Bromine Journal of the American Chemical Society, 1936, 58, 2459-2461 |
| 4101395 | CIF | Br Cl Fe2 O10 Te4 | P 1 21/c 1 | 13.2722; 6.5965; 14.2351 90; 108.02; 90 | 1185.15 | Becker, Richard; Johnsson, Mats; Kremer, Reinhard K; Klauss, Hans-Henning; Lemmens, Peter Crystal structure and magnetic properties of FeTe2O5X (X=Cl, Br): a frustrated spin cluster compound with a new Te(IV) coordination polyhedron. Journal of the American Chemical Society, 2006, 128, 15469-15475 |
| 1010076 | CIF | Br Cu | F -4 3 m | 5.82; 5.82; 5.82 90; 90; 90 | 197.1 | Wyckoff, R W G; Posnjak, E The Crystal Structures of the Cuprous Halides Journal of the American Chemical Society, 1922, 44, 30-36 |
| 1008127 | CIF | Br D4 N | P -4 3 m | 4; 4; 4 90; 90; 90 | 64 | Levy, H A; Peterson, S W Neutron Diffraction Determination of the Crystal Structure of Ammonium Bromide in Four Phases Journal of the American Chemical Society, 1953, 75, 1536-1542 |
| 1008128 | CIF | Br D4 N | P m -3 m | 4.06; 4.06; 4.06 90; 90; 90 | 66.9 | Levy, H A; Peterson, S W Neutron Diffraction Determination of the Crystal Structure of Ammonium Bromide in Four Phases Journal of the American Chemical Society, 1953, 75, 1536-1542 |
| 1008129 | CIF | Br D4 N | P 4/n m m :1 | 5.826; 5.826; 4.136 90; 90; 90 | 140.4 | Levy, H A; Peterson, S W Neutron Diffraction Determination of the Crystal Structure of Ammonium Bromide in Four Phases Journal of the American Chemical Society, 1953, 75, 1536-1542 |
| 1008920 | CIF | Br D4 N | F m -3 m | 6.9; 6.9; 6.9 90; 90; 90 | 328.5 | Levy, H A; Peterson, S W Neutron diffraction determination of the crystal structure of ammonium bromide in four phases Journal of the American Chemical Society, 1953, 75, 1536-1542 |
| 4122207 | CIF | Br F3 N2 O5 | C 1 2/c 1 | 9.892; 12.862; 10.141 90; 105.381; 90 | 1244 | Lehmann, John F.; Schrobilgen, Gary J. Synthesis and characterization of salts containing the BrO(3)F(2)(-) anion; a rare example of a bromine(VII) species. Journal of the American Chemical Society, 2005, 127, 9416-9427 |
| 4124320 | CIF | Br H14 K4 O23 P8 Pt2 | P 4/m b m | 13.131; 13.131; 8.139 90; 90; 90 | 1403.35 | Butler, L.G.; Zietlow, M.H.; Clark, R.J.H.; Gray, H.B.; Che, C.; Grunthaner, P.J.; Sridhar, S.; Schaefer, W.P.; Swanson, B.I. Translational Symmetries in the Linear-Chain Semiconductors K4 (Pt2 (P2 O5 H2)4 X) * n(H2 O) (X = Cl, Br, I) Journal of the American Chemical Society, 1988, 110, 1155-1162 |
| 1010074 | CIF | Br H4 N | F m -3 m | 6.9; 6.9; 6.9 90; 90; 90 | 328.5 | Bartlett, G; Langmuir, I The Crystal Structure of the Ammonium Halides Above and Below the Transition Temperature Journal of the American Chemical Society, 1921, 43, 84-91 |
| 1011300 | CIF | Br H4 N | P m -3 m | 3.988; 3.988; 3.988 90; 90; 90 | 63.4 | Bartlett, G; Langmuir, I The crystal structure of the ammonium halides above and below the transition temperature Journal of the American Chemical Society, 1921, 43, 84-91 |
| 1010378 | CIF | Br Na O3 | P 21 3 | 6.71; 6.71; 6.71 90; 90; 90 | 302.1 | Dickinson, R G; Goodhue, E A The Crystal Structures of Sodium Chlorate and Sodium Bromate Journal of the American Chemical Society, 1921, 43, 2045-2055 |
| 4117065 | CIF | Br1.89 H17.2 O8.6 | P 42/m n m | 23.0436; 23.0436; 12.0745 90; 90; 90 | 6411.7 | Konstantin A. Udachin; Gary D. Enright; Christopher I. Ratcliffe; John A. Ripmeester Structure, Stoichiometry, and Morphology of Bromine Hydrate Journal of the American Chemical Society, 1997, 119, 11481-11486 |
| 4121641 | CIF | Br2 Cd I2 Rb2 | A m a 2 | 11.764; 12.025; 8.446 90; 90; 90 | 1194.8 | Wu, Qi; Meng, Xianggao; Zhong, Cheng; Chen, Xingguo; Qin, Jingui Rb2CdBr2I2: A New IR Nonlinear Optical Material with a Large Laser Damage Threshold. Journal of the American Chemical Society, 2014, 136, 5683 |
| 4126915 | CIF | Br2 Cs4 O83 S8 Ti12 | P -1 | 13.5076; 16.1427; 21.3336 69.897; 72.364; 67.624 | 3959.3 | Zhang, Guanyun; Li, Wenyun; Liu, Caiyun; Jia, Jiong; Tung, Chen-Ho; Wang, Yifeng Titanium-Oxide Host Clusters with Exchangeable Guests. Journal of the American Chemical Society, 2017 |
| 4101394 | CIF | Br2 Fe2 O10 Te4 | P 1 21/c 1 | 13.3964; 6.5966; 14.2897 90; 108.118; 90 | 1200.18 | Becker, Richard; Johnsson, Mats; Kremer, Reinhard K; Klauss, Hans-Henning; Lemmens, Peter Crystal structure and magnetic properties of FeTe2O5X (X=Cl, Br): a frustrated spin cluster compound with a new Te(IV) coordination polyhedron. Journal of the American Chemical Society, 2006, 128, 15469-15475 |
| 1010855 | CIF | Br2 H18 N6 Ni | 10.48; 10.48; 10.48 90; 90; 90 | 1151 | Wyckoff, R W G The crystal structures of the hexaammoniates of the nickel halides Journal of the American Chemical Society, 1922, 44, 1239-1245 | |
| 1011077 | CIF | Br2 Hg2 | P 42/m n m | 4.66; 4.66; 11.12 90; 90; 90 | 241.5 | Havighurst, R J Parameters in crystal structure. The mercurouos halides Journal of the American Chemical Society, 1926, 48, 2113-2131 |
| 1010204 | CIF | Br3 H18 Nd O18 | P 63 m c | 11.73; 11.73; 6.76 90; 90; 120 | 805.5 | Helmholz, L The Crystal Structure of Neodymium Enneahydrate, Nd (Br O~3~)~3~ (H~2~ O)~9~ Journal of the American Chemical Society, 1939, 61, 1544-1550 |
| 4133380 | CIF | Br3 Mo3 S10 | P 1 21/c 1 | 24.246; 15.3192; 24.56 90; 119.55; 90 | 7936 | Ji, Zhe; Trickett, Christopher; Pei, Xiaokun; Yaghi, Omar M. Linking Molybdenum-Sulfur Clusters for Electrocatalytic Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 13618-13622 |
| 4103825 | CIF | Br3 Tc | P m m n :2 | 11.0618; 5.9755; 6.3873 90; 90; 90 | 422.2 | Frederic Poineau; Efrain E. Rodriguez; Paul M. Forster; Alfred P. Sattelberger; Anthony K. Cheetham; Kenneth R. Czerwinski Preparation of the Binary Technetium Bromides: TcBr3 and TcBr4 Journal of the American Chemical Society, 2009, 131, 910-911 |
| 4123936 | CIF | Br4 Cs2 Re6 Se8 | P 1 21/n 1 | 6.544; 18.687; 9.263 90; 104.26; 90 | 1097.85 | Long, J.R.; Holm, R.H.; McCarty, L.S. A solid-state route to molecular clusters: access to the solution chemistry of (Re6 Q8)(2+) (Q = S, Se) core-containing clusters via dimensional reduction Journal of the American Chemical Society, 1996, 118, 4603-4616 |
| 4103826 | CIF | Br4 Tc | P b c a | 6.3237; 12.1777; 14.7397 90; 90; 90 | 1135.08 | Frederic Poineau; Efrain E. Rodriguez; Paul M. Forster; Alfred P. Sattelberger; Anthony K. Cheetham; Kenneth R. Czerwinski Preparation of the Binary Technetium Bromides: TcBr3 and TcBr4 Journal of the American Chemical Society, 2009, 131, 910-911 |
| 4124686 | CIF | Br6 K2 Re | F m -3 m | 10.445; 10.445; 10.445 90; 90; 90 | 1139.53 | Templeton, D.H.; Dauben, C.H. The crystal structure of potassium bromorhenate(IV) Journal of the American Chemical Society, 1951, 73, 4492-4493 |
| 4123934 | CIF | Br7 Cs5 Re6 S8 | R -3 c :H | 9.957; 9.957; 54.55 90; 90; 120 | 4683.63 | Long, J.R.; McCarty, L.S.; Holm, R.H. A solid-state route to molecular clusters: access to the solution chemistry of (Re6 Q8)(2+) (Q = S, Se) core-containing clusters via dimensional reduction Journal of the American Chemical Society, 1996, 118, 4603-4616 |
| 9012289 | CIF | C | F d -3 m :1 | 3.56669; 3.56669; 3.56669 90; 90; 90 | 45.373 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012290 | CIF | C | F d -3 m :1 | 3.56672; 3.56672; 3.56672 90; 90; 90 | 45.374 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012291 | CIF | C | F d -3 m :1 | 3.56678; 3.56678; 3.56678 90; 90; 90 | 45.376 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012292 | CIF | C | F d -3 m :1 | 3.56684; 3.56684; 3.56684 90; 90; 90 | 45.379 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012293 | CIF | C | F d -3 m :1 | 3.5669; 3.5669; 3.5669 90; 90; 90 | 45.381 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012294 | CIF | C | F d -3 m :1 | 3.5667; 3.5667; 3.5667 90; 90; 90 | 45.373 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012295 | CIF | C | F d -3 m :1 | 3.56674; 3.56674; 3.56674 90; 90; 90 | 45.375 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012296 | CIF | C | F d -3 m :1 | 3.56675; 3.56675; 3.56675 90; 90; 90 | 45.375 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012297 | CIF | C | F d -3 m :1 | 3.56683; 3.56683; 3.56683 90; 90; 90 | 45.378 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012298 | CIF | C | F d -3 m :1 | 3.56689; 3.56689; 3.56689 90; 90; 90 | 45.38 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012299 | CIF | C | F d -3 m :1 | 3.5668; 3.5668; 3.5668 90; 90; 90 | 45.377 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012300 | CIF | C | F d -3 m :1 | 3.5668; 3.5668; 3.5668 90; 90; 90 | 45.377 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012301 | CIF | C | F d -3 m :1 | 3.56684; 3.56684; 3.56684 90; 90; 90 | 45.379 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012302 | CIF | C | F d -3 m :1 | 3.56689; 3.56689; 3.56689 90; 90; 90 | 45.38 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012303 | CIF | C | F d -3 m :1 | 3.567; 3.567; 3.567 90; 90; 90 | 45.385 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 9012305 | CIF | C | F d -3 m :1 | 3.56678; 3.56678; 3.56678 90; 90; 90 | 45.376 | Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: Diamond #2 Journal of the American Chemical Society, 1951, 73, 5643-5646 |
| 4124637 | CIF | C Ag K O3 | I b c a | 20.23; 5.75; 5.95 90; 90; 90 | 692.119 | Donohue, J.; Helmholz, L. The crystal structure of potassium silver carbonate, K Ag C O3 Journal of the American Chemical Society, 1944, 66, 295-298 |
| 4110963 | CIF | C Al Cl4 Cu O | P -1 | 6.8752; 7.0092; 8.7362 81.798; 69.646; 85.723 | 390.53 | Michael D. Capracotta; Roger M. Sullivan; James D. Martin Sorptive Reconstruction of CuMCl4 (M = Al and Ga) upon Small-Molecule Binding and the Competitive Binding of CO and Ethylene Journal of the American Chemical Society, 2006, 128, 13463-13473 |
| 4104920 | CIF | C Al O Sc | R -3 m :H | 3.2599; 3.2599; 30.116 90; 90; 120 | 277.16 | Melanie Schroeder; Harald Hillebrecht Synthesis, Structure, Bonding, and Properties of the Oxide Carbide ScAlOC, a New Type of Compound Journal of the American Chemical Society, 2009, 131, 12172-12179 |
| 4124697 | CIF | C B4 | R -3 m :H | 5.6; 5.6; 12.12 90; 90; 120 | 329.162 | Clark, H.K.; Hoard, J.L. The crystal structure of boron carbide Journal of the American Chemical Society, 1943, 65, 2115-2119 |
| 4112513 | CIF | C Br3 Cl F31 O8 S Sb Te6 | P 1 21/n 1 | 18.617; 9.935; 19.129 90; 90.781; 90 | 3538 | Hélène P. A. Mercier; Matthew D. Moran; Gary J. Schrobilgen; Christoph Steinberg; Reijo J. Suontamo The Syntheses of Carbocations by Use of the Noble-Gas Oxidant, [XeOTeF5][Sb(OTeF5)6]: The Syntheses and Characterization of the CX3+ (X = Cl, Br, OTeF5) and CBr(OTeF5)2+ Cations and Theoretical Studies of CX3+ and BX3 (X = F, Cl, Br, I, OTeF5) Journal of the American Chemical Society, 2004, 126, 5533-5548 |
| 4114173 | CIF | C Br4 | C 1 2/c 1 | 21.086; 11.8827; 20.674 90; 111.38; 90 | 4823.6 | Sergey V. Lindeman; Jürgen Hecht; Jay K. Kochi The Charge-Transfer Motif in Crystal Engineering. Self-Assembly of Acentric (Diamondoid) Networks from Halide Salts and Carbon Tetrabromide as Electron-Donor/Acceptor Synthons Journal of the American Chemical Society, 2003, 125, 11597-11606 |
| 4107202 | CIF | C Ca Cs F O3 | P -6 2 m | 9.2999; 9.2999; 4.54 90; 90; 120 | 340.05 | Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials Journal of the American Chemical Society, 2011, 133, 20001-20007 |
| 4107198 | CIF | C Ca F K O3 | P -6 m 2 | 5.0968; 5.0968; 4.4553 90; 90; 120 | 100.23 | Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials Journal of the American Chemical Society, 2011, 133, 20001-20007 |
| 4107200 | CIF | C Ca F O3 Rb | P -6 2 m | 9.1979; 9.1979; 4.4463 90; 90; 120 | 325.77 | Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials Journal of the American Chemical Society, 2011, 133, 20001-20007 |
| 4124626 | CIF | C Ca N2 | R -3 m :R | 5.4; 5.4; 5.4 39.92; 39.92; 39.92 | 58.417 | Bredig, M.A. The crystal structure of calcium cyanamide Journal of the American Chemical Society, 1942, 64, 1730-1731 |
| 1010928 | CIF | C Ca O3 | R -3 c RS | 6.36; 6.36; 6.36 46.1; 46.1; 46.1 | 121.9 | Elliott, N A Redetermination of the Carbon - Oxygen Distance in Calcite and the Nitrogen - Oxygen Distance in Sodium Nitrate Journal of the American Chemical Society, 1937, 59, 1380-1382 |
| 4124474 | CIF | C Cl15 K Zr6 | P m m a | 18.489; 13.909; 9.69 90; 90; 90 | 2491.91 | Ziebarth, R.P.; Corbett, J.D. Cation distributions within a cluster framework. Synthesis and structure of the carbon- and boron-centered zirconium cluster compounds K Zr6 C15 C and Cs K Zr6 Cl15 B Journal of the American Chemical Society, 1987, 109, 4844-4850 |
| 4112515 | CIF | C Cl3 F30 O6 Sb Te6 | P -1 | 8.7059; 9.181; 9.862 104.111; 103.507; 98.851 | 724.5 | Hélène P. A. Mercier; Matthew D. Moran; Gary J. Schrobilgen; Christoph Steinberg; Reijo J. Suontamo The Syntheses of Carbocations by Use of the Noble-Gas Oxidant, [XeOTeF5][Sb(OTeF5)6]: The Syntheses and Characterization of the CX3+ (X = Cl, Br, OTeF5) and CBr(OTeF5)2+ Cations and Theoretical Studies of CX3+ and BX3 (X = F, Cl, Br, I, OTeF5) Journal of the American Chemical Society, 2004, 126, 5533-5548 |
| 4112514 | CIF | C Cl3 F48 O15 S3 Sb Te9 | P -1 | 10.082; 10.95; 24.572 83.482; 81.679; 70.019 | 2516.6 | Hélène P. A. Mercier; Matthew D. Moran; Gary J. Schrobilgen; Christoph Steinberg; Reijo J. Suontamo The Syntheses of Carbocations by Use of the Noble-Gas Oxidant, [XeOTeF5][Sb(OTeF5)6]: The Syntheses and Characterization of the CX3+ (X = Cl, Br, OTeF5) and CBr(OTeF5)2+ Cations and Theoretical Studies of CX3+ and BX3 (X = F, Cl, Br, I, OTeF5) Journal of the American Chemical Society, 2004, 126, 5533-5548 |
| 4110965 | CIF HKL | C Cl4 Cu Ga O | P -1 | 6.8769; 7.0155; 8.7594 80.998; 69.454; 85.731 | 390.75 | Michael D. Capracotta; Roger M. Sullivan; James D. Martin Sorptive Reconstruction of CuMCl4 (M = Al and Ga) upon Small-Molecule Binding and the Competitive Binding of CO and Ethylene Journal of the American Chemical Society, 2006, 128, 13463-13473 |
| 4118936 | CIF | C Co Na3 O7 P | P 1 21/m 1 | 8.89282; 6.61758; 5.1456 90; 89.4853; 90 | 302.801 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 4121280 | CIF | C Cs F O3 Pb | P -6 m 2 | 5.3888; 5.3888; 5.1071 90; 90; 120 | 128.44 | Guohong Zou; Ling Huang; Ning Ye; Chensheng Lin; Wendan Cheng; Hui Huang CsPbCO3F: A Strong Second-Harmonic Generation Material Derived from Enhancement via p-π Interaction Journal of the American Chemical Society, 2013, 135, 18560-18566 |
| 4103811 | CIF | C Cs N7 | P 21 21 21 | 4.3082; 7.1345; 18.6869 90; 90; 90 | 574.38 | Klapötke, Thomas M.; Stierstorfer, Jörg The CN~7~^-^ anion Journal of the American Chemical Society, 2009, 131, 1122-1134 |
| 4118935 | CIF | C Cu Na3 O7 P | P 1 21/m 1 | 9.0079; 6.43969; 5.16525 90; 88.942; 90 | 299.58 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 4125845 | CIF | C F K Mg O3 | P -6 2 m | 8.8437; 8.8437; 3.9254 90; 90; 120 | 265.878 | Tran, T. Thao; Young, Joshua; Rondinelli, James M.; Halasyamani, P. Shiv Mixed-Metal Carbonate Fluorides as Deep-Ultraviolet Nonlinear Optical Materials. Journal of the American Chemical Society, 2017, 139, 1285-1295 |
| 4107199 | CIF | C F K O3 Sr | P -6 m 2 | 5.2598; 5.2598; 4.6956 90; 90; 120 | 112.5 | Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials Journal of the American Chemical Society, 2011, 133, 20001-20007 |
| 4124275 | CIF | C F Mg O3 Rb | P -6 2 m | 9.016; 9.016; 3.9403 90; 90; 120 | 277.388 | Tran, T. Thao; He, Jiangang; Rondinelli, James M.; Halasyamani, P. Shiv RbMgCO3F: A New Beryllium-Free Deep-Ultraviolet Nonlinear Optical Material. Journal of the American Chemical Society, 2015, 150814134038006 |
| 4107201 | CIF | C F O3 Rb Sr | P -6 m 2 | 5.3; 5.3; 4.79 90; 90; 120 | 116.525 | Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials Journal of the American Chemical Society, 2011, 133, 20001-20007 |
| 4118940 | CIF | C Fe Na3 O7 P | P 1 21/m 1 | 8.95419; 6.61129; 5.16023 90; 89.6001; 90 | 305.472 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 4111404 | CIF | C H Cs N2 O2 | P 1 21/c 1 | 4.6921; 12.7144; 7.849 90; 99.2655; 90 | 462.14 | Harald Brand; Peter Mayer; Kurt Polborn; Axel Schulz; Jan J. Weigand Blue Alkali Dinitrosomethanides: Synthesis, Structure, and Bonding Journal of the American Chemical Society, 2005, 127, 1360-1361 |
| 4135376 | CIF | C H F0 Na O4 Zn | P 1 c 1 | 3.3823; 5.453; 9.2505 90; 96.88; 90 | 169.385 | Peng, Guang; Lin, Chensheng; Ye, Ning NaZnCO3(OH): A High-Performance Carbonate Ultraviolet Nonlinear Optical Crystal Derived from KBe2BO3F2 Journal of the American Chemical Society, 2020 |
| 4134742 | CIF | C H I O | P -1 | 14.5262; 17.6511; 18.136 64.033; 69.797; 67.014 | 3762.4 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
| 4117536 | CIF | C H In10 N O9.09 S16 | P 1 21/n 1 | 15.2866; 30.0105; 20.3917 90; 110.852; 90 | 8742.2 | Tao Wu; Xianhui Bu; Puhong Liao; Le Wang; Shou-Tian Zheng; Richard Ma; Pingyun Feng Superbase Route to Supertetrahedral Chalcogenide Clusters Journal of the American Chemical Society, 2012, 134, 3619-3622 |
| 4111402 | CIF | C H K N2 O2 | I -4 2 d | 9.2329; 9.2329; 9.3868 90; 90; 90 | 800.19 | Harald Brand; Peter Mayer; Kurt Polborn; Axel Schulz; Jan J. Weigand Blue Alkali Dinitrosomethanides: Synthesis, Structure, and Bonding Journal of the American Chemical Society, 2005, 127, 1360-1361 |
| 4119736 | CIF | C H N O Zn | P 4/m m m | 15.3916; 15.3916; 9.588 90; 90; 90 | 2271.4 | Nicholas C. Burtch; Himanshu Jasuja; David Dubbeldam; Krista S. Walton Molecular-level Insight into Unusual Low Pressure CO2 Affinity in Pillared Metal-Organic Frameworks Journal of the American Chemical Society, 2013, 135, 7172-7180 |
| 4103597 | CIF | C H N5 O3 | C 1 c 1 | 7.9946; 9.1402; 6.2269 90; 99.584; 90 | 448.66 | Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction Journal of the American Chemical Society, 2010, 132, 17216-17226 |
| 4135607 | CIF | C H N5 O3 | P 1 21/c 1 | 6.1997; 10.2689; 8.2547 90; 109.477; 90 | 495.45 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
| 4132054 | CIF | C H0 I3 N Pb0.818 | P m -3 m | 6.342; 6.342; 6.342 90; 90; 90 | 255.1 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4132055 | CIF | C H0 I3 N Pb0.854 | P m -3 m | 6.3338; 6.3338; 6.3338 90; 90; 90 | 254.09 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4127267 | CIF | C H0 I3 N0.96 Pb0.524 Sn0.433 | P m -3 m | 6.3063; 6.3063; 6.3063 90; 90; 90 | 250.8 | Ke, Weijun; Spanopoulos, Ioannis; Tu, Qing; Hadar, Ido; Li, Xiaotong; Shekhawat, Gajendra S.; Dravid, Vinayak P.; Kanatzidis, Mercouri G. Ethylenediammonium-Based "Hollow" Pb/Sn Perovskites with Ideal Band Gap Yield Solar Cells with Higher Efficiency and Stability. Journal of the American Chemical Society, 2019, 141, 8627-8637 |
| 4132049 | CIF | C H0 I3 N2 Pb0.755 | P 4/m b m | 9.0452; 9.0452; 6.4036 90; 90; 90 | 523.91 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4132056 | CIF | C H0 I3 N2 Pb0.946 | P m -3 m | 6.3663; 6.3663; 6.3663 90; 90; 90 | 258.02 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4127266 | CIF | C H0 I3 N2.503 Pb0.388 Sn0.412 | P m -3 m | 6.3115; 6.3115; 6.3115 90; 90; 90 | 251.419 | Ke, Weijun; Spanopoulos, Ioannis; Tu, Qing; Hadar, Ido; Li, Xiaotong; Shekhawat, Gajendra S.; Dravid, Vinayak P.; Kanatzidis, Mercouri G. Ethylenediammonium-Based "Hollow" Pb/Sn Perovskites with Ideal Band Gap Yield Solar Cells with Higher Efficiency and Stability. Journal of the American Chemical Society, 2019, 141, 8627-8637 |
| 4108306 | CIF | C H10 B11 Cl11 O4 | P 1 21/n 1 | 10.1928; 17.8149; 12.4182 90; 98.8445; 90 | 2228.13 | Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed The Nature of the Hydrated Proton H(aq)+ in Organic Solvents Journal of the American Chemical Society, 2008, 130, 12128-12138 |
| 4126748 | CIF | C H12 Mn N2 O6 P3 | P 1 21/n 1 | 7.4021; 10.2234; 13.4765 90; 103.573; 90 | 991.35 | Wu, Yue; Shaker, Sammy; Brivio, Federico; Murugavel, Ramaswamy; Bristowe, Paul D.; Cheetham, Anthony K. [Am]Mn(H2POO)3: A New Family of Hybrid Perovskites Based on the Hypophosphite Ligand. Journal of the American Chemical Society, 2017 |
| 4115743 | CIF | C H16 Co4 N O13 S | P -3 | 8.298; 8.298; 10.519 90; 90; 120 | 627.27 | Apinpus Rujiwatra; Cameron J. Kepert; John B. Claridge; Matthew J. Rosseinsky; Hitoshi Kumagai; Mohamedally Kurmoo Layered Cobalt Hydroxysulfates with Both Rigid and Flexible Organic Pillars: Synthesis, Structure, Porosity, and Cooperative Magnetism Journal of the American Chemical Society, 2001, 123, 10584-10594 |
| 4110489 | CIF | C H2 B11 Cl11 | P -1 | 8.9136; 14.4549; 14.9526 73.416; 75.619; 84.322 | 1787.8 | Evgenii S. Stoyanov; Stephan P. Hoffmann; Mark Juhasz; Christopher A. Reed The Structure of the Strongest Brønsted Acid: The Carborane Acid H(CHB11Cl11) Journal of the American Chemical Society, 2006, 128, 3160-3161 |
| 4123987 | CIF | C H2 Cl4 Cs2 O2 Ru | A m a m | 8.096; 17.19; 7.437 90; 90; 90 | 1035.01 | Stanko, J.A.; Chaipayungpundhu, S. Crystal structure of cesium trans-tetrachloroaquocarbonylruthenate(II) Journal of the American Chemical Society, 1970, 92, 5580-5585 |
| 4103808 | CIF | C H2 Li N7 O | P 1 21/c 1 | 8.9207; 4.6663; 12.8648 90; 95.608; 90 | 532.96 | Klapötke, Thomas M.; Stierstorfer, Jörg The CN~7~^-^ anion Journal of the American Chemical Society, 2009, 131, 1122-1134 |
| 4135602 | CIF | C H2 N5 Na O4 | P 1 21/c 1 | 11.9484; 3.6295; 14.0899 90; 105.13; 90 | 589.85 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
| 4103809 | CIF | C H2 N7 Na O | P 1 21/c 1 | 11.203; 7.138; 14.409 90; 91.63; 90 | 1151.8 | Klapötke, Thomas M.; Stierstorfer, Jörg The CN~7~^-^ anion Journal of the American Chemical Society, 2009, 131, 1122-1134 |
| 4117094 | CIF | C H3 F O2 | P n m a | 6.551; 5.651; 7.347 90; 90; 90 | 272 | Dirk Wiechert; Dietrich Mootz; Thomas Dahlems The Formic Acid 1D Array with H Bonds All Reversed: Structure of a Cocrystal with Hydrogen Fluoride1,2 Journal of the American Chemical Society, 1997, 119, 12665-12666 |
| 4122417 | CIF | C H3 N3 O3 | P 43 21 2 | 4.871; 4.871; 32.266 90; 90; 90 | 765.6 | Vo, Thao T.; Parrish, Damon A.; Shreeve, Jean'ne M. Tetranitroacetimidic Acid: A High Oxygen Oxidizer and Potential Replacement for Ammonium Perchlorate. Journal of the American Chemical Society, 2014, 136, 11934 |
| 4113796 | CIF | C H4 Cd N Se | P b c a | 7.09494; 6.79535; 16.7212 90; 90; 90 | 806.17 | Xiaoying Huang; Jing Li; Yong Zhang; Angelo Mascarenhas From 1D Chain to 3D Network: Tuning Hybrid II-VI Nanostructures and Their Optical Properties Journal of the American Chemical Society, 2003, 125, 7049-7055 |
| 4103602 | CIF | C H4 N6 O3 | P b c a | 9.3989; 7.9263; 15.2618 90; 90; 90 | 1136.98 | Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction Journal of the American Chemical Society, 2010, 132, 17216-17226 |
| 4135605 | CIF | C H4 N6 O3 | P -1 | 6.6353; 6.8575; 7.0924 67.848; 72.382; 80.022 | 284.24 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
| 4103598 | CIF | C H4 N6 O4 | P 1 21/c 1 | 8.489; 12.341; 5.626 90; 91.221; 90 | 589.3 | Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction Journal of the American Chemical Society, 2010, 132, 17216-17226 |
| 4135606 | CIF | C H4 N6 O4 | F d d 2 | 14.498; 44.396; 3.6494 90; 90; 90 | 2348.9 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
| 4103805 | CIF | C H4 N8 | P 1 21 1 | 3.9103; 6.914; 9.9127 90; 99.177; 90 | 264.57 | Klapötke, Thomas M.; Stierstorfer, Jörg The CN~7~^-^ anion Journal of the American Chemical Society, 2009, 131, 1122-1134 |
| 4116929 | CIF | C H44 B3 F4 Fe O3 P2 Rh4 | P 21 21 21 | 9.838; 17.799; 21.939 90; 90; 90 | 3841.7 | Alan M. Allgeier; Caroline S. Slone; Chad A. Mirkin; Louise M. Liable-Sands; Glenn P. A. Yap; Arnold L. Rheingold Electrochemically Controlling Ligand Binding Affinity for Transition Metals via RHLs: The Importance of Electrostatic Effects Journal of the American Chemical Society, 1997, 119, 550-559 |
| 4123712 | CIF | C H5 Ge I3 N2 | R 3 m :H | 8.4669; 8.4669; 11.729 90; 90; 120 | 728.2 | Stoumpos, Constantinos C.; Frazer, Laszlo; Clark, Daniel J.; Kim, Yong Soo; Rhim, Sonny H.; Freeman, Arthur J.; Ketterson, John B.; Jang, Joon I.; Kanatzidis, Mercouri G. Hybrid germanium iodide perovskite semiconductors: active lone pairs, structural distortions, direct and indirect energy gaps, and strong nonlinear optical properties. Journal of the American Chemical Society, 2015, 137, 6804-6819 |
| 4132048 | CIF | C H5 I3 N2 Pb0.743 | P 4 b m | 9.0452; 9.0452; 6.4036 90; 90; 90 | 523.91 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4132051 | CIF | C H5 I3 N2 Pb0.96 | A m m 2 | 6.3652; 9.002; 9.0065 90; 90; 90 | 516.1 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4113795 | CIF | C H5 N Te Zn | P b c a | 7.179; 6.946; 18.913 90; 90; 90 | 943.1 | Xiaoying Huang; Jing Li; Yong Zhang; Angelo Mascarenhas From 1D Chain to 3D Network: Tuning Hybrid II-VI Nanostructures and Their Optical Properties Journal of the American Chemical Society, 2003, 125, 7049-7055 |
| 4103804 | CIF | C H5 N9 | P 1 21/c 1 | 10.8114; 7.4641; 7.6676 90; 101.437; 90 | 606.47 | Klapötke, Thomas M.; Stierstorfer, Jörg The CN~7~^-^ anion Journal of the American Chemical Society, 2009, 131, 1122-1134 |
| 4125879 | CIF | C H5.15 Br0.45 I2.55 N1.85 Pb | P m -3 m | 6.2242; 6.2242; 6.2242 90; 90; 90 | 241.13 | Xie, Li-Qiang; Chen, Liang; Nan, Zi-Ang; Lin, Hai-Xin; Wang, Tan; Zhan, Dong-Ping; Yan, Jia-Wei; Mao, Bing-Wei; Tian, Zhong-Qun Understanding the Cubic Phase Stabilization and Crystallization Kinetics in Mixed Cations and Halides Perovskite Single Crystals. Journal of the American Chemical Society, 2017, 139, 3320-3323 |
| 4130071 | CIF | C H6 Br N6 | P 63/m | 7.7196; 7.7196; 6.2784 90; 90; 120 | 324.02 | Mitra, Shouvik; Kandambeth, Sharath; Biswal, Bishnu P.; Khayum M, Abdul; Choudhury, Chandan K.; Mehta, Mihir; Kaur, Gagandeep; Banerjee, Subhrashis; Prabhune, Asmita; Verma, Sandeep; Roy, Sudip; Kharul, Ulhas K.; Banerjee, Rahul Self-Exfoliated Guanidinium-Based Ionic Covalent Organic Nanosheets (iCONs). Journal of the American Chemical Society, 2016, 138, 2823-2828 |
| 5900025 | CIF | C H6 Cl N | P 4/m n c | 6.04; 6.04; 5.05 90; 90; 90 | 184.23 | J. Am. Chem. Soc., 1946, 68, 1970 |
| 4106167 | CIF | C H6 F Fe N O4 P | P n n a | 12.953; 10.6466; 6.4469 90; 90; 90 | 889.06 | Jennifer A. Armstrong; Edward R. Williams; Mark T. Weller Fluoride-Rich, Hydrofluorothermal Routes to Functional Transition Metal (Mn, Fe, Co, Cu) Fluorophosphates Journal of the American Chemical Society, 2011, 133, 8252-8263 |
| 4123711 | CIF | C H6 Ge I3 N | R 3 m :H | 8.5534; 8.5534; 11.162 90; 90; 120 | 707.2 | Stoumpos, Constantinos C.; Frazer, Laszlo; Clark, Daniel J.; Kim, Yong Soo; Rhim, Sonny H.; Freeman, Arthur J.; Ketterson, John B.; Jang, Joon I.; Kanatzidis, Mercouri G. Hybrid germanium iodide perovskite semiconductors: active lone pairs, structural distortions, direct and indirect energy gaps, and strong nonlinear optical properties. Journal of the American Chemical Society, 2015, 137, 6804-6819 |
| 4123714 | CIF | C H6 Ge I3 N3 | P 1 21/c 1 | 9.2308; 7.3399; 17.974 90; 120.65; 90 | 1047.67 | Stoumpos, Constantinos C.; Frazer, Laszlo; Clark, Daniel J.; Kim, Yong Soo; Rhim, Sonny H.; Freeman, Arthur J.; Ketterson, John B.; Jang, Joon I.; Kanatzidis, Mercouri G. Hybrid germanium iodide perovskite semiconductors: active lone pairs, structural distortions, direct and indirect energy gaps, and strong nonlinear optical properties. Journal of the American Chemical Society, 2015, 137, 6804-6819 |
| 4124388 | CIF | C H6 I3 N Pb | I 4/m c m | 8.8392; 8.8392; 12.6948 90; 90; 90 | 991.86 | Yamada, Yasuhiro; Yamada, Takumi; Phuong, Le Quang; Maruyama, Naoki; Nishimura, Hidetaka; Wakamiya, Atsushi; Murata, Yasujiro; Kanemitsu, Yoshihiko Dynamic Optical Properties of CH3NH3PbI3 Single Crystals As Revealed by One- and Two-Photon Excited Photoluminescence Measurements. Journal of the American Chemical Society, 2015, 150814091520002 |
| 4132053 | CIF | C H6 I3 N Pb0.815 | P 4 m m | 6.343; 6.343; 6.34 90; 90; 90 | 255.1 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4132057 | CIF | C H6 I3 N Pb0.847 | P 4 m m | 6.3361; 6.3361; 6.329 90; 90; 90 | 254.09 | Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742 |
| 4121027 | CIF | C H6 Mn N10 | P 1 21/c 1 | 6.158; 7.113; 18.42 90; 102; 90 | 789.2 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4121028 | CIF | C H6 Mn N10 | P 1 21/c 1 | 6.199; 7.18; 18.379 90; 102.08; 90 | 799.9 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4121029 | CIF | C H6 Mn N10 | P 1 21/c 1 | 6.203; 7.199; 18.345 90; 102.108; 90 | 801 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4121030 | CIF | C H6 Mn N10 | P 1 21/c 1 | 6.2207; 7.253; 18.333 90; 102.178; 90 | 808.5 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4121031 | CIF | C H6 Mn N10 | P 1 21/c 1 | 9.0178; 7.3951; 12.575 90; 102.369; 90 | 819.1 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4121032 | CIF | C H6 Mn N10 | P 1 21/c 1 | 9.0165; 7.3957; 12.5731 90; 102.397; 90 | 818.87 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4121033 | CIF | C H6 Mn N10 | P 1 21/c 1 | 9.023; 7.405; 12.58 90; 102.338; 90 | 821.1 | Xin-Hua Zhao; Xing-Cai Huang; Shao-Liang Zhang; Dong Shao; Hai-Yan Wei; Xin-Yi Wang Cation-Dependent Magnetic Ordering and Room-Temperature Bistability in Azido-Bridged Perovskite-Type Compounds Journal of the American Chemical Society, 2013, 135, 16006-16009 |
| 4135601 | CIF | C H6 N4 O4 | P b c a | 9.5532; 6.3625; 16.3333 90; 90; 90 | 992.77 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
| 4124803 | CIF | C H6.99 Dy3 O9.99 | I 4 3 2 | 12.5189; 12.5189; 12.5189 90; 90; 90 | 1962 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124810 | CIF | C H6.99 Dy3 O9.99 | I 4 3 2 | 12.4967; 12.4967; 12.4967 90; 90; 90 | 1951.58 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124811 | CIF | C H6.99 Dy3 O9.99 | I 4 3 2 | 12.494; 12.494; 12.494 90; 90; 90 | 1950.31 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124812 | CIF | C H6.99 Dy3 O9.99 | I 4 3 2 | 12.4967; 12.4967; 12.4967 90; 90; 90 | 1951.58 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124801 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.6563; 12.6563; 12.6563 90; 90; 90 | 2027.31 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124804 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.6606; 12.6606; 12.6606 90; 90; 90 | 2029.38 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124805 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.669; 12.669; 12.669 90; 90; 90 | 2033.42 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124806 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.6589; 12.6589; 12.6589 90; 90; 90 | 2028.56 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124807 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.6541; 12.6541; 12.6541 90; 90; 90 | 2026.25 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124808 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.6596; 12.6596; 12.6596 90; 90; 90 | 2028.9 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124809 | CIF | C H6.99 Gd3 O9.99 | I 4 3 2 | 12.6597; 12.6597; 12.6597 90; 90; 90 | 2028.94 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124802 | CIF | C H6.99 O9.99 Tb3 | I 4 3 2 | 12.59; 12.59; 12.59 90; 90; 90 | 1995.62 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124813 | CIF | C H6.99 O9.99 Tb3 | I 4 3 2 | 12.5137; 12.5137; 12.5137 90; 90; 90 | 1959.55 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124814 | CIF | C H6.99 O9.99 Tb3 | I 4 3 2 | 12.4988; 12.4988; 12.4988 90; 90; 90 | 1952.56 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4124815 | CIF | C H6.99 O9.99 Tb3 | I 4 3 2 | 12.5234; 12.5234; 12.5234 90; 90; 90 | 1964.11 | Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages. Journal of the American Chemical Society, 2015, 137, 15988-15991 |
| 4103909 | CIF | C H8 B N | P n m a | 11.135; 6.5575; 4.9194 90; 90; 90 | 359.2 | Simon Aldridge; Anthony J. Downs; Christina Y. Tang; Simon Parsons; Michael C. Clarke; Russell D. L. Johnstone; Heather E. Robertson; David W. H. Rankin; Derek A. Wann Structures and Aggregation of the Methylamine-Borane Molecules, MenH3-nN.BH3 (n= 1-3), Studied by X-ray Diffraction, Gas-Phase Electron Diffraction, and Quantum Chemical Calculations Journal of the American Chemical Society, 2009, 131, 2231-2243 |
| 4108305 | CIF | C H8 B11 Cl11 O3 | P n a 21 | 13.1286; 10.2028; 15.7311 90; 90; 90 | 2107.16 | Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed The Nature of the Hydrated Proton H(aq)+ in Organic Solvents Journal of the American Chemical Society, 2008, 130, 12128-12138 |
| 4122893 | CIF | C H8 I3 N O Pb | P 1 21/m 1 | 10.3939; 4.6419; 11.1181 90; 101.161; 90 | 526.27 | Hao, Feng; Stoumpos, Constantinos C.; Liu, Zhao; Chang, Robert P. H.; Kanatzidis, Mercouri G. Controllable Perovskite Crystallization at a Gas‒Solid Interface for Hole Conductor-Free Solar Cells with Steady Power Conversion Efficiency over 10% Journal of the American Chemical Society, 2014, 141106073145004 |
| 4128767 | CIF | C I3 N2.857 Pb0.48 Sn0.521 | P m -3 m | 6.2983; 6.2983; 6.2983 90; 90; 90 | 249.845 | Ke, Weijun; Spanopoulos, Ioannis; Tu, Qing; Hadar, Ido; Li, Xiaotong; Shekhawat, Gajendra S.; Dravid, Vinayak P.; Kanatzidis, Mercouri G. Ethylenediammonium-Based "Hollow" Pb/Sn Perovskites with Ideal Band Gap Yield Solar Cells with Higher Efficiency and Stability. Journal of the American Chemical Society, 2019, 141, 8627-8637 |
| 1010090 | CIF | C K N O | I 4/m c m | 6.07; 6.07; 7.03 90; 90; 90 | 259 | Hendricks, S B; Pauling, L The Crystal Structures of Sodium and Potassium Trinitrides and Potassium Cyanate and the Nature of the Trinitride Group Journal of the American Chemical Society, 1925, 47, 2904-2920 |
| 4135603 | CIF | C K N5 O3 | P 1 21/n 1 | 6.8957; 11.5328; 7.0382 90; 97.155; 90 | 555.37 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
| 4103810 | CIF | C K N7 | P 1 21/c 1 | 9.7759; 6.299; 8.4533 90; 96.72; 90 | 516.96 | Klapötke, Thomas M.; Stierstorfer, Jörg The CN~7~^-^ anion Journal of the American Chemical Society, 2009, 131, 1122-1134 |
| 4118939 | CIF | C Mg Na3 O7 P | P 1 21/m 1 | 8.82663; 6.61646; 5.15605 90; 89.6919; 90 | 301.114 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 4118938 | CIF | C Mn Na3 O7 P | P 1 21/m 1 | 8.98593; 6.73577; 5.15998 90; 90.1225; 90 | 312.318 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 4126518 | CIF | C Na O P | P -6 2 c | 8.5229; 8.5229; 7.178 90; 90; 120 | 451.55 | Hennersdorf, Felix; Frötschel, Julia; Weigand, Jan J. Selective Derivatization of a Hexaphosphane from Functionalization of White Phosphorus. Journal of the American Chemical Society, 2017 |
| 4118937 | CIF | C Na3 Ni O7 P | P 1 21/m 1 | 8.82621; 6.586832; 5.127293 90; 89.2669; 90 | 298.06 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 1011031 | CIF | C Si | F -4 3 m | 4.358; 4.358; 4.358 90; 90; 90 | 82.8 | Burdick, C L; Owen, E A The Atomic Structure of Carborundum Determined by X-Rays Journal of the American Chemical Society, 1918, 40, 1749-1759 |
| 4103448 | CIF | C0 Be2 K2 Na0 O12 Si4 | P 1 21/m 1 | 8.4812; 13.7542; 8.5138 90; 109.015; 90 | 938.96 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4114283 | CIF | C0 F8 Fe2 N6 O8 P2 | P n a 21 | 22.81; 7.5762; 8.8993 90; 90; 90 | 1537.9 | Trevor W. Hayton; W. Stephen McNeil; Brian O. Patrick; Peter Legzdins Toward Binary Nitrosyls: Distinctly Bent Fe-N-O Linkages in Base-Stabilized Fe(NO)3+ Complexes Journal of the American Chemical Society, 2003, 125, 12935-12944 |
| 4103447 | CIF | C0 H0 Be2 K2 O24 Si6 | P 42/n m c :2 | 13.8256; 13.8256; 9.7767 90; 90; 90 | 1868.79 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4127750 | CIF | C0 H0 K26.92 O159 P0 U24 | I 4/m | 19.6881; 19.6881; 19.0607 90; 90; 90 | 7388.3 | Xu, Mengyu; Traustason, Hrafn; Bo, Fabrice Dal; Hickam, Sarah; Chong, Saehwa; Zhang, Lei; Oliver, Allen G.; Burns, Peter C. Supramolecular Assembly of Geometrically Unstable Hybrid Organic-Inorganic Uranyl Peroxide Cage Clusters and Their Transformations. Journal of the American Chemical Society, 2019, 141, 12780-12788 |
| 4130132 | CIF | C0 H0 O228 Ti84 | F m -3 | 29.896; 29.896; 29.896 90; 90; 90 | 26720.2 | Gao, Mei-Yan; Wang, Fei; Gu, Zhi-Gang; Zhang, De-Xiang; Zhang, Lei; Zhang, Jian Fullerene-like Polyoxotitanium Cage with High Solution Stability. Journal of the American Chemical Society, 2016, 138, 2556-2559 |
| 4103450 | CIF | C0 H4 Be K O8 Si4 | P 1 | 7.1255; 7.13; 15.5209 90.315; 90.117; 90.006 | 788.52 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4110019 | CIF | C0.01 H0 O0.01 Zn0 | F m -3 m | 25.8074; 25.8074; 25.8074 90; 90; 90 | 17188 | Zhenqiang Wang; Seth M. Cohen Postsynthetic Covalent Modification of a Neutral Metal-Organic Framework Journal of the American Chemical Society, 2007, 129, 12368-12369 |
| 4118800 | CIF HKL | C0.11 Al0.1 Na0.1 O1.21 Si0.4 | I -4 3 m | 14.62823; 14.62823; 14.62823 90; 90; 90 | 3130.22 | Magdalena M. Lozinska; Enzo Mangano; John P. S. Mowat; Ashley M. Shepherd; Russell F. Howe; Stephen P. Thompson; Julia E. Parker; Stefano Brandani; Paul A. Wright Understanding Carbon Dioxide Adsorption on Univalent Cation Forms of the Flexible Zeolite Rho at Conditions Relevant to Carbon Capture from Flue Gases Journal of the American Chemical Society, 2012, 134, 17628-17642 |
| 4131764 | CIF | C0.21 H0.58 Br0.21 Mn0.05 N0.05 | P 63/m m c | 10.031; 10.031; 6.977 90; 90; 120 | 608 | Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Large Piezoelectric Effect in a Lead-Free Molecular Ferroelectric Thin Film. Journal of the American Chemical Society, 2017, 139, 18071-18077 |
| 4131510 | CIF | C0.3 H0.7 I0.13 N0.09 Rb0.04 | R 3 :R | 7.272; 7.272; 7.272 84.81; 84.81; 84.81 | 380.1 | Zhang, Wan-Ying; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Liao, Wei-Qiang; Fu, Da-Wei; Ye, Heng-Yun; Zhang, Yi; Xiong, Ren-Gen Precise Molecular Design of High-T<sub>c</sub> 3D Organic-Inorganic Perovskite Ferroelectric: [MeHdabco]RbI<sub>3</sub> (MeHdabco = N-Methyl-1,4-diazoniabicyclo[2.2.2]octane). Journal of the American Chemical Society, 2017, 139, 10897-10902 |
| 4103449 | CIF | C0.4 Be1.6 K3.2 N0.4 O12 Si6.4 | P n m a | 12.7069; 13.2309; 13.9362 90; 90; 90 | 2343 | Jennifer A. Armstrong; Mark T. Weller Beryllosilicate Frameworks and Zeolites Journal of the American Chemical Society, 2010, 132, 15679-15686 |
| 4113785 | CIF | C0.5 H34 K10 Mn4 O16.5 Se17 Sn4 | P 41 21 2 | 15.515; 15.515; 25.44 90; 90; 90 | 6123.8 | Stefanie Dehnen; Michael K. Brandmayer Reactivity of Chalcogenostannate Compounds: Syntheses, Crystal Structures, and Electronic Properties of Novel Compounds Containing Discrete Ternary Anions [MII4(μ4-Se)(SnSe4)4]10- (MII = Zn, Mn) Journal of the American Chemical Society, 2003, 125, 6618-6619 |
| 4113784 | CIF | C0.5 H34 K10 O16.5 Se17 Sn4 Zn4 | P 43 21 2 | 15.384; 15.384; 25.386 90; 90; 90 | 6008 | Stefanie Dehnen; Michael K. Brandmayer Reactivity of Chalcogenostannate Compounds: Syntheses, Crystal Structures, and Electronic Properties of Novel Compounds Containing Discrete Ternary Anions [MII4(μ4-Se)(SnSe4)4]10- (MII = Zn, Mn) Journal of the American Chemical Society, 2003, 125, 6618-6619 |
| 4126753 | CIF | C0.5 H6 Mn0.5 N1.5 O3 P1.5 | I 1 2/m 1 | 8.7596; 13.2087; 9.6956 90; 89.764; 90 | 1121.8 | Wu, Yue; Shaker, Sammy; Brivio, Federico; Murugavel, Ramaswamy; Bristowe, Paul D.; Cheetham, Anthony K. [Am]Mn(H2POO)3: A New Family of Hybrid Perovskites Based on the Hypophosphite Ligand. Journal of the American Chemical Society, 2017 |
| 4100885 | CIF | C0.69 H0.38 F0.07 N0.03 O0.12 Ru0.02 S0.02 | P 1 21/c 1 | 16.672; 31.875; 16.47 90; 105.04; 90 | 8453 | Fairchild, Robert M.; Holman, K. Travis Selective anion encapsulation by a metalated cryptophane with a pi-acidic interior. Journal of the American Chemical Society, 2005, 127, 16364-16365 |
| 4130457 | CIF | C0.99 H0.61 O0.2 Zr0.04 | F m -3 m | 38.554; 38.554; 38.554 90; 90; 90 | 57307 | Manna, Kuntal; Ji, Pengfei; Greene, Francis X.; Lin, Wenbin Metal-Organic Framework Nodes Support Single-Site Magnesium-Alkyl Catalysts for Hydroboration and Hydroamination Reactions. Journal of the American Chemical Society, 2016, 138, 7488-7491 |
| 4130788 | CIF | C1.17 H0.53 O0.24 Zr0.05 | P m -3 n | 41.512; 41.512; 41.512 90; 90; 90 | 71535 | Ji, Pengfei; Manna, Kuntal; Lin, Zekai; Urban, Ania; Greene, Francis X.; Lan, Guangxu; Lin, Wenbin Single-Site Cobalt Catalysts at New Zr8(μ2-O)8(μ2-OH)4 Metal-Organic Framework Nodes for Highly Active Hydrogenation of Alkenes, Imines, Carbonyls, and Heterocycles. Journal of the American Chemical Society, 2016, 138, 12234-12242 |
| 4130790 | CIF | C1.25 Hf0.05 O0.26 | P m -3 n | 41.516; 41.516; 41.516 90; 90; 90 | 71556 | Ji, Pengfei; Manna, Kuntal; Lin, Zekai; Urban, Ania; Greene, Francis X.; Lan, Guangxu; Lin, Wenbin Single-Site Cobalt Catalysts at New Zr8(μ2-O)8(μ2-OH)4 Metal-Organic Framework Nodes for Highly Active Hydrogenation of Alkenes, Imines, Carbonyls, and Heterocycles. Journal of the American Chemical Society, 2016, 138, 12234-12242 |
| 4128612 | CIF | C1.34 H1.18 F0.08 N0.04 Np0.24 O1.05 | P 6/m | 20.719; 20.719; 18.477 90; 90; 120 | 6869 | Gilson, Sara E.; Li, Peng; Szymanowski, Jennifer E. S.; White, Jacob; Ray, Debmalya; Gagliardi, Laura; Farha, Omar K.; Burns, Peter C. In Situ Formation of Unprecedented Neptunium-Oxide Wheel Clusters Stabilized in a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 11842-11846 |
| 4107590 | CIF | C1.5 H0.5 In0.125 K0.16 N0.58 Na0.045 O1.36 | I m -3 m | 18.761; 18.761; 18.761 90; 90; 90 | 6603 | Dorina F. Sava; Victor Ch. Kravtsov; Farid Nouar; Lukasz Wojtas; Jarrod F. Eubank; Mohamed Eddaoudi Quest for Zeolite-like Metal-Organic Frameworks: On Pyrimidinecarboxylate Bis-Chelating Bridging Ligands Journal of the American Chemical Society, 2008, 130, 3768-3770 |
| 4126749 | CIF | C1.5 H4 Mn0.5 N0.5 O3 P1.5 | C 1 2/c 1 | 13.4506; 10.2196; 7.5274 90; 103.604; 90 | 1005.69 | Wu, Yue; Shaker, Sammy; Brivio, Federico; Murugavel, Ramaswamy; Bristowe, Paul D.; Cheetham, Anthony K. [Am]Mn(H2POO)3: A New Family of Hybrid Perovskites Based on the Hypophosphite Ligand. Journal of the American Chemical Society, 2017 |
| 4100074 | CIF | C1.65 H10 N0.82 O5.24 Se U0.59 | I 2 m m | 10.8864; 29.532; 47.439 90; 90; 90 | 15251.5 | Journal of the American Chemical Society, 2005 |
| 9014909 | CIF | C1.72 H18 O10 | F d -3 m :1 | 17.175; 17.175; 17.175 90; 90; 90 | 5066.29 | Kirchner, M. T.; Boese, R.; Billups, W. E.; Norman, L. R. Gas hydrate single-crystal structure analyses Sample: (C3H8)8(H2O)136, T = 123 K Journal of the American Chemical Society, 2004, 126, 9407-9412 |
| 4133596 | CIF | C1.74 H0.5 O2.83 Zr0.5 | F d -3 m :2 | 35.0104; 35.0104; 35.0104 90; 90; 90 | 42913 | Baek, Jayeon; Rungtaweevoranit, Bunyarat; Pei, Xiaokun; Park, Myeongkee; Fakra, Sirine C.; Liu, Yi-Sheng; Matheu, Roc; Alshmimri, Sultan A.; Alshehri, Saeed; Trickett, Christopher A.; Somorjai, Gabor A.; Yaghi, Omar M. Bioinspired Metal-Organic Framework Catalysts for Selective Methane Oxidation to Methanol. Journal of the American Chemical Society, 2018, 140, 18208-18216 |
| 4121073 | CIF | C1.81 H1.94 Ag0.13 F0.77 N0.39 O0.13 P0.13 | P 1 21/c 1 | 11.9135; 10.1334; 13.9442 90; 99.587; 90 | 1659.89 | Xiao-Ping Zhou; Yuan Wu; Dan Li Polyhedral Metal-Imidazolate Cages: Control of Self-Assembly and Cage to Cage Transformation Journal of the American Chemical Society, 2013, 135, 16062-16065 |
| 4133595 | CIF | C1.9 H0.55 O2.77 Zr0.5 | F d -3 m :2 | 35.0221; 35.0221; 35.0221 90; 90; 90 | 42956 | Baek, Jayeon; Rungtaweevoranit, Bunyarat; Pei, Xiaokun; Park, Myeongkee; Fakra, Sirine C.; Liu, Yi-Sheng; Matheu, Roc; Alshmimri, Sultan A.; Alshehri, Saeed; Trickett, Christopher A.; Somorjai, Gabor A.; Yaghi, Omar M. Bioinspired Metal-Organic Framework Catalysts for Selective Methane Oxidation to Methanol. Journal of the American Chemical Society, 2018, 140, 18208-18216 |
| 4124116 | CIF | C10 F2 N4 O48 Si24 | C 1 m 1 | 10.44783; 14.9854; 8.83659 90; 105.935; 90 | 1330.33 | Yang, X.; Camblor, M.A.; Olson, D.H.; Liu, H.; Lee, Y. Synthesis and crystal structure of as-synthesized and calcined silica zeolite ITQ-12 Journal of the American Chemical Society, 2004, 126, 10403-10409 |
| 4134281 | CIF | C10 H0 F0 I4 N2 Pb | I 4/m m m | 6.5653; 6.5653; 25.81 90; 90; 90 | 1112.5 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4116324 | CIF | C10 H0 F13 N4 O U2 | P 1 21/c 1 | 15.385; 12.688; 17.532 90; 107.48; 90 | 3264.3 | R. J. Francis; P. S. Halasyamani; J. S. Bee; D. O'Hare Variable Dimensionality in the Uranium Fluoride/2-Methyl-Piperazine System: Syntheses and Structures of UFO-5, -6, and -7; Zero-, One-, and Two-Dimensional Materials with Unprecedented Topologies Journal of the American Chemical Society, 1999, 121, 1609-1610 |
| 4118763 | CIF | C10 H10 Au N2 O2 S2 Se4 | P 1 21/a 1 | 14.7952; 4.1628; 13.4493 90; 95.717; 90 | 824.22 | Gilles Yzambart; Nathalie Bellec; Ghassan Nasser; Olivier Jeannin; Thierry Roisnel; Marc Fourmigué; Pascale Auban-Senzier; Jorge Íñiguez; Enric Canadell; Dominique Lorcy Anisotropic Chemical Pressure Effects in Single-Component Molecular Metals Based on Radical Dithiolene and Diselenolene Gold Complexes Journal of the American Chemical Society, 2012, 134, 17138-17148 |
| 4118762 | CIF | C10 H10 Au N2 O2 S6 | P 1 21/a 1 | 14.135; 4.137; 13.46 90; 97.14; 90 | 781 | Gilles Yzambart; Nathalie Bellec; Ghassan Nasser; Olivier Jeannin; Thierry Roisnel; Marc Fourmigué; Pascale Auban-Senzier; Jorge Íñiguez; Enric Canadell; Dominique Lorcy Anisotropic Chemical Pressure Effects in Single-Component Molecular Metals Based on Radical Dithiolene and Diselenolene Gold Complexes Journal of the American Chemical Society, 2012, 134, 17138-17148 |
| 4118764 | CIF | C10 H10 Au N2 S4 Se4 | P 1 21/a 1 | 14.5116; 4.0984; 14.3554 90; 92.613; 90 | 852.89 | Gilles Yzambart; Nathalie Bellec; Ghassan Nasser; Olivier Jeannin; Thierry Roisnel; Marc Fourmigué; Pascale Auban-Senzier; Jorge Íñiguez; Enric Canadell; Dominique Lorcy Anisotropic Chemical Pressure Effects in Single-Component Molecular Metals Based on Radical Dithiolene and Diselenolene Gold Complexes Journal of the American Chemical Society, 2012, 134, 17138-17148 |
| 4105374 | CIF | C10 H10 Au N2 S8 | P 1 21/a 1 | 14.06; 4.0593; 14.259 90; 93.524; 90 | 812.3 | Nadine Tenn; Nathalie Bellec; Olivier Jeannin; Lidia Piekara-Sady; Pascale Auban-Senzier; Jorge Íñiguez; Enric Canadell; Dominique Lorcy A Single-Component Molecular Metal Based on a Thiazole Dithiolate Gold Complex Journal of the American Chemical Society, 2009, 131, 16961-16967 |
| 4115091 | CIF | C10 H10 B F3 O | P 1 21/n 1 | 7.4487; 17.747; 7.8625 90; 104.66; 90 | 1005.5 | Do Hyun Ryu; Thomas W. Lee; E. J. Corey Broad-Spectrum Enantioselective Diels-Alder Catalysis by Chiral, Cationic Oxazaborolidines Journal of the American Chemical Society, 2002, 124, 9992-9993 |
| 4115090 | CIF | C10 H10 B F3 O2 | P 1 21/n 1 | 9.9804; 10.1025; 10.7724 90; 107.403; 90 | 1036.4 | Do Hyun Ryu; Thomas W. Lee; E. J. Corey Broad-Spectrum Enantioselective Diels-Alder Catalysis by Chiral, Cationic Oxazaborolidines Journal of the American Chemical Society, 2002, 124, 9992-9993 |
| 4135067 | CIF | C10 H10 B2 | P -1 | 7.0969; 8.5411; 14.8555 91.182; 103.436; 97.147 | 867.87 | Scholz, Alexander Stefan; Massoth, Julian; Bursch, Markus; Mewes, Jan; Hetzke, Thilo; Wolf, Bernd; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias BNB-Doped Phenalenyls: Modular Synthesis, Optoelectronic Properties, and One-Electron Reduction. Journal of the American Chemical Society, 2020 |
| 4122923 | CIF | C10 H10 Br F O | P 21 21 21 | 4.9777; 9.2119; 21.6756 90; 90; 90 | 993.91 | Zi, Weiwei; Wang, Yi-Ming; Toste, F. Dean An in situ directing group strategy for chiral anion phase-transfer fluorination of allylic alcohols. Journal of the American Chemical Society, 2014, 136, 12864-12867 |
| 4129189 | CIF | C10 H10 Br N O | P 1 21 1 | 4.807; 7.0174; 14.3984 90; 96.901; 90 | 482.18 | Zhou, Zijun; Chen, Shuming; Hong, Yubiao; Winterling, Erik; Tan, Yuqi; Hemming, Marcel; Harms, Klaus; Houk, K. N.; Meggers, Eric Non-C2-Symmetric Chiral-at-Ruthenium Catalyst for Highly Efficient Enantioselective Intramolecular C(sp3)‒H Amidation Journal of the American Chemical Society, 2019 |
| 4110763 | CIF | C10 H10 Br2 Cl4 Cu N2 | P -1 | 7.407; 7.703; 15.506 82.644; 79.837; 68.888 | 810.4 | Guillermo Mínguez Espallargas; Lee Brammer; Jacco van de Streek; Kenneth Shankland; Alastair J. Florence; Harry Adams Reversible Extrusion and Uptake of HCl Molecules by Crystalline Solids Involving Coordination Bond Cleavage and Formation Journal of the American Chemical Society, 2006, 128, 9584-9585 |
| 4110764 | CIF | C10 H10 Br2 Cl4 Cu N2 | P -1 | 7.5702; 7.8282; 15.562 82.064; 78.89; 67.093 | 831.54 | Guillermo Mínguez Espallargas; Lee Brammer; Jacco van de Streek; Kenneth Shankland; Alastair J. Florence; Harry Adams Reversible Extrusion and Uptake of HCl Molecules by Crystalline Solids Involving Coordination Bond Cleavage and Formation Journal of the American Chemical Society, 2006, 128, 9584-9585 |
| 4110766 | CIF | C10 H10 Br2 Cl4 Cu N2 | P -1 | 7.56821; 7.82283; 15.5551 82.1012; 78.9087; 67.0878 | 830.44 | Guillermo Mínguez Espallargas; Lee Brammer; Jacco van de Streek; Kenneth Shankland; Alastair J. Florence; Harry Adams Reversible Extrusion and Uptake of HCl Molecules by Crystalline Solids Involving Coordination Bond Cleavage and Formation Journal of the American Chemical Society, 2006, 128, 9584-9585 |
| 4126312 | CIF | C10 H10 Br2 Cl4 N2 Np O2 | C 1 2/m 1 | 15.9996; 8.6659; 6.8488 90; 102.023; 90 | 928.76 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126319 | CIF | C10 H10 Br2 Cl4 N2 Np O2 | C 1 2/m 1 | 15.715; 8.6156; 6.874 90; 102.349; 90 | 909.2 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126316 | CIF | C10 H10 Br2 Cl4 N2 O2 Pu | C 1 2/m 1 | 16.1488; 8.734; 6.7757 90; 101.912; 90 | 935.09 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4108029 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.2842; 7.5139; 14.0608 90; 100.051; 90 | 1798.08 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108030 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.249; 7.4744; 13.9631 90; 100.123; 90 | 1772.2 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108031 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.2461; 7.4589; 13.9154 90; 100.129; 90 | 1762.14 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108032 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.2353; 7.4456; 13.8804 90; 100.158; 90 | 1753.3 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108033 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.2433; 7.4312; 13.8431 90; 100.143; 90 | 1746.1 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108034 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.2186; 7.4177; 13.8073 90; 100.193; 90 | 1735.67 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108035 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.211; 7.4028; 13.7689 90; 100.218; 90 | 1726.47 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108036 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.1969; 7.3925; 13.7372 90; 100.243; 90 | 1718.55 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108037 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.1915; 7.3882; 13.7152 90; 100.254; 90 | 1714.2 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108047 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.214; 7.4879; 14.0091 90; 99.98; 90 | 1778.4 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108048 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.211; 7.3392; 13.7246 90; 100.381; 90 | 1705.2 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108049 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.144; 7.2256; 13.5526 90; 100.611; 90 | 1650.1 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108050 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.137; 7.188; 13.504 90; 100.821; 90 | 1633.9 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108051 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.082; 7.066; 13.353 90; 101.073; 90 | 1581.7 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108052 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.058; 7.0335; 13.2733 90; 101.103; 90 | 1562.7 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108053 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 17.022; 6.9783; 13.1936 90; 101.2; 90 | 1537.3 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108054 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 16.968; 6.8746; 13.0779 90; 101.392; 90 | 1495.5 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108055 | CIF | C10 H10 Br4 Cl2 Co N2 | C 1 2/c 1 | 16.92; 6.768; 13.009 90; 101.541; 90 | 1459.6 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108141 | CIF | C10 H10 Cl14 Mo6 N2 O2 | P 1 21/c 1 | 8.9148; 9.6561; 17.6885 90; 94.7019; 90 | 1517.54 | Kei Inumaru; Takashi Kikudome; Hiroshi Fukuoka; Shoji Yamanaka Reversible Emergence of a Self-Assembled Layered Structure From Three-Dimensional Isotropic Ionic Crystal of a Cluster Compound (4-HNC5H4OH)2Mo6Cl14 Driven By Absorption of Water and Alcohols Journal of the American Chemical Society, 2008, 130, 10038-10039 |
| 4108140 | CIF | C10 H10 Cl14 Mo6 N2 O8 | P n a 21 | 17.1972; 9.7664; 20.8704 90; 90; 90 | 3505.28 | Kei Inumaru; Takashi Kikudome; Hiroshi Fukuoka; Shoji Yamanaka Reversible Emergence of a Self-Assembled Layered Structure From Three-Dimensional Isotropic Ionic Crystal of a Cluster Compound (4-HNC5H4OH)2Mo6Cl14 Driven By Absorption of Water and Alcohols Journal of the American Chemical Society, 2008, 130, 10038-10039 |
| 4120574 | CIF | C10 H10 Cl2 N2 Pt | P -1 | 5.4655; 6.9612; 7.6303 79.842; 84.579; 89.123 | 284.48 | Johnstone, Timothy C.; Lippard, Stephen J. The chiral potential of phenanthriplatin and its influence on Guanine binding. Journal of the American Chemical Society, 2014, 136, 2126-2134 |
| 4134072 | CIF | C10 H10 Cl4 Fe Ga | P n m a | 13.902; 8.7619; 11.972 90; 90; 90 | 1458.3 | Zhang, Han-Yue; Hu, Chun-Li; Hu, Zhao-Bo; Mao, Jiang-Gao; Song, You; Xiong, Ren-Gen Narrow Band Gap Observed in a Molecular Ferroelastic: Ferrocenium Tetrachloroferrate. Journal of the American Chemical Society, 2020 |
| 4134071 | CIF | C10 H10 Cl4 Fe2 | P n m a | 13.7297; 8.6471; 11.9568 90; 90; 90 | 1419.5 | Zhang, Han-Yue; Hu, Chun-Li; Hu, Zhao-Bo; Mao, Jiang-Gao; Song, You; Xiong, Ren-Gen Narrow Band Gap Observed in a Molecular Ferroelastic: Ferrocenium Tetrachloroferrate. Journal of the American Chemical Society, 2020 |
| 4134073 | CIF | C10 H10 Cl4 Fe2 | P n m a | 13.8181; 8.7371; 11.9538 90; 90; 90 | 1443.2 | Zhang, Han-Yue; Hu, Chun-Li; Hu, Zhao-Bo; Mao, Jiang-Gao; Song, You; Xiong, Ren-Gen Narrow Band Gap Observed in a Molecular Ferroelastic: Ferrocenium Tetrachloroferrate. Journal of the American Chemical Society, 2020 |
| 4126313 | CIF | C10 H10 Cl4 I2 N2 Np O2 | C 1 2/m 1 | 16.3553; 8.668; 6.9455 90; 102.394; 90 | 961.7 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126320 | CIF | C10 H10 Cl4 I2 N2 Np O2 | C 1 2/m 1 | 16.084; 8.61; 6.9394 90; 103.004; 90 | 936.3 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126317 | CIF | C10 H10 Cl4 I2 N2 O2 Pu | C 1 2/m 1 | 16.4644; 8.7019; 6.8794 90; 102.267; 90 | 963.12 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4108020 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.506; 7.3215; 13.9763 90; 100.516; 90 | 1660.65 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108021 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4936; 7.3003; 13.888 90; 100.556; 90 | 1643.93 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108022 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.493; 7.2802; 13.8389 90; 100.55; 90 | 1633.58 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108023 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4898; 7.2729; 13.7991 90; 100.551; 90 | 1626.93 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108024 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4924; 7.2511; 13.7532 90; 100.545; 90 | 1616.94 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108025 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4836; 7.2469; 13.7167 90; 100.551; 90 | 1610.82 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108026 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4821; 7.2348; 13.6784 90; 100.547; 90 | 1603.52 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108027 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4775; 7.226; 13.6408 90; 100.546; 90 | 1596.73 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108028 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4754; 7.2193; 13.6161 90; 100.541; 90 | 1592.18 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108038 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.52; 7.3101; 13.95 90; 100.485; 90 | 1656.5 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108039 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.5059; 7.2124; 13.752 90; 100.695; 90 | 1608.7 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108040 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4993; 7.1511; 13.6366 90; 100.808; 90 | 1580.4 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108041 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4769; 7.0705; 13.4942 90; 100.971; 90 | 1543.3 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108042 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.4411; 6.9803; 13.3444 90; 101.164; 90 | 1502.47 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108043 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.3973; 6.8907; 13.2377 90; 101.387; 90 | 1466.27 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108044 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.3564; 6.76; 13.15 90; 101.79; 90 | 1423.3 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108045 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.354; 6.577; 13.014 90; 102.23; 90 | 1368 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4108046 | CIF | C10 H10 Cl6 Co N2 | C 1 2/c 1 | 16.317; 6.5279; 12.914 90; 102.463; 90 | 1343.1 | Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br) Journal of the American Chemical Society, 2008, 130, 9058-9071 |
| 4110759 | CIF | C10 H10 Cl6 Cu N2 | P -1 | 7.1853; 7.6605; 15.4482 82.336; 80.555; 70.735 | 788.95 | Guillermo Mínguez Espallargas; Lee Brammer; Jacco van de Streek; Kenneth Shankland; Alastair J. Florence; Harry Adams Reversible Extrusion and Uptake of HCl Molecules by Crystalline Solids Involving Coordination Bond Cleavage and Formation Journal of the American Chemical Society, 2006, 128, 9584-9585 |
| 4110760 | CIF | C10 H10 Cl6 Cu N2 | P -1 | 7.3119; 7.7799; 15.497 81.684; 79.779; 69.368 | 808.69 | Guillermo Mínguez Espallargas; Lee Brammer; Jacco van de Streek; Kenneth Shankland; Alastair J. Florence; Harry Adams Reversible Extrusion and Uptake of HCl Molecules by Crystalline Solids Involving Coordination Bond Cleavage and Formation Journal of the American Chemical Society, 2006, 128, 9584-9585 |
| 4110762 | CIF | C10 H10 Cl6 Cu N2 | P -1 | 7.30931; 7.77643; 15.49792 81.6898; 79.7745; 69.3487 | 807.99 | Guillermo Mínguez Espallargas; Lee Brammer; Jacco van de Streek; Kenneth Shankland; Alastair J. Florence; Harry Adams Reversible Extrusion and Uptake of HCl Molecules by Crystalline Solids Involving Coordination Bond Cleavage and Formation Journal of the American Chemical Society, 2006, 128, 9584-9585 |
| 4126311 | CIF | C10 H10 Cl6 N2 Np O2 | C 1 2/m 1 | 15.7687; 6.7068; 9.0971 90; 105.585; 90 | 926.71 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126318 | CIF | C10 H10 Cl6 N2 Np O2 | C 1 2/m 1 | 15.705; 6.5663; 9.05 90; 105.538; 90 | 899.2 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126315 | CIF | C10 H10 Cl6 N2 O2 Pu | C 1 2/m 1 | 15.8025; 6.7045; 9.1106 90; 105.384; 90 | 930.66 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4133885 | CIF | C10 H10 Co F6 P | P 1 21/c 1 | 13.2837; 9.1759; 9.252 90; 96.293; 90 | 1120.9 | Zhu, Tianyu; Sha, Ye; Adabi Firouzjaie, Horie; Peng, Xiong; Cha, Yujin; Dissanayake, D. M. M. Mevan; Smith, Mark D.; Vannucci, Aaron K.; Mustain, William Earl; Tang, Chuanbing Rational Synthesis of Metallo-Cations Toward Redox- and Alkaline-Stable Metallo-Polyelectrolytes. Journal of the American Chemical Society, 2019 |
| 4121379 | CIF | C10 H10 Cu F4 N2 O2 V | P 1 21/c 1 | 7.107; 17.24; 12.1314 90; 125.491; 90 | 1210.2 | Romain Gautier; Kengo Oka; Takumi Kihara; Nitesh Kumar; Athinarayanan Sundaresan; Masashi Tokunaga; Masaki Azuma; Kenneth R. Poeppelmeier Spin Frustration from cis-Edge or -Corner Sharing Metal-Centered Octahedra Journal of the American Chemical Society, 2013, 135, 19268-19274 |
| 4100941 | CIF | C10 H10 Cu3 Mo2 N2 O10 | P -1 | 5.5199; 5.6912; 13.456 83.015; 85.442; 79.488 | 411.82 | Shores, M. P.; Bartlett, B. M.; Nocera, D. G. Spin-Frustrated Organic-Inorganic Hybrids of Lindgrenite Journal of the American Chemical Society, 2005, 127, 17986-17987 |
| 4128042 | CIF | C10 H10 F N O2 | C 1 2/c 1 | 20.7185; 9.3045; 12.4912 90; 133.858; 90 | 1736.31 | Yu, Jin-Sheng; Espinosa, Miguel; Noda, Hidetoshi; Shibasaki, Masakatsu Traceless Electrophilic Amination for the Synthesis of Unprotected Cyclic β-Amino Acids. Journal of the American Chemical Society, 2019, 141, 10530-10537 |
| 4103843 | CIF | C10 H10 F2 N2 Pd | P 1 21/c 1 | 16.308; 7.9739; 17.077 90; 109.33; 90 | 2095.5 | Vladimir V. Grushin; William J. Marshall trans-Difluoro Complexes of Palladium(II) Journal of the American Chemical Society, 2009, 131, 918-919 |
| 4118219 | CIF | C10 H10 F3 N O | P 1 21/c 1 | 8.8952; 7.6628; 16.6493 90; 117.473; 90 | 1006.87 | Nongnaphat Duangdee; Wacharee Harnying; Giuseppe Rulli; Jörg-M. Neudörfl; Harald Gröger; Albrecht Berkessel Highly Enantioselective Organocatalytic Trifluoromethyl Carbinol Synthesis-A Caveat on Reaction Times and Product Isolation Journal of the American Chemical Society, 2012, 134, 11196-11205 |
| 4127787 | CIF | C10 H10 F3 N O | P 21 21 21 | 4.9345; 8.6504; 23.3738 90; 90; 90 | 997.72 | Gimenez, Diana; Zhou, Guangfeng; Hurley, Matthew F. D.; Aguilar, Juan A.; Voelz, Vincent A.; Cobb, Steven L. Fluorinated Aromatic Monomers as Building Blocks To Control α-Peptoid Conformation and Structure. Journal of the American Chemical Society, 2019, 141, 3430-3434 |
| 4130091 | CIF | C10 H10 F3 N O3 | P 1 21/n 1 | 5.0912; 8.9533; 23.0489 90; 94.2965; 90 | 1047.69 | Nagamani, Chikkannagari; Liu, Huiying; Moore, Jeffrey S. Mechanogeneration of Acid from Oxime Sulfonates. Journal of the American Chemical Society, 2016, 138, 2540-2543 |
| 4120259 | CIF | C10 H10 F4 N3 Nb O | C 1 c 1 | 20.2084; 3.98043; 15.7991 90; 109.387; 90 | 1198.79 | Hongcheng Lu; Romain Gautier; Martin D. Donakowski; T.Thao Tran; Bryce W. Edwards; Juan C. Nino; P. Shiv Halasyamani; Zhengtang Liu; Kenneth R. Poeppelmeier Nonlinear Active Materials: An Illustration of Controllable Phase Matchability Journal of the American Chemical Society, 2013, 135, 11942-11950 |
| 4128109 | CIF | C10 H10 I N O | P 21 21 21 | 4.6221; 7.3099; 29.54 90; 90; 90 | 998.1 | Wang, Hao; Park, Yoonsu; Bai, Ziqian; Chang, Sukbok; He, Gang; Chen, Gong Iridium-Catalyzed Enantioselective C(sp<sup>3</sup>)-H Amidation Controlled by Attractive Noncovalent Interactions. Journal of the American Chemical Society, 2019, 141, 7194-7201 |
| 4103846 | CIF | C10 H10 I2 N2 Pd | C 1 2/m 1 | 8.71; 14.865; 5.3681 90; 100.127; 90 | 684.2 | Vladimir V. Grushin; William J. Marshall trans-Difluoro Complexes of Palladium(II) Journal of the American Chemical Society, 2009, 131, 918-919 |
| 4103847 | CIF | C10 H10 I2 N2 Pd | C 1 2/c 1 | 17.039; 4.993; 17.697 90; 115.202; 90 | 1362.3 | Vladimir V. Grushin; William J. Marshall trans-Difluoro Complexes of Palladium(II) Journal of the American Chemical Society, 2009, 131, 918-919 |
| 4119219 | CIF | C10 H10 La O16 P4 | P 1 21/c 1 | 6.0301; 18.347; 19.0401 90; 95.541; 90 | 2096.6 | Jared M. Taylor; Karl W. Dawson; George K. H. Shimizu A Water-Stable Metal-Organic Framework with Highly Acidic Pores for Proton-Conducting Applications Journal of the American Chemical Society, 2013, 135, 1193-1196 |
| 4102501 | CIF | C10 H10 N2 | P 1 21 1 | 5.5395; 8.7722; 8.7887 90; 90.678; 90 | 427.04 | Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations Journal of the American Chemical Society, 2010, 132, 7730-7744 |
| 4121576 | CIF | C10 H10 N2 O3 | C 1 2/c 1 | 20.687; 6.4683; 15.9083 90; 116.05; 90 | 1912.4 | Foo, Klement; Sella, Eran; Thomé, Isabelle; Eastgate, Martin D.; Baran, Phil S. A mild, ferrocene-catalyzed C-h imidation of (hetero)arenes. Journal of the American Chemical Society, 2014, 136, 5279-5282 |
| 4102219 | CIF | C10 H10 N2 O4 | P b c n | 11.65; 5.8419; 15.9102 90; 90; 90 | 1082.82 | Matthew J. Kryger; Mitchell T. Ong; Susan A. Odom; Nancy R. Sottos; Scott R. White; Todd J. Martinez; Jeffrey S. Moore Masked Cyanoacrylates Unveiled by Mechanical Force Journal of the American Chemical Society, 2010, 132, 4558-4559 |
| 4102220 | CIF | C10 H10 N2 O4 | P -1 | 5.9857; 9.3466; 9.4874 93.652; 100.48; 95.083 | 518.15 | Matthew J. Kryger; Mitchell T. Ong; Susan A. Odom; Nancy R. Sottos; Scott R. White; Todd J. Martinez; Jeffrey S. Moore Masked Cyanoacrylates Unveiled by Mechanical Force Journal of the American Chemical Society, 2010, 132, 4558-4559 |
| 4107146 | CIF | C10 H10 N2 O4 | P -1 | 5.9857; 9.3466; 9.4874 93.652; 100.48; 95.083 | 518.15 | Matthew J. Kryger; Alexander M. Munaretto; Jeffrey S. Moore Structure-Mechanochemical Activity Relationships for Cyclobutane Mechanophores Journal of the American Chemical Society, 2011, 133, 18992-18998 |
| 4107147 | CIF | C10 H10 N2 O4 | P b c n | 11.65; 5.8419; 15.9102 90; 90; 90 | 1082.82 | Matthew J. Kryger; Alexander M. Munaretto; Jeffrey S. Moore Structure-Mechanochemical Activity Relationships for Cyclobutane Mechanophores Journal of the American Chemical Society, 2011, 133, 18992-18998 |
| 4129285 | CIF | C10 H10 N2 O4 S | P 1 21/c 1 | 8.7977; 7.8194; 15.8743 90; 97.043; 90 | 1083.8 | Do, Jean-Louis; Mottillo, Cristina; Tan, Davin; Štrukil, Vjekoslav; Friščić, Tomislav Mechanochemical ruthenium-catalyzed olefin metathesis. Journal of the American Chemical Society, 2015, 137, 2476-2479 |
| 4135189 | CIF | C10 H10 N3 O3 Zn | R 3 c :H | 26.583; 26.583; 10.1311 90; 90; 120 | 6200.1 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
| 4122380 | CIF | C10 H10 N4 | P 1 21/c 1 | 11.2431; 10.1867; 8.9687 90; 104.512; 90 | 994.41 | Weston, Claire E.; Richardson, Robert D.; Haycock, Peter R.; White, Andrew J. P.; Fuchter, Matthew J. Arylazopyrazoles: Azoheteroarene Photoswitches Offering Quantitative Isomerization and Long Thermal Half-Lives. Journal of the American Chemical Society, 2014, 136, 11878 |
| 4125843 | CIF | C10 H10 N4 | P b c a | 10.1175; 11.0673; 16.8859 90; 90; 90 | 1890.77 | Calbo, Joaquín; Weston, Claire E.; White, Andrew J. P.; Rzepa, Henry S.; Contreras-García, Julia; Fuchter, Matthew J. Tuning Azoheteroarene Photoswitch Performance through Heteroaryl Design. Journal of the American Chemical Society, 2017, 139, 1261-1274 |
| 4106790 | CIF | C10 H10 O2 | P 21 21 21 | 7.2085; 7.8988; 13.8528 90; 90; 90 | 788.758 | Noah Z. Burns; Michael R. Witten; Eric N. Jacobsen Dual Catalysis in Enantioselective Oxidopyrylium-Based [5 + 2] Cycloadditions Journal of the American Chemical Society, 2011, 133, 14578-14581 |
| 4107369 | CIF | C10 H10 O2 | P 1 21/n 1 | 10.8535; 5.5167; 13.9943 90; 100.41; 90 | 824.12 | Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis Journal of the American Chemical Society, 2008, 130, 1741-1748 |
| 4120169 | CIF HKL | C10 H10 O2 | P 1 21 1 | 7.3733; 6.0822; 9.3401 90; 100.71; 90 | 411.57 | Javier Izquierdo; Ane Orue; Karl A. Scheidt A Dual Lewis Base Activation Strategy for Enantioselective Carbene-Catalyzed Annulations Journal of the American Chemical Society, 2013, 135, 10634-10637 |
| 4128275 | CIF | C10 H10 O2 | P b c a | 8.5386; 10.4949; 18.8536 90; 90; 90 | 1689.5 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
| 4125682 | CIF | C10 H10 O2 S | P 1 21/c 1 | 5.93; 7.2867; 20.9055 90; 90.331; 90 | 903.31 | Lopchuk, Justin M.; Fjelbye, Kasper; Kawamata, Yu; Malins, Lara R.; Pan, Chung-Mao; Gianatassio, Ryan; Wang, Jie; Prieto, Liher; Bradow, James; Brandt, Thomas A.; Collins, Michael R.; Elleraas, Jeff; Ewanicki, Jason; Farrell, William; Fadeyi, Olugbeminiyi O.; Gallego, Gary M.; Mousseau, James J.; Oliver, Robert; Sach, Neal W.; Smith, Jason K.; Spangler, Jillian E.; Zhu, Huichin; Zhu, Jinjiang; Baran, Phil S. Strain-Release Heteroatom Functionalization: Development, Scope, and Stereospecificity. Journal of the American Chemical Society, 2017, 139, 3209-3226 |
| 4118501 | CIF | C10 H10 O2 S4 | P 1 21/c 1 | 13.462; 8.271; 11.139 90; 110.853; 90 | 1159 | Takashi Shirahata; Keita Shiratori; Shouhei Kumeta; Tadashi Kawamoto; Tadahiko Ishikawa; Shin-ya Koshihara; Yoshiaki Nakano; Hideki Yamochi; Misaki, Yohji; Takehiko Mori Structural Transitions from Triangular to Square Molecular Arrangements in the Quasi-One-Dimensional Molecular Conductors (DMEDO-TTF)2XF6 (X = P, As, and Sb) Journal of the American Chemical Society, 2012, 134, 13330-13340 |
| 4123090 | CIF | C10 H10 O2 Si | P -1 | 6.799; 17.085; 17.516 68.123; 83.058; 77.859 | 1843.9 | Tani, Yosuke; Fujihara, Tetsuaki; Terao, Jun; Tsuji, Yasushi Copper-Catalyzed Regiodivergent Silacarboxylation of Allenes with Carbon Dioxide and a Silylborane. Journal of the American Chemical Society, 2014, 141212124847001 |
| 4120858 | CIF | C10 H10 O5 | P n a 21 | 7.1097; 11.5996; 12.0357 90; 90; 90 | 992.6 | Shikha Sharma; Trideep Rajale; David B. Cordes; Fernando Hung-Low; David M. Birney Experimental and Computational Studies on the [3,3]- and [3,5]-Sigmatropic Rearrangements of Acetoxycyclohexadienones: A Non-ionic Mechanism for Acyl Migration Journal of the American Chemical Society, 2013, 135, 14438-14447 |
| 4113232 | CIF | C10 H10 P2 | P 1 21/n 1 | 8.484; 12.8058; 9.7203 90; 115.088; 90 | 956.43 | Stephan A. Reiter; Stefan D. Nogai; Konstantin Karaghiosoff; Hubert Schmidbaur Insignificance of P-H...P Hydrogen Bonding: Structural Chemistry of Neutral and Protonated 1,8-Di(phosphinyl)naphthalene Journal of the American Chemical Society, 2004, 126, 15833-15843 |
| 4133980 | CIF | C10 H10 Ru | P n m a | 7.0229; 8.8503; 12.7614 90; 90; 90 | 793.18 | Bear, Joseph C.; Cockcroft, Jeremy K.; Williams, Jeffrey H. Influence of Solvent in Crystal Engineering: A Significant Change to the Order-Disorder Transition in Ferrocene. Journal of the American Chemical Society, 2020, 142, 1731-1734 |
| 4101806 | CIF | C10 H10 S2 Si | C m c 21 | 13.186; 12.994; 6.7057 90; 90; 90 | 1148.9 | Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties Journal of the American Chemical Society, 2010, 132, 1066-1074 |
| 4121125 | CIF | C10 H10 S6 | P 21 21 21 | 9.1424; 11.0497; 13.7839 90; 90; 90 | 1392.46 | Flavia Pop; Pascale Auban-Senzier; Arkadiusz Frąckowiak; Krzysztof Ptaszyński; Iwona Olejniczak; John D. Wallis; Enric Canadell; Narcis Avarvari Chirality Driven Metallic versus Semiconducting Behavior in a Complete Series of Radical Cation Salts Based on Dimethyl-Ethylenedithio-Tetrathiafulvalene (DM-EDT-TTF) Journal of the American Chemical Society, 2013, 135, 17176-17186 |
| 4121126 | CIF | C10 H10 S6 | P 21 21 21 | 9.1575; 11.0492; 13.757 90; 90; 90 | 1392 | Flavia Pop; Pascale Auban-Senzier; Arkadiusz Frąckowiak; Krzysztof Ptaszyński; Iwona Olejniczak; John D. Wallis; Enric Canadell; Narcis Avarvari Chirality Driven Metallic versus Semiconducting Behavior in a Complete Series of Radical Cation Salts Based on Dimethyl-Ethylenedithio-Tetrathiafulvalene (DM-EDT-TTF) Journal of the American Chemical Society, 2013, 135, 17176-17186 |
| 4125298 | CIF | C10 H11 B Cl N | P -1 | 7.635; 9.2691; 14.887 89.64; 79.774; 70.461 | 975.5 | Xu, Senmiao; Zhang, Yuanzhe; Li, Bo; Liu, Shih-Yuan Site-Selective and Stereoselective trans-Hydroboration of 1,3-Enynes Catalyzed by 1,4-Azaborine-Based Phosphine-Pd Complex. Journal of the American Chemical Society, 2016, 138, 14566-14569 |
| 4130946 | CIF | C10 H11 B F3 I O4 | P 1 21/n 1 | 9.655; 8.3949; 16.7646 90; 94.564; 90 | 1354.51 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
| 4133919 | CIF | C10 H11 B F3 K O5 | P c a 21 | 8.0689; 19.1049; 8.649 90; 90; 90 | 1333.29 | Jin, Shengfei; Dang, Hang T.; Haug, Graham C.; He, Ru; Nguyen, Viet D.; Nguyen, Vu T.; Arman, Hadi D.; Schanze, Kirk S.; Larionov, Oleg V. Visible Light-Induced Borylation of C-O, C-N, and C-X Bonds. Journal of the American Chemical Society, 2020, 142, 1603-1613 |
| 4104413 | CIF | C10 H11 B N2 O4 | P 32 | 11.5735; 11.5735; 6.9885 90; 90; 120 | 810.67 | David M. Knapp; Eric P. Gillis; Martin D. Burke A General Solution for Unstable Boronic Acids: Slow-Release Cross-Coupling from Air-Stable MIDA Boronates Journal of the American Chemical Society, 2009, 131, 6961-6963 |
| 4129292 | CIF | C10 H11 Br O2 S | P 1 21 1 | 8.385; 5.7634; 11.4508 90; 104.014; 90 | 536.9 | Lim, Kelvin Meng-Hui; Hayashi, Tamio Rhodium-catalyzed asymmetric arylation of allyl sulfones under the conditions of isomerization into alkenyl sulfones. Journal of the American Chemical Society, 2015, 137, 3201-3204 |
| 4116618 | CIF | C10 H11 Cl N O2 | P 1 21/c 1 | 11.033; 4.936; 18.011 90; 95.055; 90 | 977 | Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates Journal of the American Chemical Society, 1999, 121, 11122-11129 |
| 4131985 | CIF | C10 H11 Cl N O3 S | P 1 21/n 1 | 5.9637; 15.7025; 11.9733 90; 95.124; 90 | 1116.76 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4101500 | CIF | C10 H11 Cl N2 O4 | P 21 21 21 | 5.9181; 7.2067; 28.153 90; 90; 90 | 1200.7 | Lu, Shao-Feng; Du, Da-Ming; Xu, Jiaxi; Zhang, Shi-Wei Asymmetric Michael addition of nitroalkanes to nitroalkenes catalyzed by C2-symmetric tridentate bis(oxazoline) and bis(thiazoline) zinc complexes. Journal of the American Chemical Society, 2006, 128, 7418-7419 |
| 4101499 | CIF | C10 H11 F N2 O4 | P 1 21 1 | 7.5315; 19.034; 8.174 90; 104.27; 90 | 1135.6 | Lu, Shao-Feng; Du, Da-Ming; Xu, Jiaxi; Zhang, Shi-Wei Asymmetric Michael addition of nitroalkanes to nitroalkenes catalyzed by C2-symmetric tridentate bis(oxazoline) and bis(thiazoline) zinc complexes. Journal of the American Chemical Society, 2006, 128, 7418-7419 |
| 4117594 | CIF | C10 H11 N O2 | P 21 21 21 | 6.139; 11.7027; 12.4248 90; 90; 90 | 892.63 | Gregory L. Adams; Patrick J. Carroll; Amos B. Smith Total Synthesis of (+)-Scholarisine A Journal of the American Chemical Society, 2012, 134, 4037-4040 |
| 4126125 | CIF | C10 H11 N O3 | P 1 21/c 1 | 20.0813; 7.5198; 12.1237 90; 91.565; 90 | 1830.09 | Schäfer, Mathias; Peckelsen, Katrin; Paul, Mathias; Martens, Jonathan; Oomens, Jos; Berden, Giel; Berkessel, Albrecht; Meijer, Anthony J. H. M. Hydrogen Tunneling above Room Temperature Evidenced by Infrared Ion Spectroscopy. Journal of the American Chemical Society, 2017, 139, 5779-5786 |
| 4125086 | CIF | C10 H11 N O3 S | P 1 21 1 | 9.1983; 16.7173; 13.7123 90; 90.549; 90 | 2108.5 | Huang, Yuan; Huang, Rui-Zhi; Zhao, Yu Cobalt-Catalyzed Enantioselective Vinylation of Activated Ketones and Imines. Journal of the American Chemical Society, 2016, 138, 6571-6576 |
| 4132098 | CIF | C10 H11 N O4 | P 1 21/c 1 | 10.9576; 20.9044; 8.4845 90; 100.185; 90 | 1912.9 | Discekici, Emre H.; St Amant, Andre H.; Nguyen, Shay N.; Lee, In-Hwan; Hawker, Craig J.; Read de Alaniz, Javier Endo and Exo Diels-Alder Adducts: Temperature-Tunable Building Blocks for Selective Chemical Functionalization. Journal of the American Chemical Society, 2018, 140, 5009-5013 |
| 4108978 | CIF | C10 H11 N O5 | P 21 21 21 | 4.7314; 9.4083; 23.648 90; 90; 90 | 1052.7 | S. S. V. Ramasastry; Haile Zhang; Fujie Tanaka; Carlos F. Barbas Direct Catalytic Asymmetric Synthesis of anti-1,2-Amino Alcohols and syn-1,2-Diols through Organocatalytic anti-Mannich and syn-Aldol Reactions Journal of the American Chemical Society, 2007, 129, 288-289 |
| 4131980 | CIF | C10 H11 N2 O5 S | I 1 2/a 1 | 17.884; 6.712; 19.8456 90; 112.723; 90 | 2197.3 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4100620 | CIF | C10 H11 N3 O3 S | P 1 21/c 1 | 11.64; 6.8189; 15.419 90; 107.106; 90 | 1169.7 | Price, C.P.; Grzesiak, A.L.; Matzger, A.J. Journal of the American Chemical Society, 2005 |
| 4100621 | CIF | C10 H11 N3 O3 S | P 1 21/n 1 | 5.4895; 16.761; 12.422 90; 97.08; 90 | 1134.2 | Price, C.P.; Grzesiak, A.L.; Matzger, A.J. Journal of the American Chemical Society, 2005 |
| 4129772 | CIF | C10 H11 N3 O6 S | P 21 21 21 | 6.383; 8.0212; 22.0071 90; 90; 90 | 1126.75 | Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak Chemical Mutagenesis of an Emissive RNA Alphabet. Journal of the American Chemical Society, 2015, 137, 14602-14605 |
| 4119250 | CIF | C10 H110 K9 N5 O133 Se2 W29 | P -1 | 16.7881; 16.8248; 22.9363 91.583; 109.045; 95.431 | 6084.6 | Jing Gao; Jun Yan; Sebastian Beeg; De-Liang Long; Leroy Cronin One-Pot versus Sequential Reactions in the Self-Assembly of Gigantic Nanoscale Polyoxotungstates Journal of the American Chemical Society, 2013, 135, 1796-1805 |
| 4107306 | CIF | C10 H12 Ag2 N4 | I -4 3 d | 27.2326; 27.2326; 27.2326 90; 90; 90 | 20196.1 | Jie-Peng Zhang; Susumu Kitagawa Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate Journal of the American Chemical Society, 2008, 130, 907-917 |
| 4125543 | CIF | C10 H12 B2 O4 | P 1 21/c 1 | 12.799; 7.758; 10.736 90; 108.119; 90 | 1013.2 | Shoji, Yoshiaki; Ikabata, Yasuhiro; Wang, Qi; Nemoto, Daisuke; Sakamoto, Atsushi; Tanaka, Naoki; Seino, Junji; Nakai, Hiromi; Fukushima, Takanori Unveiling a New Aspect of Simple Arylboronic Esters: Long-Lived Room-Temperature Phosphorescence from Heavy-Atom-Free Molecules. Journal of the American Chemical Society, 2017, 139, 2728-2733 |
| 4115278 | CIF | C10 H12 Br Cl F I | P 1 21/c 1 | 12.4234; 12.3944; 7.8787 90; 90.012; 90 | 1213.17 | Peter R. Schreiner; Andrey A. Fokin; Oliver Lauenstein; Yoshio Okamoto; Tsuneki Wakita; Christopher Rinderspacher; Gregory H. Robinson; Jason K. Vohs; Charles F. Campana Pseudotetrahedral Polyhaloadamantanes as Chirality Probes: Synthesis, Separation, and Absolute Configuration Journal of the American Chemical Society, 2002, 124, 13348-13349 |
| 4114975 | CIF | C10 H12 Br2 O4 | P 1 21/a 1 | 8.3045; 5.5002; 13.84 90; 95.622; 90 | 629.12 | Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions Journal of the American Chemical Society, 2002, 124, 8891-8902 |
| 4116846 | CIF | C10 H12 Cl2 N2 Si | C 1 2/c 1 | 15.4608; 6.166; 14.3313 90; 118.576; 90 | 1199.79 | Karl Hensen; Thorsten Stumpf; Michael Bolte; Christian Näther; Holger Fleischer Experimental Investigations and ab Initio Studies on Hexacoordinated Complexes of Dichlorosilane Journal of the American Chemical Society, 1998, 120, 10402-10408 |
| 4114974 | CIF | C10 H12 Cl2 O4 | P 1 21/a 1 | 8.0986; 5.4164; 13.8414 90; 101.047; 90 | 595.91 | Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions Journal of the American Chemical Society, 2002, 124, 8891-8902 |
| 4126310 | CIF | C10 H12 Cl4 N2 Np O2 | P -1 | 7.7161; 10.2869; 11.274 78.003; 71.909; 75.712 | 815.91 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126314 | CIF | C10 H12 Cl4 N2 O2 Pu | P -1 | 7.7417; 10.3137; 11.2637 77.936; 71.773; 75.432 | 818.42 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4126309 | CIF | C10 H12 Cl4 N2 O2 U | P -1 | 7.732; 10.312; 11.343 78.07; 72.22; 75.6 | 825.7 | Surbella, Robert G.; Ducati, Lucas Colucci; Pellegrini, Kristi L.; McNamara, Bruce K.; Autschbach, Jochen; Schwantes, Jon Michael; Cahill, Christopher L. Transuranic Hybrid Materials: Crystallographic and Computational Metrics of Supramolecular Assembly. Journal of the American Chemical Society, 2017 |
| 4119558 | CIF | C10 H12 Co D4 K N8 | P 4/m n c | 8.2371; 8.2371; 11.6 90; 90; 90 | 787.1 | Wen Zhang; Heng-Yun Ye; Robert Graf; Hans W. Spiess; Ye-Feng Yao; Run-Qiang Zhu; Ren-Gen Xiong Tunable and Switchable Dielectric Constant in an Amphidynamic Crystal Journal of the American Chemical Society, 2013, 135, 5230-5233 |
| 4119559 | CIF | C10 H12 Co D4 K N8 | P 4/m n c | 8.277; 8.277; 11.622 90; 90; 90 | 796.2 | Wen Zhang; Heng-Yun Ye; Robert Graf; Hans W. Spiess; Ye-Feng Yao; Run-Qiang Zhu; Ren-Gen Xiong Tunable and Switchable Dielectric Constant in an Amphidynamic Crystal Journal of the American Chemical Society, 2013, 135, 5230-5233 |
| 4134679 | CIF | C10 H12 Cu F6 Hf N2 O2 | P 1 2/n 1 | 6.259; 9.2167; 12.2518 90; 90.846; 90 | 706.7 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
| 4131997 | CIF | C10 H12 Cu F6 N10 O Si | C 1 2/c 1 | 16.3598; 11.2335; 21.3117 90; 91.676; 90 | 3914.9 | Bao, Zongbi; Xie, Danyan; Chang, Ganggang; Wu, Hui; Li, Liangying; Zhou, Wei; Wang, Hailong; Zhang, Zhiguo; Xing, Huabin; Yang, Qiwei; Zaworotko, Michael J.; Ren, Qilong; Chen, Banglin Fine Tuning and Specific Binding Sites with a Porous Hydrogen-Bonded Metal-Complex Framework for Gas Selective Separations. Journal of the American Chemical Society, 2018, 140, 4596-4603 |
| 4134681 | CIF | C10 H12 Cu F6 N2 O2 Ti | P n m a | 7.727; 14.3219; 12.3521 90; 90; 90 | 1366.95 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
| 4107309 | CIF | C10 H12 Cu2 N4 | I -4 3 d | 26.407; 26.407; 26.407 90; 90; 90 | 18414 | Jie-Peng Zhang; Susumu Kitagawa Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate Journal of the American Chemical Society, 2008, 130, 907-917 |
| 4112972 | CIF | C10 H12 Fe O4 P Zn0.5 | P c c n | 9.695; 26.7; 8.864 90; 90; 90 | 2294.5 | Olivier Oms; Jean Le Bideau; Fabrice Leroux; Arie van der Lee; Dominique Leclercq; André Vioux Mixed 1D-2D Inorganic Polymeric Zinc Ferrocenylphosphonate: Crystal Structure and Electrochemical Study Journal of the American Chemical Society, 2004, 126, 12090-12096 |
| 1100464 | CIF | C10 H12 I N3 | C 1 2/c 1 | 26.993; 5.599; 15.917 90; 105.44; 90 | 2318.78 | Boche, Gernot; Andrews, Phil; Harms, Klaus; Marsch, Michael; Rangappa, Kanchugarakoppal S.; Schimeczek, Michael; Willeke, Christoph Crystal and Electronic Structure of Stable Nitrenium Ions. A Comparison with Structurally Related Carbenes Journal of the American Chemical Society, 1996, 118, 4925-4930 |
| 4116617 | CIF | C10 H12 N O2 | P 1 21/a 1 | 10.98; 4.862; 17.72 90; 97.93; 90 | 936.9 | Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates Journal of the American Chemical Society, 1999, 121, 11122-11129 |
| 4131979 | CIF | C10 H12 N O3 S | P 1 21/n 1 | 8.8901; 7.0512; 16.8721 90; 95.229; 90 | 1053.24 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131978 | CIF | C10 H12 N O4 S | P 1 21/c 1 | 8.124; 5.7011; 23.0661 90; 93.074; 90 | 1066.79 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4128674 | CIF | C10 H12 N2 O | P 1 21 1 | 6.1799; 8.3702; 9.1069 90; 106.537; 90 | 451.59 | Zhu, Jie S.; Li, Clarabella J.; Tsui, Ka Yi; Kraemer, Niklas; Son, Jung-Ho; Haddadin, Makhluf J.; Tantillo, Dean J.; Kurth, Mark J. Accessing Multiple Classes of 2 H-Indazoles: Mechanistic Implications for the Cadogan and Davis-Beirut Reactions. Journal of the American Chemical Society, 2019, 141, 6247-6253 |
| 4115164 | CIF | C10 H12 N2 O2 | P -1 | 9.234; 9.254; 12.706 73.199; 76.044; 70.494 | 967.1 | Alexander A. Tishkov; Alexander D. Dilman; Valery I. Faustov; Arsenij A. Birukov; Konstantin S. Lysenko; Paul A. Belyakov; Sema L. Ioffe; Yury A. Strelenko; Michael Yu. Antipin Structure and Stereodynamics of N,N-Bis(silyloxy)enamines Journal of the American Chemical Society, 2002, 124, 11358-11367 |
| 4120316 | CIF | C10 H12 N2 O2 | P 1 21/c 1 | 7.6315; 12.0996; 10.2473 90; 97.95; 90 | 937.1 | Subash Chandra Sahoo; Manas K. Panda; Naba K. Nath; Panče Naumov Biomimetic Crystalline Actuators: Structure-Kinematic Aspects of the Self-Actuation and Motility of Thermosalient Crystals Journal of the American Chemical Society, 2013, 135, 12241-12251 |
| 4127699 | CIF | C10 H12 N2 O5 | P -1 | 7.9812; 12.549; 12.711 63.35; 73.51; 83.41 | 1090.9 | Lengyel, Jeff; Wang, Xiaoping; Choi, Eun Sang; Besara, Tiglet; Schönemann, Rico; Ramakrishna, Sanath Kumar; Holleman, Jade; Blockmon, Avery L.; Hughey, Kendall D.; Liu, Tianhan; Hudis, Jacob; Beery, Drake; Balicas, Luis; McGill, Stephen A.; Hanson, Kenneth; Musfeldt, Janice L.; Siegrist, Theo; Dalal, Naresh S.; Shatruk, Michael Antiferroelectric Phase Transition in a Proton-Transfer Salt of Squaric Acid and 2,3-Dimethylpyrazine. Journal of the American Chemical Society, 2019, 141, 16279-16287 |
| 4127700 | CIF | C10 H12 N2 O5 | P -1 | 6.721; 7.967; 10.75 76.398; 89.55; 80.515 | 551.5 | Lengyel, Jeff; Wang, Xiaoping; Choi, Eun Sang; Besara, Tiglet; Schönemann, Rico; Ramakrishna, Sanath Kumar; Holleman, Jade; Blockmon, Avery L.; Hughey, Kendall D.; Liu, Tianhan; Hudis, Jacob; Beery, Drake; Balicas, Luis; McGill, Stephen A.; Hanson, Kenneth; Musfeldt, Janice L.; Siegrist, Theo; Dalal, Naresh S.; Shatruk, Michael Antiferroelectric Phase Transition in a Proton-Transfer Salt of Squaric Acid and 2,3-Dimethylpyrazine. Journal of the American Chemical Society, 2019, 141, 16279-16287 |
| 4132369 | CIF | C10 H12 N4 O2 | P 1 21/c 1 | 9.8903; 4.6929; 11.8569 90; 96.707; 90 | 546.56 | Liu, Guofeng; Sheng, Jianhui; Wu, Hongwei; Yang, Chaolong; Yang, Guangbao; Li, Yongxin; Ganguly, Rakesh; Zhu, Liangliang; Zhao, Yanli Controlling Supramolecular Chirality of Two-Component Hydrogels by J- and H-Aggregation of Building Blocks. Journal of the American Chemical Society, 2018, 140, 6467-6473 |
| 4131460 | CIF | C10 H12 N4 Pd | P 1 21/c 1 | 9.9648; 34.1529; 13.0537 90; 106.465; 90 | 4260.35 | Goudy, Violaine; Jaoul, Arnaud; Cordier, Marie; Clavaguéra, Carine; Nocton, Grégory Tuning the Stability of Pd(IV) Intermediates Using a Redox Non-innocent Ligand Combined with an Organolanthanide Fragment. Journal of the American Chemical Society, 2017, 139, 10633-10636 |
| 4105799 | CIF | C10 H12 N6 O3 | P 1 21/n 1 | 9.9777; 20.156; 11.0109 90; 92.311; 90 | 2212.6 | Powner, Matthew W.; Sutherland, John D.; Szostak, Jack W. Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water Journal of the American Chemical Society, 2011, 133, 4149-4150 |
| 4112258 | CIF | C10 H12 O4 | I b a 2 | 13.483; 21.392; 6.8956 90; 90; 90 | 1988.9 | Shinji Nomura; Takahito Itoh; Hirofumi Nakasho; Takahiro Uno; Masataka Kubo; Kazuki Sada; Katsunari Inoue; Mikiji Miyata Crystal Structures and Topochemical Polymerizations of 7,7,8,8-Tetrakis(alkoxycarbonyl)quinodimethanes Journal of the American Chemical Society, 2004, 126, 2035-2041 |
| 4113696 | CIF | C10 H12 O4 | P -1 | 5.976; 7.55; 11.552 96.3; 90.03; 105.77 | 498.3 | F. Albert Cotton; James P. Donahue; Carlos A. Murillo Polyunsaturated Dicarboxylate Tethers Connecting Dimolybdenum Redox and Chromophoric Centers: Syntheses, Structures, and Electrochemistry Journal of the American Chemical Society, 2003, 125, 5436-5450 |
| 4127501 | CIF | C10 H12 O4 | P -1 | 7.7553; 8.2119; 8.3575 77.75; 69.61; 66.847 | 456.97 | Fan, Jie; Liao, Ge; Kindinger, Florian; Ludwig-Radtke, Lena; Yin, Wen-Bing; Li, Shu-Ming Peniphenone and Penilactone Formation in Penicillium crustosum via 1,4-Michael Additions of ortho-Quinone Methide from Hydroxyclavatol to γ-Butyrolactones from Crustosic Acid. Journal of the American Chemical Society, 2019, 141, 4225-4229 |
| 4104584 | CIF | C10 H13 Br O2 | P 1 21 1 | 6.2315; 8.0843; 10.0707 90; 92.451; 90 | 506.87 | Sang Young Yun; Jun-Cheng Zheng; Daesung Lee Stereoelectronic Effect for the Selectivity in C-H Insertion of Alkylidene Carbenes and Its Application to the Synthesis of Platensimycin Journal of the American Chemical Society, 2009, 131, 8413-8415 |
| 4105800 | CIF | C10 H13 Cl N6 O3 | P -1 | 7.0578; 7.96; 12.8899 72.221; 77.298; 65.396 | 623.35 | Powner, Matthew W.; Sutherland, John D.; Szostak, Jack W. Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water Journal of the American Chemical Society, 2011, 133, 4149-4150 |
| 4121746 | CIF | C10 H13 Cl2 N O | P 1 c 1 | 9.4966; 10.2364; 12.0587 90; 104.097; 90 | 1136.94 | Rodriguez, Rodrigo A.; Pan, Chung-Mao; Yabe, Yuki; Kawamata, Yu; Eastgate, Martin D.; Baran, Phil S. Palau'chlor: A Practical and Reactive Chlorinating Reagent. Journal of the American Chemical Society, 2014, 136, 6908-6911 |
| 4110131 | CIF | C10 H13 Cr Mn N8 | P 1 21/c 1 | 7.85; 14.31; 12.97 90; 90.1; 90 | 1457 | Wakako Kaneko; Masaaki Ohba; Susumu Kitagawa A Flexible Coordination Polymer Crystal Providing Reversible Structural and Magnetic Conversions Journal of the American Chemical Society, 2007, 129, 13706-13712 |
| 4132012 | CIF | C10 H13 F12 N O3 | P -1 | 9.5076; 9.6913; 9.753 103.771; 91.642; 113.628 | 791.84 | Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353 |
| 4122587 | CIF | C10 H13 Fe2 O5 P S2 | P -1 | 8.4937; 9.4901; 11.7656 101.03; 104.003; 113.074 | 801.9 | Jablonskytė, Aušra; Webster, Lee R.; Simmons, Trevor R.; Wright, Joseph A.; Pickett, Christopher J. Electronic control of the protonation rates of Fe-Fe bonds. Journal of the American Chemical Society, 2014, 136, 13038-13044 |
| 4125020 | CIF | C10 H13 I N6 O3 | P 1 21 1 | 4.5885; 10.0115; 16.2053 90; 90.413; 90 | 744.42 | Piotrowski, David W.; Kamlet, Adam S.; Dechert-Schmitt, Anne-Marie R; Yan, Jiangli; Brandt, Thomas A.; Xiao, Jun; Wei, Liuqing; Barrila, Mark T. Regio- and Enantioselective Synthesis of Azole Hemiaminal Esters by Lewis Base Catalyzed Dynamic Kinetic Resolution. Journal of the American Chemical Society, 2016, 138, 4818-4823 |
| 4133545 | CIF | C10 H13 N O S | P 1 21 1 | 6.45; 10.41727; 14.8501 90; 99.2411; 90 | 984.85 | Verbraeken, Bart; Hullaert, Jan; van Guyse, Joachim; Van Hecke, Kristof; Winne, Johan; Hoogenboom, Richard The Elusive Seven-Membered Cyclic Imino Ether Tetrahydrooxazepine. Journal of the American Chemical Society, 2018, 140, 17404-17408 |
| 4117747 | CIF | C10 H13 N O2 | P 1 21/c 1 | 10.308; 6.921; 13.374 90; 105.34; 90 | 920.1 | Francis Beaumier; Marianne Dupuis; Claude Spino; Claude Y. Legault Formal Intramolecular (4 + 1)-Cycloaddition of Dialkoxycarbenes: Control of the Stereoselectivity and a Mechanistic Portrait Journal of the American Chemical Society, 2012, 134, 5938-5953 |
| 4122847 | CIF | C10 H13 N3 | P b c a | 7.7043; 15.9073; 15.9426 90; 90; 90 | 1953.8 | Longstreet, Ashley R.; Jo, Minyoung; Chandler, Rebecca R.; Hanson, Kenneth; Zhan, Naiqian; Hrudka, Jeremy J.; Mattoussi, Hedi; Shatruk, Michael; McQuade, D. Tyler Ylidenemalononitrile enamines as fluorescent "turn-on" indicators for primary amines. Journal of the American Chemical Society, 2014, 136, 15493-15496 |
| 4129773 | CIF | C10 H13 N4 O5.5 S | P 1 | 4.8777; 7.7049; 17.0972 81.369; 82.83; 72.019 | 602.14 | Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak Chemical Mutagenesis of an Emissive RNA Alphabet. Journal of the American Chemical Society, 2015, 137, 14602-14605 |
| 4118525 | CIF | C10 H13 N6 O S | P 1 21/n 1 | 8.8428; 17.383; 16.123 90; 90.286; 90 | 2478.3 | Powner, Matthew W.; Zheng, Shao-Liang; Szostak, Jack W. Multicomponent Assembly of Proposed DNA Precursors in Water Journal of the American Chemical Society, 2012, 134, 13889-13895 |
| 4120325 | CIF | C10 H14 B10 F4 | P c a 21 | 21.924; 7.5397; 9.2002 90; 90; 90 | 1520.8 | Zaozao Qiu; Yangjian Quan; Zuowei Xie Palladium-Catalyzed Selective Fluorination of o-Carboranes Journal of the American Chemical Society, 2013, 135, 12192-12195 |
| 4120327 | CIF | C10 H14 B10 F4 | P 21 21 21 | 7.1817; 8.6876; 24.463 90; 90; 90 | 1526.3 | Zaozao Qiu; Yangjian Quan; Zuowei Xie Palladium-Catalyzed Selective Fluorination of o-Carboranes Journal of the American Chemical Society, 2013, 135, 12192-12195 |
| 4103344 | CIF | C10 H14 Br N O3 | P 1 21/c 1 | 8.7129; 10.4699; 12.4154 90; 92.979; 90 | 1131 | Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution Journal of the American Chemical Society, 2010, 132, 14780-14789 |
| 4116018 | CIF | C10 H14 Cl3 N O Pt S | P -1 | 7.1808; 8.317; 12.725 93.87; 98.78; 105.75 | 718.11 | Larissa Alexandrova; Oleg G. D'yachenko; Grigory M. Kazankov; Vladimir A. Polyakov; Pavel V. Samuleev; Enrique Sansores; Alexander D. Ryabov Mechanism of Biologically Relevant Deoxygenation of Dimethyl Sulfoxide Coupled with Pt(II) to Pt(IV) Oxidation of Orthoplatinated Oximes. Synthetic, Kinetic, Electrochemical, X-ray Structural, and Density Functional Study Journal of the American Chemical Society, 2000, 122, 5189-5200 |
| 4107214 | CIF | C10 H14 Cu O6 P2 | C 1 2/c 1 | 18.566; 7.7903; 9.7596 90; 90.748; 90 | 1411.5 | Simon S. Iremonger; Junmei Liang; Ramanathan Vaidhyanathan; Isaac Martens; George K. H. Shimizu; Thomas D. Daff; Mohammad Zein Aghaji; Saeid Yeganegi; Tom K. Woo Phosphonate Monoesters as Carboxylate-like Linkers for Metal Organic Frameworks Journal of the American Chemical Society, 2011, 133, 20048-20051 |
| 4128139 | CIF | C10 H14 Fe N4 | P 31 2 1 | 8.4206; 8.4206; 13.1696 90; 90; 120 | 808.7 | López-Cabrelles, Javier; Romero, Jorge; Abellán, Gonzalo; Giménez-Marqués, Mónica; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Mínguez Espallargas, Guillermo Solvent-Free Synthesis of ZIFs: A Route toward the Elusive Fe(II) Analogue of ZIF-8. Journal of the American Chemical Society, 2019, 141, 7173-7180 |
| 4101903 | CIF | C10 H14 I N O3 | P 1 21/c 1 | 11.536; 6.2833; 16.804 90; 104.543; 90 | 1179 | Xinqiang Fang; Kun Liu; Chaozhong Li Efficient Regio- and Stereoselective Formation of Azocan-2-ones via 8-EndoCyclization of α-Carbamoyl Radicals Journal of the American Chemical Society, 2010, 132, 2274-2283 |
| 4101904 | CIF | C10 H14 I N O3 | P -1 | 6.84; 7.013; 13.178 79.04; 89.21; 73.583 | 594.8 | Xinqiang Fang; Kun Liu; Chaozhong Li Efficient Regio- and Stereoselective Formation of Azocan-2-ones via 8-EndoCyclization of α-Carbamoyl Radicals Journal of the American Chemical Society, 2010, 132, 2274-2283 |
| 4115505 | CIF | C10 H14 N3 O3 S | P -1 | 7.2609; 7.4075; 13.1537 89.189; 77.186; 62.193 | 606.91 | K. Travis Holman; Stephen M. Martin; Daniel P. Parker; Michael D. Ward The Generality of Architectural Isomerism in Designer Inclusion Frameworks Journal of the American Chemical Society, 2001, 123, 4421-4431 |
| 4126893 | CIF | C10 H14 N4 O4 Zn | I -4 3 m | 17.2458; 17.2458; 17.2458 90; 90; 90 | 5129.2 | Hobday, Claire L.; Bennett, Thomas D.; Fairen-Jimenez, David; Graham, Alexander J.; Morrison, Carole A.; Allan, David R.; Düren, Tina; Moggach, Stephen A. Tuning the Swing Effect by Chemical Functionalization of Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017 |
| 4129771 | CIF | C10 H14 N4 O5 S | P 1 21 1 | 4.8225; 8.003; 15.9946 90; 97.432; 90 | 612.12 | Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak Chemical Mutagenesis of an Emissive RNA Alphabet. Journal of the American Chemical Society, 2015, 137, 14602-14605 |
| 4129774 | CIF | C10 H14 N4 O6 S | P 21 21 21 | 6.9429; 11.0987; 16.3128 90; 90; 90 | 1257.02 | Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak Chemical Mutagenesis of an Emissive RNA Alphabet. Journal of the American Chemical Society, 2015, 137, 14602-14605 |
| 4103570 | CIF | C10 H14 N6 O3 | P 1 21/n 1 | 4.576; 13.064; 20.128 90; 90.429; 90 | 1203.2 | Matthew W. Powner; John D. Sutherland; Jack W. Szostak Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water Journal of the American Chemical Society, 2010, 132, 16677-16688 |
| 4103571 | CIF | C10 H14 N6 O4 | P 21 21 21 | 7.749; 11.1967; 14.0827 90; 90; 90 | 1221.86 | Matthew W. Powner; John D. Sutherland; Jack W. Szostak Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water Journal of the American Chemical Society, 2010, 132, 16677-16688 |
| 4103572 | CIF | C10 H14 N6 O4 | P 1 21/n 1 | 4.4783; 18.704; 14.171 90; 98.611; 90 | 1173.6 | Matthew W. Powner; John D. Sutherland; Jack W. Szostak Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water Journal of the American Chemical Society, 2010, 132, 16677-16688 |
| 4115923 | CIF | C10 H14 N8 O6 Pt | P -1 | 8.878; 10.223; 10.313 62.44; 77.18; 69.93 | 777.2 | Ralf-Dieter Schnebeck; Eva Freisinger; Frank Glahé; Bernhard Lippert Molecular Architecture Based on Metal Triangles Derived from 2,2'-Bipyrazine (Bpz) and EnMII (M = Pt, Pd) Journal of the American Chemical Society, 2000, 122, 1381-1390 |
| 4101953 | CIF | C10 H14 O | R -3 :H | 21.9236; 21.9236; 10.0361 90; 90; 120 | 4177.53 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101954 | CIF | C10 H14 O | R -3 :H | 20.0129; 20.0129; 11.9485 90; 90; 120 | 4144.42 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101955 | CIF | C10 H14 O | R -3 :H | 14.6614; 14.6614; 22.7128 90; 90; 120 | 4228.17 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101956 | CIF | C10 H14 O | R -3 :H | 21.1499; 21.1499; 10.9707 90; 90; 120 | 4249.93 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101957 | CIF | C10 H14 O | P 1 21/c 1 | 8.3762; 5.1455; 21.9095 90; 109.281; 90 | 891.327 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101958 | CIF | C10 H14 O | R -3 :H | 23.4015; 23.4015; 9.2166 90; 90; 120 | 4371.08 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101959 | CIF | C10 H14 O | P 1 21/n 1 | 17.1461; 5.0284; 11.0202 90; 109.469; 90 | 895.808 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101960 | CIF | C10 H14 O | P 21 21 21 | 4.5362; 12.2286; 16.2915 90; 90; 90 | 903.712 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101961 | CIF | C10 H14 O | R -3 :H | 22.7159; 22.7159; 9.2069 90; 90; 120 | 4114.38 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101962 | CIF | C10 H14 O | P 21 21 21 | 23.2015; 8.6198; 4.5444 90; 90; 90 | 908.845 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101963 | CIF | C10 H14 O | P 21 21 21 | 12.1203; 16.1584; 4.6365 90; 90; 90 | 908.034 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101964 | CIF | C10 H14 O | C 1 2/c 1 | 17.8291; 4.5894; 24.0942 90; 69.6837; 90 | 1848.86 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101965 | CIF | C10 H14 O | P 1 21/a 1 | 17.1957; 4.6403; 12.03 90; 109.939; 90 | 902.369 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101966 | CIF | C10 H14 O | I 1 2/a 1 | 22.8234; 4.7105; 17.6462 90; 73.2208; 90 | 1816.36 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101967 | CIF | C10 H14 O | C 1 2/c 1 | 26.4489; 4.6486; 16.7492 90; 116.586; 90 | 1841.57 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101968 | CIF | C10 H14 O | P 1 21/a 1 | 19.9525; 4.5351; 11.0565 90; 68.2256; 90 | 929.083 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101969 | CIF | C10 H14 O | I 1 2/a 1 | 24.2387; 4.6525; 18.1098 90; 115.793; 90 | 1838.79 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101970 | CIF | C10 H14 O | C 1 2/c 1 | 24.4512; 4.6442; 16.7109 90; 105.874; 90 | 1825.26 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4101971 | CIF | C10 H14 O | P 1 21/n 1 | 12.5972; 4.7007; 16.3407 90; 109.644; 90 | 911.31 | Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy Journal of the American Chemical Society, 2010, 132, 2564-2566 |
| 4123577 | CIF | C10 H14 O2 | P 1 21 1 | 7.2838; 7.068; 8.6698 90; 100.133; 90 | 439.38 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4127758 | CIF | C10 H14 O3 | P 1 21 1 | 6.9327; 7.3133; 8.9299 90; 95.124; 90 | 450.94 | Tan, Yun-Xuan; Zhang, Fang; Xie, Pei-Pei; Zhang, Shuo-Qing; Wang, Yi-Fan; Li, Qing-Hua; Tian, Ping; Hong, Xin; Lin, Guo-Qiang Rhodium(III)-Catalyzed Asymmetric Borylative Cyclization of Cyclohexadienone-Containing 1,6-Dienes: An Experimental and DFT Study. Journal of the American Chemical Society, 2019, 141, 12770-12779 |
| 4127342 | CIF | C10 H14 O4 | C 1 2/c 1 | 21.1666; 7.7501; 12.954 90; 108.914; 90 | 2010.28 | Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society, 2019, 141, 8372-8380 |
| 4130770 | CIF | C10 H14 O4 | P 1 21/c 1 | 5.9569; 10.5931; 15.0785 90; 91.0247; 90 | 951.33 | Davis, Dexter C.; Walker, Katherine L.; Hu, Chunhua; Zare, Richard N.; Waymouth, Robert M.; Dai, Mingji Catalytic Carbonylative Spirolactonization of Hydroxycyclopropanols. Journal of the American Chemical Society, 2016, 138, 10693-10699 |
| 4125096 | CIF | C10 H14 O5 | P 1 21/c 1 | 3.9342; 27.324; 9.9305 90; 96.314; 90 | 1061 | Li, Gang; Kuo, Jonathan L.; Han, Arthur; Abuyuan, Janine M.; Young, Lily C.; Norton, Jack R.; Palmer, Joshua H. Radical Isomerization and Cycloisomerization Initiated by H• Transfer. Journal of the American Chemical Society, 2016, 138, 7698-7704 |
| 4104384 | CIF | C10 H15 B Cl N Zr | P 1 21/c 1 | 8.1; 10.792; 15.087 90; 119.12; 90 | 1152.14 | Taryn D. Forster; Heikki M. Tuononen; Masood Parvez; Roland Roesler Characterization of β-B-Agostic Isomers in Zirconocene Amidoborane Complexes Journal of the American Chemical Society, 2009, 131, 6689-6691 |
| 4108297 | CIF | C10 H15 B Cl2 F4 Fe2 N O5 P S2 | P -1 | 10.523; 14.085; 15.516 97.095; 101.417; 90.182 | 2236.1 | Matthew T. Olsen; Maurizio Bruschi; Luca De Gioia; Thomas B. Rauchfuss; Scott R. Wilson Nitrosyl Derivatives of Diiron(I) Dithiolates Mimic the Structure and Lewis Acidity of the [FeFe]-Hydrogenase Active Site Journal of the American Chemical Society, 2008, 130, 12021-12030 |
| 4126568 | CIF | C10 H15 B F3 N | P 1 21/n 1 | 7.546; 12.6; 11.855 90; 105.288; 90 | 1087.3 | Légaré Lavergne, Julien; Jayaraman, Arumugam; Misal-Castro, Luis C; Rochette, Etienne; Fontaine, Frédéric-Georges Metal-Free Borylation of Heteroarenes using Ambiphilic Aminoboranes: On the Importance of Sterics in Frustrated Lewis Pair C-H Bond Activation. Journal of the American Chemical Society, 2017 |
| 4126078 | CIF | C10 H15 B10 N O2 | P 1 21/n 1 | 11.5496; 6.8211; 18.6932 90; 94.936; 90 | 1467.21 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4126079 | CIF | C10 H15 B10 N O2 | P 1 21/c 1 | 7.0828; 7.5414; 27.6234 90; 96.54; 90 | 1465.88 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4126080 | CIF | C10 H15 B10 N O2 | P 1 21/n 1 | 6.8825; 34.5844; 12.4876 90; 93.418; 90 | 2967.1 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4114677 | CIF | C10 H15 Cl2 Cr O | P -1 | 6.3902; 8.5992; 11.0202 85.291; 86.502; 89.568 | 602.4 | James S. Hess; Somying Leelasubcharoen; Arnold L. Rheingold; Douglas J. Doren; Klaus H. Theopold Spin Surface Crossing in Chromium-Mediated Olefin Epoxidation with O2 Journal of the American Chemical Society, 2002, 124, 2454-2455 |
| 4119855 | CIF | C10 H15 F3 O5 S | P 1 21/c 1 | 8.9055; 9.8677; 14.8112 90; 107.445; 90 | 1241.7 | Gorkem Gunbas; William L. Sheppard; James C. Fettinger; Marilyn M. Olmstead; Mark Mascal Extreme Oxatriquinanes: Structural Characterization of α-Oxyoxonium Species with Extraordinarily Long Carbon-Oxygen Bonds Journal of the American Chemical Society, 2013, 135, 8173-8176 |
| 4123249 | CIF | C10 H15 N O | P n m a | 12.744; 6.6351; 10.4218 90; 90; 90 | 881.2 | Komarov, Igor V.; Yanik, Stanislav; Ishchenko, Aleksandr Yu; Davies, John E.; Goodman, Jonathan M.; Kirby, Anthony J. The Most Reactive Amide As a Transition-State Mimic For cis-trans Interconversion. Journal of the American Chemical Society, 2015, 137, 926-930 |
| 4102644 | CIF | C10 H15 N O2 | P -1 | 6.8952; 8.7695; 8.9826 69.553; 72.897; 80.674 | 485.36 | Gardner S. Creech; Ohyun Kwon Tandem 6π-Electrocyclization and Cycloaddition of Nitrodienes to Yield Multicyclic Nitroso Acetals Journal of the American Chemical Society, 2010, 132, 8876-8877 |
| 4113959 | CIF | C10 H15 N O2 S2 | P 21 21 21 | 5.286; 7.6575; 29.617 90; 90; 90 | 1198.8 | David A. Evans; C. Wade Downey; Jed L. Hubbs Ni(II) Bis(oxazoline)-Catalyzed Enantioselective Syn Aldol Reactions of N-Propionylthiazolidinethiones in the Presence of Silyl Triflates Journal of the American Chemical Society, 2003, 125, 8706-8707 |
| 4125729 | CIF | C10 H15 N O3 | P 21 21 21 | 6.7401; 11.1362; 13.6362 90; 90; 90 | 1023.52 | Smalley, Adam P.; Cuthbertson, James D.; Gaunt, Matthew J. Palladium-Catalyzed Enantioselective C-H Activation of Aliphatic Amines Using Chiral Anionic BINOL-Phosphoric Acid Ligands. Journal of the American Chemical Society, 2017, 139, 1412-1415 |
| 4129039 | CIF | C10 H15 N O3 S | P 1 21 1 | 9.491; 6.116; 9.9296 90; 101.54; 90 | 564.73 | Yuan, Jingsong; Xiong, Wei; Zhou, Xuhao; Zhang, Yi; Shi, Dong; Li, Zichen; Lu, Hua 4-Hydroxyproline-Derived Sustainable Polythioesters: Controlled Ring-Opening Polymerization, Complete Recyclability, and Facile Functionalization. Journal of the American Chemical Society, 2019, 141, 4928-4935 |
| 4118012 | CIF | C10 H15 N O6 | P 1 21 1 | 7.8901; 11.4722; 12.9352 90; 91.536; 90 | 1170.43 | Kyle L. Kimmel; Jimmie D. Weaver; Melissa Lee; Jonathan A. Ellman Catalytic Enantioselective Protonation of Nitronates Utilizing an Organocatalyst Chiral Only at Sulfur Journal of the American Chemical Society, 2012, 134, 9058-9061 |
| 4121755 | CIF | C10 H16 B Cl N2 O2 | P -1 | 7.6158; 8.4994; 10.1588 75.01; 78.014; 73.334 | 602.15 | Rodriguez, Rodrigo A.; Pan, Chung-Mao; Yabe, Yuki; Kawamata, Yu; Eastgate, Martin D.; Baran, Phil S. Palau'chlor: A Practical and Reactive Chlorinating Reagent. Journal of the American Chemical Society, 2014, 136, 6908-6911 |
| 4104383 | CIF | C10 H16 B N Zr | P 1 21/c 1 | 7.984; 14.837; 10.305 90; 117.83; 90 | 1079.52 | Taryn D. Forster; Heikki M. Tuononen; Masood Parvez; Roland Roesler Characterization of β-B-Agostic Isomers in Zirconocene Amidoborane Complexes Journal of the American Chemical Society, 2009, 131, 6689-6691 |
| 4121847 | CIF | C10 H16 B10 | P 1 21/c 1 | 24.5147; 7.0276; 17.2539 90; 110.603; 90 | 2782.4 | Quan, Yangjian; Qiu, Zaozao; Xie, Zuowei Transition-Metal-Mediated Three-Component Cascade Cyclization: Selective Cage B-C(sp(2)) Coupling of Carborane with Aromatics and Synthesis of Carborane-Fused Tricyclics. Journal of the American Chemical Society, 2014, 136, 7599-7602 |
| 4127707 | CIF | C10 H16 B10 F N O | C 1 2/c 1 | 33.7489; 13.4301; 24.9712 90; 116.232; 90 | 10152.6 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Catalytic Cascade Dehydrogenative Cross-Coupling of BH/CH and BH/NH: One-Pot Process to Carborano-Isoquinolinone. Journal of the American Chemical Society, 2019, 141, 12855-12862 |
| 4134949 | CIF | C10 H16 Br N O2 | P 21 21 21 | 5.9297; 9.0915; 19.9795 90; 90; 90 | 1077.09 | Lin, You-Chen; Ribaucourt, Aubert; Moazami, Yasamin; Pierce, Joshua G. Concise Synthesis and Antimicrobial Evaluation of the Guanidinium Alkaloid Batzelladine D: Development of a Stereodivergent Strategy. Journal of the American Chemical Society, 2020, 142, 9850-9857 |
| 4111146 | CIF | C10 H16 Cl N O2 S | P 21 21 21 | 6.8389; 8.3595; 21.712 90; 90; 90 | 1241.27 | Claudio Palomo; Mikel Oiarbide; Rosa López; Pedro B. González; Enrique Gómez-Bengoa; José M. Saá; Anthony Linden Intramolecular Sulfur Transfer in N-Enoyl Oxazolidine-2-thiones Promoted by Brønsted Acids. Practical Asymmetric Synthesis of β-Mercapto Carboxylic Acids and Mechanistic Insights Journal of the American Chemical Society, 2006, 128, 15236-15247 |
| 4131928 | CIF | C10 H16 Cl2 Cu N16 O6 | C 1 2/c 1 | 14.6638; 8.9883; 16.3538 90; 90.324; 90 | 2155.44 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131929 | CIF | C10 H16 Cl2 Cu N16 O6 | P -1 | 6.7837; 8.182; 10.1959 108.068; 101.188; 90.137 | 526.6 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4119556 | CIF | C10 H16 Co K N8 | P 4/m n c | 8.242; 8.242; 11.584 90; 90; 90 | 786.9 | Wen Zhang; Heng-Yun Ye; Robert Graf; Hans W. Spiess; Ye-Feng Yao; Run-Qiang Zhu; Ren-Gen Xiong Tunable and Switchable Dielectric Constant in an Amphidynamic Crystal Journal of the American Chemical Society, 2013, 135, 5230-5233 |
| 4119557 | CIF | C10 H16 Co K N8 | P 4/m n c | 8.2895; 8.2895; 11.621 90; 90; 90 | 798.5 | Wen Zhang; Heng-Yun Ye; Robert Graf; Hans W. Spiess; Ye-Feng Yao; Run-Qiang Zhu; Ren-Gen Xiong Tunable and Switchable Dielectric Constant in an Amphidynamic Crystal Journal of the American Chemical Society, 2013, 135, 5230-5233 |
| 4128539 | CIF | C10 H16 Fe2 N S4 | I 41/a :2 | 17.1853; 17.1853; 20.4819 90; 90; 90 | 6049.01 | Horwitz, Noah E.; Xie, Jiaze; Filatov, Alexander S.; Papoular, Robert J.; Shepard, William E.; Zee, David Z.; Grahn, Mia P.; Gilder, Chloe; Anderson, John S. Redox-Active 1D Coordination Polymers of Iron-Sulfur Clusters. Journal of the American Chemical Society, 2019, 141, 3940-3951 |
| 1100296 | CIF | C10 H16 Li N O | P 1 21/c 1 | 11.493; 9.567; 19.636 90; 93.18; 90 | 2155.72 | Boche, Gernot; Harms, Klaus; Marsch, Michael X-ray structure determination of [1-cyano-2,.2-dimtheylcyclopropyllithium·tetrahydrofuran]~∞~: a tetrahedral anionic α-cyano carbon atom Journal of the American Chemical Society, 1988, 110, 6925-6926 |
| 4129065 | CIF | C10 H16 N O | P b c a | 12.98637; 11.75812; 11.72942 90; 90; 90 | 1791.03 | Dragulescu-Andrasi, Alina; Filatov, Alexander S.; Oakley, Richard T.; Li, Xiang; Lekin, Kristina; Huq, Ashfia; Pak, Chongin; Greer, Samuel M.; McKay, Johannes; Jo, Minyoung; Lengyel, Jeff; Hung, Ivan; Maradzike, Elvis; DePrince, A. Eugene; Stoian, Sebastian A.; Hill, Stephen; Hu, Yan-Yan; Shatruk, Michael Radical Dimerization in Plastic Organic Crystal Leads to Structural and Magnetic Bistability with Wide Thermal Hysteresis. Journal of the American Chemical Society, 2019 |
| 4120264 | CIF | C10 H16 N2 O2 | P 21 21 21 | 8.44; 8.862; 13.239 90; 90; 90 | 990.2 | Yan-Bo Wang; Yi-Ming Wang; Wen-Zhen Zhang; Xiao-Bing Lu Fast CO2 Sequestration, Activation, and Catalytic Transformation Using N-Heterocyclic Olefins Journal of the American Chemical Society, 2013, 135, 11996-12003 |
| 4118530 | CIF | C10 H16 N6 O4 S | P -1 | 8.7; 20.0767; 23.68 97.662; 91.72; 90.016 | 4097.3 | Powner, Matthew W.; Zheng, Shao-Liang; Szostak, Jack W. Multicomponent Assembly of Proposed DNA Precursors in Water Journal of the American Chemical Society, 2012, 134, 13889-13895 |
| 4123578 | CIF | C10 H16 O2 | P 32 | 18.8316; 18.8316; 6.8064 90; 90; 120 | 2090.37 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4123667 | CIF | C10 H16 O2 | P 43 21 2 | 7.8391; 7.8391; 30.7247 90; 90; 90 | 1888.08 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4123668 | CIF | C10 H16 O2 | P 43 | 7.7371; 7.7371; 30.9059 90; 90; 90 | 1850.11 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4100370 | CIF | C10 H16 O3 | P 1 21/n 1 | 12.012; 6.8002; 13.1662 90; 115.748; 90 | 968.69 | Katsuhiko Tomooka Journal of the American Chemical Society, 2005 |
| 4107602 | CIF | C10 H16 O3 | P -1 | 6.945; 7.426; 10.987 85.366; 86.896; 63.74 | 506.4 | Maksim Royzen; Glenn P. A. Yap; Joseph M. Fox A Photochemical Synthesis of Functionalized trans-Cyclooctenes Driven by Metal Complexation Journal of the American Chemical Society, 2008, 130, 3760-3761 |
| 4123665 | CIF | C10 H16 O3 | P 1 21 1 | 6.94; 12.1429; 11.5499 90; 93.316; 90 | 971.7 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4123666 | CIF | C10 H16 O3 | P 1 21 1 | 7.3713; 10.8358; 11.8516 90; 91.104; 90 | 946.46 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4123669 | CIF | C10 H16 O3 | P 21 21 21 | 8.294; 9.0364; 12.17 90; 90; 90 | 912.12 | Masarwa, Ahmad; Weber, Manuel; Sarpong, Richmond Selective C-C and C-h bond activation/cleavage of pinene derivatives: synthesis of enantiopure cyclohexenone scaffolds and mechanistic insights. Journal of the American Chemical Society, 2015, 137, 6327-6334 |
| 4126662 | CIF | C10 H16 O4 | P 31 | 12.007; 12.007; 6.4662 90; 90; 120 | 807.3 | Hashimoto, Satoshi; Katoh, Shun-Ichiro; Kato, Takehiro; Urabe, Daisuke; Inoue, Masayuki Total Synthesis of Resiniferatoxin Enabled by Radical-Mediated Three-Component Coupling and 7-endo Cyclization. Journal of the American Chemical Society, 2017 |
| 4119729 | CIF | C10 H16 O7 | P 1 | 8.2828; 8.5783; 12.4406 80.819; 87.674; 89.574 | 871.89 | Koichiro Mikami; Alexander T. Lonnecker; Tiffany P. Gustafson; Nathanael F. Zinnel; Pei-Jing Pai; David H. Russell; Karen L. Wooley Polycarbonates Derived from Glucose via an Organocatalytic Approach Journal of the American Chemical Society, 2013, 135, 6826-6829 |
| 4129372 | CIF | C10 H16.5 Br Cl O1.25 | P 21 21 2 | 16.4144; 23.4402; 5.9992 90; 90; 90 | 2308.2 | Hu, Dennis X.; Seidl, Frederick J.; Bucher, Cyril; Burns, Noah Z. Catalytic chemo-, regio-, and enantioselective bromochlorination of allylic alcohols. Journal of the American Chemical Society, 2015, 137, 3795-3798 |
| 4100980 | CIF | C10 H17 B F4 N4 O3 | P n m a | 6.5925; 10.6552; 21.296 90; 90; 90 | 1495.93 | Peddy Vishweshwar; Jennifer A. McMahon; Mark Oliveira; Matthew L. Peterson; Michael J. Zaworotko Journal of the American Chemical Society, 2005 |
| 4120334 | CIF | C10 H17 B7 Fe | P -1 | 6.5321; 8.0627; 12.6859 73.519; 84.233; 77.446 | 624.81 | Brendan Gleeson; Patrick J. Carroll; Larry G. Sneddon Syntheses and Structural Characterizations of Inorganic ansa-Metallocene Analogues: ansa-Ferratricarbadecaboranes Journal of the American Chemical Society, 2013, 135, 12407-12413 |
| 4114172 | CIF | C10 H17 Br5 N2 | P 1 21/c 1 | 7.6795; 12.9359; 16.5349 90; 101.481; 90 | 1609.73 | Sergey V. Lindeman; Jürgen Hecht; Jay K. Kochi The Charge-Transfer Motif in Crystal Engineering. Self-Assembly of Acentric (Diamondoid) Networks from Halide Salts and Carbon Tetrabromide as Electron-Donor/Acceptor Synthons Journal of the American Chemical Society, 2003, 125, 11597-11606 |
| 4108596 | CIF | C10 H17 Co N O7 P2 | P 1 21/c 1 | 8.354; 29.211; 6.2171 90; 110.621; 90 | 1419.9 | Andrei V. Palii; Oleg S. Reu; Sergei M. Ostrovsky; Sophia I. Klokishner; Boris S. Tsukerblat; Zhong-Ming Sun; Jiang-Gao Mao; Andrey V. Prosvirin; Han-Hua Zhao; Kim R. Dunbar A Highly Anisotropic Cobalt(II)-Based Single-Chain Magnet: Exploration of Spin Canting in an Antiferromagnetic Array Journal of the American Chemical Society, 2008, 130, 14729-14738 |
| 4110130 | CIF | C10 H17 Cr Mn N8 O2 | P 1 21/n 1 | 7.681; 14.498; 16.598 90; 97.326; 90 | 1833.3 | Wakako Kaneko; Masaaki Ohba; Susumu Kitagawa A Flexible Coordination Polymer Crystal Providing Reversible Structural and Magnetic Conversions Journal of the American Chemical Society, 2007, 129, 13706-13712 |
| 4112226 | CIF | C10 H17 N O3 | P 1 21/n 1 | 12.198; 6.272; 14.501 90; 107.04; 90 | 1060.7 | Frederick A. Villamena; Christopher M. Hadad; Jay L. Zweier Theoretical Study of the Spin Trapping of Hydroxyl Radical by Cyclic Nitrones: A Density Functional Theory Approach Journal of the American Chemical Society, 2004, 126, 1816-1829 |
| 4107689 | CIF | C10 H17 N O4 S | C 1 2/c 1 | 27.957; 7.6891; 11.327 90; 98.949; 90 | 2405.3 | Aaron R. Thornton; Simon B. Blakey Catalytic Metallonitrene/Alkyne Metathesis: A Powerful Cascade Process for the Synthesis of Nitrogen-Containing Molecules Journal of the American Chemical Society, 2008, 130, 5020-5021 |
| 4110202 | CIF | C10 H17 N3 O3 S | P n m a | 20.044; 7.464; 8.63 90; 90; 90 | 1291.1 | Matthew J. Horner; K. Travis Holman; Michael D. Ward Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders Journal of the American Chemical Society, 2007, 129, 14640-14660 |
| 4110203 | CIF | C10 H17 N3 O3 S | P n m a | 18.513; 7.4798; 9.3991 90; 90; 90 | 1301.5 | Matthew J. Horner; K. Travis Holman; Michael D. Ward Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders Journal of the American Chemical Society, 2007, 129, 14640-14660 |
| 4110233 | CIF | C10 H17 N3 O3 S | P b c a | 14.501; 12.686; 47.584 90; 90; 90 | 8754 | Matthew J. Horner; K. Travis Holman; Michael D. Ward Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders Journal of the American Chemical Society, 2007, 129, 14640-14660 |
| 4128453 | CIF | C10 H18 B Cl O2 | P -1 | 7.339; 7.6739; 11.4931 105.065; 95.119; 114.634 | 553.57 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4122136 | CIF | C10 H18 B Cl3 Ga Mo N O4 Si2 | P 21 21 21 | 12.0364; 12.668; 14.0217 90; 90; 90 | 2138 | Braunschweig, Holger; Ye, Qing; Vargas, Alfredo; Dewhurst, Rian D.; Hupp, Florian Complete and Partial 1,2-Additions across Transition Metal-Boron Double Bonds. Journal of the American Chemical Society, 2014, 136, 9560-9563 |
| 4107994 | CIF | C10 H18 B Cu F3 N2 | P -1 | 8.249; 9.803; 16.222 84.265; 86.712; 83.729 | 1296 | Galyna G. Dubinina; Hideki Furutachi; David A. Vicic Active Trifluoromethylating Agents from Well-Defined Copper(I)-CF3 Complexes Journal of the American Chemical Society, 2008, 130, 8600-8601 |
| 4123503 | CIF | C10 H18 B10 | P 1 21/n 1 | 10.246; 13.688; 10.528 90; 91.892; 90 | 1475.7 | Quan, Yangjian; Xie, Zuowei Palladium-Catalyzed Regioselective Intramolecular Coupling of o-Carborane with Aromatics via Direct Cage B-H Activation. Journal of the American Chemical Society, 2015, 150310140942007 |
| 4127482 | CIF | C10 H18 B10 Cl N O | P -1 | 10.2815; 12.6911; 13.9103 92.039; 109.668; 104.582 | 1639.64 | Lyu, Hairong; Zhang, Jie; Yang, Jingting; Quan, Yangjian; Xie, Zuowei Catalytic Regioselective Cage B(8)-H Arylation of o-Carboranes via "Cage-Walking" Strategy. Journal of the American Chemical Society, 2019, 141, 4219-4224 |
| 4106286 | CIF | C10 H18 Br Li N2 O4 | P 41 21 2 | 9.1703; 9.1703; 15.5694 90; 90; 90 | 1309.3 | Tien Teng Ong; Padmini Kavuru; Thanhha Nguyen; Ryan Cantwell; Łukasz Wojtas; Michael J. Zaworotko 2:1 Cocrystals of Homochiral and Achiral Amino Acid Zwitterions with Li+ Salts: Water-Stable Zeolitic and Diamondoid Metal-Organic Materials Journal of the American Chemical Society, 2011, 133, 9224-9227 |
| 4106288 | CIF | C10 H18 Cl Li N2 O4 | P 41 21 2 | 9.0791; 9.0791; 15.4104 90; 90; 90 | 1270.28 | Tien Teng Ong; Padmini Kavuru; Thanhha Nguyen; Ryan Cantwell; Łukasz Wojtas; Michael J. Zaworotko 2:1 Cocrystals of Homochiral and Achiral Amino Acid Zwitterions with Li+ Salts: Water-Stable Zeolitic and Diamondoid Metal-Organic Materials Journal of the American Chemical Society, 2011, 133, 9224-9227 |
| 4127410 | CIF | C10 H18 Cl2 Sn2 | P b c a | 6.626; 19.1358; 24.4346 90; 90; 90 | 3098.2 | Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society, 2019, 141, 11000-11003 |
| 4115015 | CIF | C10 H18 Cl4 Pt Si2 | P b c n | 8.26; 16.961; 11.406 90; 90; 90 | 1598 | Aroop K. Roy; Richard B. Taylor The First Alkene-Platinum-Silyl Complexes: Lifting the Hydrosilation Mechanism Shroud with Long-Lived Precatalytic Intermediates and True Pt Catalysts Journal of the American Chemical Society, 2002, 124, 9510-9524 |
| 4117582 | CIF | C10 H18 F6 O10 S2 Sn | P 1 21/n 1 | 8.7518; 16.127; 14.8106 90; 101.022; 90 | 2051.8 | Charles L. B. Macdonald; Rajoshree Bandyopadhyay; Benjamin F. T. Cooper; Warren W. Friedl; Aaron J. Rossini; Robert W. Schurko; S. Holger Eichhorn; Rolfe H. Herber Experimental and Computational Insights into the Stabilization of Low-Valent Main Group Elements Using Crown Ethers and Related Ligands Journal of the American Chemical Society, 2012, 134, 4332-4345 |
| 4115762 | CIF | C10 H18 F8 I2 N3 O P | P c a 21 | 20.312; 8.679; 12.045 90; 90; 90 | 2123 | Qianli Chu; Zhemin Wang; Qichen Huang; Chunhua Yan; Shizheng Zhu Fluorine-Containing Donor-Acceptor Complex: Infinite Chain Formed by Oxygen...Iodine Interaction Journal of the American Chemical Society, 2001, 123, 11069-11070 |
| 4106291 | CIF | C10 H18 Li N3 O7 | P 21 21 21 | 11.0448; 12.0393; 20.2019 90; 90; 90 | 2686.28 | Tien Teng Ong; Padmini Kavuru; Thanhha Nguyen; Ryan Cantwell; Łukasz Wojtas; Michael J. Zaworotko 2:1 Cocrystals of Homochiral and Achiral Amino Acid Zwitterions with Li+ Salts: Water-Stable Zeolitic and Diamondoid Metal-Organic Materials Journal of the American Chemical Society, 2011, 133, 9224-9227 |
| 4106292 | CIF | C10 H18 Li N3 O7 | P 21 21 21 | 9.5219; 9.5664; 15.0812 90; 90; 90 | 1373.8 | Tien Teng Ong; Padmini Kavuru; Thanhha Nguyen; Ryan Cantwell; Łukasz Wojtas; Michael J. Zaworotko 2:1 Cocrystals of Homochiral and Achiral Amino Acid Zwitterions with Li+ Salts: Water-Stable Zeolitic and Diamondoid Metal-Organic Materials Journal of the American Chemical Society, 2011, 133, 9224-9227 |
| 4106451 | CIF | C10 H18 N2 O14 Zn2 | P -1 | 6.722; 8.897; 9.501 62.779; 88.615; 71.692 | 474.9 | Masaaki Sadakiyo; Teppei Yamada; Hiroshi Kitagawa Hydroxyl Group Recognition by Hydrogen-Bonding Donor and Acceptor Sites Embedded in a Layered Metal-Organic Framework Journal of the American Chemical Society, 2011, 133, 11050-11053 |
| 4117828 | CIF | C10 H18 N2 O3 | P 1 21/c 1 | 10.3706; 9.6865; 11.846 90; 93.873; 90 | 1187.3 | Maréva Fèvre; Julien Pinaud; Alexandre Leteneur; Yves Gnanou; Joan Vignolle; Daniel Taton; Karinne Miqueu; Jean-Marc Sotiropoulos Imidazol(in)ium Hydrogen Carbonates as a Genuine Source of N-Heterocyclic Carbenes (NHCs): Applications to the Facile Preparation of NHC Metal Complexes and to NHC-Organocatalyzed Molecular and Macromolecular Syntheses Journal of the American Chemical Society, 2012, 134, 6776-6784 |
| 4116327 | CIF | C10 H18 N2 O4 P2 | C 1 2/c 1 | 14.6181; 8.3199; 11.878 90; 115.877; 90 | 1299.77 | Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides Journal of the American Chemical Society, 1999, 121, 1658-1664 |
| 4130278 | CIF | C10 H18 N4 O | P 1 21/c 1 | 11.2054; 5.6226; 17.6834 90; 93.73; 90 | 1111.76 | Licsandru, Erol; Kocsis, Istvan; Shen, Yue-Xiao; Murail, Samuel; Legrand, Yves-Marie; van der Lee, Arie; Tsai, Daniel; Baaden, Marc; Kumar, Manish; Barboiu, Mihail Salt-Excluding Artificial Water Channels Exhibiting Enhanced Dipolar Water and Proton Translocation. Journal of the American Chemical Society, 2016, 138, 5403-5409 |
| 4112824 | CIF HKL | C10 H18 O S2 | P 1 21/c 1 | 8.786; 12.028; 11.204 90; 92.372; 90 | 1183 | Kentaro Okuma; Toshiyuki Shigetomi; Yoshinori Nibu; Kosei Shioji; Masato Yoshida; Yoshinobu Yokomori Synthesis of Isolable Thiirane-2-thione (α-Dithiolactone) from Thioketene S-Oxide Journal of the American Chemical Society, 2004, 126, 9508-9509 |
| 4108581 | CIF | C10 H18 O2 | P 1 21 1 | 5.3896; 9.8022; 9.3448 90; 90.939; 90 | 493.62 | Bruce H. Lipshutz; Benjamin Amorelli; John B. Unger CuH-Catalyzed Enantioselective Intramolecular Reductive Aldol Reactions Generating Three New Contiguous Asymmetric Stereocenters Journal of the American Chemical Society, 2008, 130, 14378-14379 |
| 4105370 | CIF | C10 H18 O4 | P 1 21 1 | 6.0434; 8.5691; 10.8387 90; 95.146; 90 | 559.04 | Morris Markert; Ulf Scheffler; Rainer Mahrwald Asymmetric Histidine-Catalyzed Cross-Aldol Reactions of Enolizable Aldehydes: Access to Defined Configured Quaternary Stereogenic Centers Journal of the American Chemical Society, 2009, 131, 16642-16643 |
| 4116147 | CIF | C10 H18 O4 | P 1 21/c 1 | 10.9106; 5.0109; 9.7936 90; 93.451; 90 | 534.46 | Venkat R. Thalladi; Markus Nüsse; Roland Boese The Melting Point Alternation in α,ω-Alkanedicarboxylic Acids Journal of the American Chemical Society, 2000, 122, 9227-9236 |
| 4114873 | CIF | C10 H18 O6 Sn3 | P 21 21 21 | 21.4033; 24.3825; 24.4347 90; 90; 90 | 12751.6 | Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters Journal of the American Chemical Society, 2002, 124, 6904-6913 |
| 4101452 | CIF | C10 H19 B11 | P c a 21 | 29.9835; 6.9576; 14.8049 90; 90; 90 | 3088.5 | Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society, 2006, 128, 5219-5230 |
| 4132333 | CIF | C10 H19 Br O2 | C 1 2 1 | 24.997; 5.1956; 18.1896 90; 104.221; 90 | 2290 | Goh, Shermin S.; Guduguntla, Sureshbabu; Kikuchi, Takashi; Lutz, Martin; Otten, Edwin; Fujita, Makoto; Feringa, Ben L. Desymmetrization of meso-Dibromocycloalkenes through Copper(I)-Catalyzed Asymmetric Allylic Substitution with Organolithium Reagents. Journal of the American Chemical Society, 2018, 140, 7052-7055 |
| 4106933 | CIF | C10 H19 Br O3 | P 1 21/c 1 | 15.255; 8.603; 8.606 90; 95.675; 90 | 1123.9 | Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks; Wesley Sattler A General Strategy for the Stereocontrolled Preparation of Diverse 8- and 9-Membered Laurencia-Type Bromoethers Journal of the American Chemical Society, 2011, 133, 15898-15901 |
| 4113583 | CIF | C10 H19 Cl N2 O12 | P -1 | 5.5253; 7.169; 10.823 81.321; 88.518; 76.042 | 411.3 | Leif Häggman; Cecilia Lindblad; Hans Oskarsson; Ann-Sofi Ullström; Ingmar Persson The Influence of Short Strong Hydrogen Bonding on the Structure and the Physicochemical Properties of Alkyl-N-iminodiacetic Acids in Solid State and Aqueous Systems Journal of the American Chemical Society, 2003, 125, 3631-3641 |
| 4107940 | CIF | C10 H19 Cl N2 O7 | P 1 21 1 | 4.919; 7.856; 18.784 90; 91.27; 90 | 725.7 | Mohamed Mohamed Naseer Ali; Udayanath Aich; Babu Varghese; Anne Imberty Conformational Preferences of the Aglycon Moiety in Models and Analogs of GlcNAc-Asn Linkage: Crystal Structures and ab Initio Quantum Chemical Calculations of N-(β-d-Glycopyranosyl)haloacetamides Journal of the American Chemical Society, 2008, 130, 8317-8325 |
| 4113581 | CIF | C10 H19 N O4 | P b c a | 8.412; 9.589; 28.063 90; 90; 90 | 2263.6 | Leif Häggman; Cecilia Lindblad; Hans Oskarsson; Ann-Sofi Ullström; Ingmar Persson The Influence of Short Strong Hydrogen Bonding on the Structure and the Physicochemical Properties of Alkyl-N-iminodiacetic Acids in Solid State and Aqueous Systems Journal of the American Chemical Society, 2003, 125, 3631-3641 |
| 4111666 | CIF | C10 H2 F12 O4 Zn | C 1 2/c 1 | 20.3991; 7.8389; 20.312 90; 109.276; 90 | 3065.9 | Evgeny V. Dikarev; Haitao Zhang; Bo Li Heterometallic Bismuth-Transition Metal Homoleptic β-Diketonates Journal of the American Chemical Society, 2005, 127, 6156-6157 |
| 4102710 | CIF | C10 H20 B10 O | P -1 | 7.8439; 9.9497; 11.2367 101.613; 108.27; 100.565 | 786.55 | Sunewang R. Wang; Zaozao Qiu; Zuowei Xie Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes Journal of the American Chemical Society, 2010, 132, 9988-9989 |
| 4102711 | CIF | C10 H20 B10 O | P 1 21/n 1 | 6.9769; 12.9283; 17.4054 90; 94.134; 90 | 1565.87 | Sunewang R. Wang; Zaozao Qiu; Zuowei Xie Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes Journal of the American Chemical Society, 2010, 132, 9988-9989 |
| 4125151 | CIF | C10 H20 B10 O | P 1 21/n 1 | 8.6489; 13.1773; 13.8649 90; 94.794; 90 | 1574.64 | Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society, 2016, 138, 9081-9084 |
| 4125155 | CIF | C10 H20 B10 O | P 21 21 21 | 7.6501; 13.2544; 15.2454 90; 90; 90 | 1545.85 | Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society, 2016, 138, 9081-9084 |
| 4126073 | CIF | C10 H20 B10 O | P -1 | 11.7531; 14.5081; 20.6459 104.277; 99.855; 110.189 | 3072.4 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4126074 | CIF | C10 H20 B10 O | P 1 21/c 1 | 11.0205; 18.651; 7.7745 90; 103.99; 90 | 1550.6 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4126075 | CIF | C10 H20 B10 O | P -1 | 11.895; 15.005; 20.362 105.498; 99.46; 110.281 | 3149.5 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4126076 | CIF | C10 H20 B10 O | P 21 21 21 | 7.834; 13.872; 14.386 90; 90; 90 | 1563.37 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4126077 | CIF | C10 H20 B10 O | P 1 21/n 1 | 8.6489; 13.1773; 13.8649 90; 94.794; 90 | 1574.64 | Dziedzic, Rafal Miroslaw; Martin, Joshua L.; Axtell, Jonathan C.; Saleh, Liban M. A.; Ong, Ta-Chung; Yang, Yun-Fang; Messina, Marco S.; Rheingold, Arnold L.; Houk, Kendall N.; Spokoyny, Alexander M. Cage-walking: Vertex Differentiation by Palladium-Catalyzed Isomerization of B(9)-Bromo-meta-Carborane. Journal of the American Chemical Society, 2017 |
| 4103972 | CIF | C10 H20 Cl O2 P | P c a 21 | 25.078; 7.7656; 11.962 90; 90; 90 | 2329.5 | Monica Carreira; Manutsavin Charernsuk; Michael Eberhard; Natalie Fey; Roel van Ginkel; Alex Hamilton; Wilhelmus P. Mul; A. Guy Orpen; Hirihataya Phetmung; Paul G. Pringle Anatomy of Phobanes. Diastereoselective Synthesis of the Three Isomers of n-Butylphobane and a Comparison of their Donor Properties Journal of the American Chemical Society, 2009, 131, 3078-3092 |
| 4131925 | CIF | C10 H20 Cl2 Cu N16 O8 | C 1 2/c 1 | 15.0672; 9.0113; 17.5426 90; 97.696; 90 | 2360.39 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4101196 | CIF | C10 H20 Cl3 Ge N2 P | P n m a | 12.964; 17.3985; 7.3944 90; 90; 90 | 1667.84 | Burck, Sebastian; Gudat, Dietrich; Nieger, Martin; Du Mont, Wolf-Walter P-Hydrogen substituted 1,3,2-Diazaphospholenes: Molecular Hydrides Journal of the American Chemical Society, 2006 |
| 4101197 | CIF | C10 H20 Cl3 N2 P Sn | P n m a | 12.7132; 17.4583; 7.7723 90; 90; 90 | 1725.07 | Burck, Sebastian; Gudat, Dietrich; Nieger, Martin; Du Mont, Wolf-Walter P-Hydrogen substituted 1,3,2-Diazaphospholenes: Molecular Hydrides Journal of the American Chemical Society, 2006 |
| 4104218 | CIF | C10 H20 Cl3 Nb O2 | P -1 | 6.9774; 7.2895; 15.4878 79.058; 78.262; 71.287 | 723.87 | Rocío Arteaga-Müller; Hayato Tsurugi; Teruhiko Saito; Masao Yanagawa; Seiji Oda; Kazushi Mashima New Tantalum Ligand-Free Catalyst System for Highly Selective Trimerization of Ethylene Affording 1-Hexene: New Evidence of a Metallacycle Mechanism Journal of the American Chemical Society, 2009, 131, 5370-5371 |
| 4134273 | CIF | C10 H20 F4 I4 N2 Pb | A e a 2 | 9.2974; 25.1758; 8.9611 90; 90; 90 | 2097.52 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4134277 | CIF | C10 H20 F4 I4 N2 Pb | A e a 2 | 9.2541; 25.0703; 8.9483 90; 90; 90 | 2076.03 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4134282 | CIF | C10 H20 F4 I4 N2 Pb | A e a 2 | 9.3456; 25.3587; 9.0113 90; 90; 90 | 2135.61 | Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric. Journal of the American Chemical Society, 2020 |
| 4112931 | CIF | C10 H20 Fe N3 O S2 | P 1 21/n 1 | 7.665; 23.861; 7.803 90; 112.869; 90 | 1314.9 | Chao-Yi Chiang; Matthew L. Miller; Joseph H. Reibenspies; Marcetta Y. Darensbourg Bismercaptoethanediazacyclooctane as a N2S2 Chelating Agent and Cys-X-Cys Mimic for Fe(NO) and Fe(NO)2 Journal of the American Chemical Society, 2004, 126, 10867-10874 |
| 4128404 | CIF | C10 H20 Mn N9 | P 21 21 21 | 7.5991; 9.5866; 20.193 90; 90; 90 | 1471.1 | Vaddypally, Shivaiah; Tomlinson, Warren; O'Sullivan, Owen T; Ding, Ran; Van Vliet, Megan M.; Wayland, Bradford B.; Hooper, Joseph P.; Zdilla, Michael J. Activation of C-H, N-H, and O-H Bonds via Proton-Coupled Electron Transfer to a Mn(III) Complex of Redox-Noninnocent Octaazacyclotetradecadiene, a Catenated-Nitrogen Macrocyclic Ligand. Journal of the American Chemical Society, 2019, 141, 5699-5709 |
| 4125865 | CIF | C10 H20 N2 O S4 V | P 1 21/c 1 | 12.7241; 13.8775; 9.4376 90; 105.076; 90 | 1609.12 | Atzori, Matteo; Tesi, Lorenzo; Benci, Stefano; Lunghi, Alessandro; Righini, Roberto; Taschin, Andrea; Torre, Renato; Sorace, Lorenzo; Sessoli, Roberta Spin Dynamics and Low Energy Vibrations: Insights from Vanadyl-Based Potential Molecular Qubits. Journal of the American Chemical Society, 2017, 139, 4338-4341 |
| 4101257 | CIF | C10 H20 N2 O3 | P 61 | 14.573; 14.573; 10.354 90; 90; 120 | 1904.3 | Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society, 2006, 128, 6737-6744 |
| 4125573 | CIF | C10 H20 N2 Se | P b c a | 11.4233; 10.80265; 18.95402 90; 90; 90 | 2338.96 | Campos, Michael P.; Hendricks, Mark P.; Beecher, Alexander N.; Walravens, Willem; Swain, Robert A.; Cleveland, Gregory T.; Hens, Zeger; Sfeir, Matthew Y.; Owen, Jonathan S. A Library of Selenourea Precursors to PbSe Nanocrystals with Size Distributions near the Homogeneous Limit. Journal of the American Chemical Society, 2017, 139, 2296-2305 |
| 4100247 | CIF | C10 H20 N4 O8 | P 1 21 1 | 4.8451; 18.326; 8.678 90; 104.029; 90 | 747.5 | Journal of the American Chemical Society, 2005 |
| 4126564 | CIF | C10 H20 O18 P4 Pr | P 1 21/c 1 | 5.964; 18.27; 18.965 90; 95.62; 90 | 2056.5 | Wong, Norman E.; Ramaswamy, Padmini; Lee, Andrew; Gelfand, Benjamin S.; Bladek, Kamila; Taylor, Jared M.; Spasyuk, Denis; Shimizu, George K. H. Tuning Intrinsic and Extrinsic Proton Conduction in Metal-Organic Frameworks by the Lanthanide Contraction. Journal of the American Chemical Society, 2017 |
| 4125156 | CIF | C10 H21 B10 N O2 | P -1 | 12.7259; 12.9299; 20.6344 100.156; 98.573; 96.338 | 3272 | Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society, 2016, 138, 9081-9084 |
| 4130812 | CIF | C10 H21 B10 N O2 S | C 1 2/c 1 | 24.2592; 7.3926; 19.8972 90; 98.5493; 90 | 3528.7 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
| 4130813 | CIF | C10 H21 B10 N O3 S | C 1 2/c 1 | 25.0743; 7.4905; 19.9945 90; 101.104; 90 | 3685 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
| 4112932 | CIF | C10 H21 Fe N4 O2 S2 | P b c a | 16.448; 12.384; 28.996 90; 90; 90 | 5906 | Chao-Yi Chiang; Matthew L. Miller; Joseph H. Reibenspies; Marcetta Y. Darensbourg Bismercaptoethanediazacyclooctane as a N2S2 Chelating Agent and Cys-X-Cys Mimic for Fe(NO) and Fe(NO)2 Journal of the American Chemical Society, 2004, 126, 10867-10874 |
| 4119791 | CIF | C10 H21 N O2 | P n m a | 19.6025; 11.5901; 9.6145 90; 90; 90 | 2184.37 | Yanfeng Jiang; Olivier Blacque; Thomas Fox; Heinz Berke Catalytic CO2 Activation Assisted by Rhenium Hydride/B(C6F5)3 Frustrated Lewis Pairs-Metal Hydrides Functioning as FLP Bases Journal of the American Chemical Society, 2013, 135, 7751-7760 |
| 4121604 | CIF | C10 H21 N2 O0.5 | C 1 2/c 1 | 22.675; 6.1256; 16.5599 90; 113.194; 90 | 2114.2 | Fujita, Ken-Ichi; Tanaka, Yui; Kobayashi, Masato; Yamaguchi, Ryohei Homogeneous perdehydrogenation and perhydrogenation of fused bicyclic N-heterocycles catalyzed by iridium complexes bearing a functional bipyridonate ligand. Journal of the American Chemical Society, 2014, 136, 4829-4832 |
| 4104484 | CIF | C10 H22 Br F6 N O2 P2 Si | P 1 21/c 1 | 16.0802; 9.2065; 15.4421 90; 111.208; 90 | 2131.26 | Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+ Journal of the American Chemical Society, 2009, 131, 7905-7916 |
| 4106290 | CIF | C10 H22 Li N3 O7 | P 1 21/c 1 | 16.0472; 8.4767; 10.8836 90; 103.731; 90 | 1438.2 | Tien Teng Ong; Padmini Kavuru; Thanhha Nguyen; Ryan Cantwell; Łukasz Wojtas; Michael J. Zaworotko 2:1 Cocrystals of Homochiral and Achiral Amino Acid Zwitterions with Li+ Salts: Water-Stable Zeolitic and Diamondoid Metal-Organic Materials Journal of the American Chemical Society, 2011, 133, 9224-9227 |
| 4121605 | CIF | C10 H22 N2 O | C 1 2/c 1 | 15.671; 5.0499; 13.9788 90; 90.849; 90 | 1106.1 | Fujita, Ken-Ichi; Tanaka, Yui; Kobayashi, Masato; Yamaguchi, Ryohei Homogeneous perdehydrogenation and perhydrogenation of fused bicyclic N-heterocycles catalyzed by iridium complexes bearing a functional bipyridonate ligand. Journal of the American Chemical Society, 2014, 136, 4829-4832 |
| 4111048 | CIF | C10 H23 N3 O11 P2 | P 1 21/c 1 | 8.6608; 14.173; 15.231 90; 102.704; 90 | 1823.8 | Junhong Mao; Sujoy Mukherjee; Yong Zhang; Rong Cao; John M. Sanders; Yongcheng Song; Yonghui Zhang; Gary A. Meints; Yi Gui Gao; Dushyant Mukkamala; Michael P. Hudock; Eric Oldfield Solid-State NMR, Crystallographic, and Computational Investigation of Bisphosphonates and Farnesyl Diphosphate Synthase-Bisphosphonate Complexes Journal of the American Chemical Society, 2006, 128, 14485-14497 |
| 4125101 | CIF | C10 H23 N3 O3 | P 21 21 21 | 8.1091; 9.773; 16.327 90; 90; 90 | 1293.9 | Kim, Byoungmoo; Chinn, Alex J.; Fandrick, Daniel R.; Senanayake, Chris H.; Singer, Robert A.; Miller, Scott J. Distal Stereocontrol Using Guanidinylated Peptides as Multifunctional Ligands: Desymmetrization of Diarylmethanes via Ullman Cross-Coupling. Journal of the American Chemical Society, 2016, 138, 7939-7945 |
| 4105995 | CIF | C10 H24 B10 O2 | C 1 2/c 1 | 28.0596; 7.3777; 17.1759 90; 112.127; 90 | 3293.8 | Sunewang R. Wang; Zaozao Qiu; Zuowei Xie Regioselective Insertion of Carborynes into Ethereal C-H Bond: Facile Synthesis of α-Carboranylated Ethers Journal of the American Chemical Society, 2011, 133, 5760-5763 |
| 4119270 | CIF | C10 H24 B2 N4 | P -1 | 8.3848; 11.5802; 14.6971 86.343; 84.661; 71.837 | 1349.15 | Holger Braunschweig; Alexander Damme; Rian D. Dewhurst; Sundargopal Ghosh; Thomas Kramer; Bernd Pfaffinger; Krzysztof Radacki; Alfredo Vargas Electronic and Structural Effects of Stepwise Borylation and Quaternization on Borirene Aromaticity Journal of the American Chemical Society, 2013, 135, 1903-1911 |
| 4133889 | CIF | C10 H24 Br4 N2 O2 Pb | C m c 21 | 26.972; 8.9027; 7.9566 90; 90; 90 | 1910.6 | Chen, Xiao-Gang; Song, Xian-Jiang; Zhang, Zhi-Xu; Li, Peng-Fei; Ge, Jia-Zhen; Tang, Yuan-Yuan; Gao, Ji-Xing; Zhang, Wan-Ying; Fu, Da-Wei; You, Yu-Meng; Xiong, Ren-Gen Two-dimensional layered perovskite ferroelectric with giant piezoelectric voltage coefficient. Journal of the American Chemical Society, 2019 |
| 4133890 | CIF | C10 H24 Br4 N2 O2 Pb | C m c 21 | 26.89; 8.8834; 8.0708 90; 90; 90 | 1927.9 | Chen, Xiao-Gang; Song, Xian-Jiang; Zhang, Zhi-Xu; Li, Peng-Fei; Ge, Jia-Zhen; Tang, Yuan-Yuan; Gao, Ji-Xing; Zhang, Wan-Ying; Fu, Da-Wei; You, Yu-Meng; Xiong, Ren-Gen Two-dimensional layered perovskite ferroelectric with giant piezoelectric voltage coefficient. Journal of the American Chemical Society, 2019 |
| 4116392 | CIF | C10 H24 Cl Fe N10 O4 | P 1 21/c 1 | 13.641; 8.851; 15.266 90; 99.53; 90 | 1817.7 | Karsten Meyer; Eckhard Bill; Bernd Mienert; Thomas Weyhermüller; Karl Wieghardt Photolysis of cis- and trans-[FeIII(cyclam)(N3)2]+ Complexes: Spectroscopic Characterization of a Nitridoiron(V) Species Journal of the American Chemical Society, 1999, 121, 4859-4876 |
| 4116781 | CIF | C10 H24 Cl Mn N10 O4 | P -1 | 9.462; 9.511; 11.434 79.45; 81.07; 63.5 | 902.1 | Karsten Meyer; Jesper Bendix; Nils Metzler-Nolte; Thomas Weyhermüller; Karl Wieghardt Nitridomanganese(V) and -(VI) Complexes Containing Macrocyclic Amine Ligands Journal of the American Chemical Society, 1998, 120, 7260-7270 |
| 4115996 | CIF | C10 H24 Cl2 Fe N5 O5 | P b c a | 13.01; 10.853; 23.692 90; 90; 90 | 3345.3 | Christina Hauser; Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt The Electronic Structures of an Isostructural Series of Octahedral Nitrosyliron Complexes {Fe-NO}6,7,8 Elucidated by Mössbauer Spectroscopy Journal of the American Chemical Society, 2000, 122, 4352-4365 |
| 4116783 | CIF | C10 H24 Cl2 Mn N5 O4 | P b c a | 13.101; 10.896; 23.203 90; 90; 90 | 3312.2 | Karsten Meyer; Jesper Bendix; Nils Metzler-Nolte; Thomas Weyhermüller; Karl Wieghardt Nitridomanganese(V) and -(VI) Complexes Containing Macrocyclic Amine Ligands Journal of the American Chemical Society, 1998, 120, 7260-7270 |
| 4116785 | CIF | C10 H24 Cl2 Mn N5 O8 | P 1 21/c 1 | 9.378; 13.134; 15.158 90; 99.88; 90 | 1839.3 | Karsten Meyer; Jesper Bendix; Nils Metzler-Nolte; Thomas Weyhermüller; Karl Wieghardt Nitridomanganese(V) and -(VI) Complexes Containing Macrocyclic Amine Ligands Journal of the American Chemical Society, 1998, 120, 7260-7270 |
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