Crystallography Open Database
Search results
Result: there are 1446 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 129
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4111334 | CIF | C17 H21 N O4 | P 1 21/c 1 | 30.5704; 16.5037; 9.4954 90; 94.119; 90 | 4778.3 | Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters Journal of the American Chemical Society, 2007, 129, 9631-9634 |
| 4111335 | CIF | C17 H17 N O | P -1 | 8.5625; 8.6438; 19.5105 85.69; 78.443; 65.331 | 1285.57 | Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters Journal of the American Chemical Society, 2007, 129, 9631-9634 |
| 4111336 | CIF | C13.33 H15 N1.67 O5 | C 1 2/c 1 | 27.3241; 13.5169; 24.5145 90; 116.008; 90 | 8137.2 | Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters Journal of the American Chemical Society, 2007, 129, 9631-9634 |
| 4111337 | CIF | C25.46 H16.46 F6 N1.54 S2 | P 1 21/n 1 | 7.091; 24.868; 12.256 90; 102.575; 90 | 2109.4 | Shizuka Takami; Lumi Kuroki; Masahiro Irie Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives Journal of the American Chemical Society, 2007, 129, 7319-7326 |
| 4111338 | CIF | C26.46 H17.46 F6 N0.54 S2 | P -1 | 11.808; 13.568; 14.917 81.763; 82.255; 82.303 | 2327.6 | Shizuka Takami; Lumi Kuroki; Masahiro Irie Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives Journal of the American Chemical Society, 2007, 129, 7319-7326 |
| 4111339 | CIF | C25.63 H16.63 F6 N1.37 O0.3 S1.7 | P 1 21/n 1 | 7.288; 25.792; 12.586 90; 102.519; 90 | 2309.6 | Shizuka Takami; Lumi Kuroki; Masahiro Irie Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives Journal of the American Chemical Society, 2007, 129, 7319-7326 |
| 4111340 | CIF | C25.4 H16.4 F6 N1.6 S2 | P 1 21/n 1 | 7.362; 26.25; 12.701 90; 103.271; 90 | 2389 | Shizuka Takami; Lumi Kuroki; Masahiro Irie Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives Journal of the American Chemical Society, 2007, 129, 7319-7326 |
| 4111341 | CIF | C13 H22 O3 | P 21 21 21 | 9.1824; 10.6533; 13.0707 90; 90; 90 | 1278.61 | Rongbiao Tong; Jason C. Valentine; Frank E. McDonald; Rui Cao; Xikui Fang; Kenneth I. Hardcastle Total Syntheses of Durgamone, Nakorone, and Abudinol B via Biomimetic Oxa- and Carbacyclizations Journal of the American Chemical Society, 2007, 129, 1050-1051 |
| 4111342 | CIF | C19 H30 O2 | P 21 21 21 | 7.1883; 9.8601; 23.4975 90; 90; 90 | 1665.4 | Rongbiao Tong; Jason C. Valentine; Frank E. McDonald; Rui Cao; Xikui Fang; Kenneth I. Hardcastle Total Syntheses of Durgamone, Nakorone, and Abudinol B via Biomimetic Oxa- and Carbacyclizations Journal of the American Chemical Society, 2007, 129, 1050-1051 |
| 4111343 | CIF | C39 H72 O4 Si2 | P 1 21 1 | 13.008; 7.6273; 22.235 90; 106.982; 90 | 2109.9 | Rongbiao Tong; Jason C. Valentine; Frank E. McDonald; Rui Cao; Xikui Fang; Kenneth I. Hardcastle Total Syntheses of Durgamone, Nakorone, and Abudinol B via Biomimetic Oxa- and Carbacyclizations Journal of the American Chemical Society, 2007, 129, 1050-1051 |
| 4111344 | CIF | C36 H31 Cl2 O P2 Re | P b c a | 18.0285; 16.6735; 21.7549 90; 90; 90 | 6539.5 | Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond Journal of the American Chemical Society, 2007, 129, 5180-5187 |
| 4111345 | CIF | C54 H51 Cl2 N P2 Re | P 1 21/n 1 | 15.368; 19.168; 15.9227 90; 103.293; 90 | 4564.74 | Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond Journal of the American Chemical Society, 2007, 129, 5180-5187 |
| 4111346 | CIF | C39 H42 Cl3 N2 P Re | P -1 | 11.8396; 12.8071; 13.6137 72.664; 76.118; 70.558 | 1835.27 | Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond Journal of the American Chemical Society, 2007, 129, 5180-5187 |
| 4111347 | CIF | C24 H24 Cu3 N20 O8 W2 | I b a m | 11.419; 24.83; 30.005 90; 90; 90 | 8507 | Shin-ichi Ohkoshi; Yoshihide Tsunobuchi; Hitomi Takahashi; Toshiya Hozumi; Motoo Shiro; Kazuhito Hashimoto Synthesis and Alcohol Vapor Sensitivity of a Ferromagnetic Copper-Tungsten Bimetallic Assembly Journal of the American Chemical Society, 2007, 129, 3084-3085 |
| 4111348 | CIF | C28.5 H24.5 Cu3 N20 O3.75 W2 | P m m n :2 | 14.761; 25.593; 11.5284 90; 90; 90 | 4355.2 | Shin-ichi Ohkoshi; Yoshihide Tsunobuchi; Hitomi Takahashi; Toshiya Hozumi; Motoo Shiro; Kazuhito Hashimoto Synthesis and Alcohol Vapor Sensitivity of a Ferromagnetic Copper-Tungsten Bimetallic Assembly Journal of the American Chemical Society, 2007, 129, 3084-3085 |
| 4111349 | CIF | C21 H25 N O4 | P 21 21 21 | 9.2969; 12.2219; 15.8158 90; 90; 90 | 1797.1 | Douglas C. Beshore; Amos B. Smith Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B Journal of the American Chemical Society, 2007, 129, 4148-4149 |
| 4111350 | CIF | C18 H29 N O4 | P 1 21 1 | 9.5676; 8.9088; 11.0762 90; 108.677; 90 | 894.37 | Douglas C. Beshore; Amos B. Smith Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B Journal of the American Chemical Society, 2007, 129, 4148-4149 |
| 4111351 | CIF | C13 H20 I N O | P 1 21 1 | 11.5465; 16.9259; 27.4768 90; 91.208; 90 | 5368.7 | Douglas C. Beshore; Amos B. Smith Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B Journal of the American Chemical Society, 2007, 129, 4148-4149 |
| 4111352 | CIF | C17 H18 O5 | P 1 21/n 1 | 9.747; 7.882; 20.522 90; 102.46; 90 | 1539.5 | Cole A. Witham; Pablo Mauleón; Nathan D. Shapiro; Benjamin D. Sherry; F. Dean Toste Gold(I)-Catalyzed Oxidative Rearrangements Journal of the American Chemical Society, 2007, 129, 5838-5839 |
| 4111353 | CIF | C8 H18 F6 O6 P2 S2 | R -3 m :H | 9.228; 9.228; 17.826 90; 90; 120 | 1314.6 | Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations Journal of the American Chemical Society, 2007, 129, 7969-7976 |
| 4111354 | CIF | C11 H24 F6 O6 P2 S2 | P 1 2/c 1 | 15.765; 11.994; 24.584 90; 114.619; 90 | 4226 | Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations Journal of the American Chemical Society, 2007, 129, 7969-7976 |
| 4111355 | CIF | C14 H30 F6 O6 P2 S2 | P -1 | 8.75; 11.566; 12.245 88.744; 74.948; 76.431 | 1162.3 | Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations Journal of the American Chemical Society, 2007, 129, 7969-7976 |
| 4111356 | CIF | C12 H30 Cl8 Ga2 P2 | P n a 21 | 17.749; 10.2043; 14.494 90; 90; 90 | 2625.1 | Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations Journal of the American Chemical Society, 2007, 129, 7969-7976 |
| 4111357 | CIF | C37 H33 Li O6 Sn | C 1 2/c 1 | 11.585; 20.8836; 15.2368 90; 102.415; 90 | 3600.1 | Masaichi Saito; Sanae Imaizumi; Tomoyuki Tajima; Kazuya Ishimura; Shigeru Nagase Synthesis and Structure of Pentaorganostannate Having Five Carbon Substituents Journal of the American Chemical Society, 2007, 129, 10974-10975 |
| 4111358 | CIF | C41 H54 Cl N4 O3 P | P 1 21 1 | 11.0044; 16.4067; 11.104 90; 95.425; 90 | 1995.8 | Daisuke Uraguchi; Sawako Sakaki; Takashi Ooi Chiral Tetraaminophosphonium Salt-Mediated Asymmetric Direct Henry Reaction Journal of the American Chemical Society, 2007, 129, 12392-12393 |
| 4111359 | CIF | C33 H26 Eu F9 N6 O16 S5 | C 1 2/c 1 | 16.84; 16.541; 16.309 90; 104.57; 90 | 4396.8 | Ana de Bettencourt-Dias; Subha Viswanathan; Alexandra Rollett Thiophene-Derivatized Pybox and Its Highly Luminescent Lanthanide Ion Complexes Journal of the American Chemical Society, 2007, 129, 15436-15437 |
| 4121514 | CIF | Li2 O | F m -3 m | 4.614; 4.614; 4.614 90; 90; 90 | 98.23 | David, William I. F.; Jones, Martin O.; Gregory, Duncan H.; Jewell, Catherine M.; Johnson, Simon R.; Walton, Allan; Edwards, Peter P. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4121515 | CIF | Li2 O | F m -3 m | 4.6124; 4.6124; 4.6124 90; 90; 90 | 98.125 | David, W. I. F.; Jones, M. O.; Gregory, D. H.; Jewell, C. M.; Johnson, S. R.; Walton, A.; Edwards, P. P. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124005 | CIF | H2 Li N | I -4 | 5.04309; 5.04309; 10.2262 90; 90; 90 | 260.08 | David, W.I.F.; Jones, M.O.; Gregory, D.H.; Jewell, C.M.; Edwards, P.P.; Johnson, S.R.; Walton, A. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124006 | CIF | H1.92 Li1.08 N | F m -3 m | 5.0713; 5.0713; 5.0713 90; 90; 90 | 130.424 | David, W.I.F.; Jones, M.O.; Johnson, S.R.; Gregory, D.H.; Jewell, C.M.; Edwards, P.P.; Walton, A. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124007 | CIF | H1.6 Li1.4 N | F m -3 m | 5.318; 5.318; 5.318 90; 90; 90 | 150.399 | David, W.I.F.; Gregory, D.H.; Jones, M.O.; Jewell, C.M.; Walton, A.; Johnson, S.R.; Edwards, P.P. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124008 | CIF | H1.77 Li1.23 N | F m -3 m | 5.0628; 5.0628; 5.0628 90; 90; 90 | 129.769 | David, W.I.F.; Jewell, C.M.; Gregory, D.H.; Jones, M.O.; Johnson, S.R.; Walton, A.; Edwards, P.P. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124009 | CIF | H1.61 Li1.39 N | F m -3 m | 5.0418; 5.0418; 5.0418 90; 90; 90 | 128.161 | David, W.I.F.; Jones, M.O.; Jewell, C.M.; Gregory, D.H.; Johnson, S.R.; Walton, A.; Edwards, P.P. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124010 | CIF | H1.46 Li1.54 N | F m -3 m | 5.0207; 5.0207; 5.0207 90; 90; 90 | 126.559 | David, W.I.F.; Jones, M.O.; Gregory, D.H.; Johnson, S.R.; Jewell, C.M.; Walton, A.; Edwards, P.P. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124011 | CIF | H1.3 Li1.7 N | F m -3 m | 4.9996; 4.9996; 4.9996 90; 90; 90 | 124.97 | David, W.I.F.; Gregory, D.H.; Jones, M.O.; Jewell, C.M.; Johnson, S.R.; Edwards, P.P.; Walton, A. A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction Journal of the American Chemical Society, 2007, 129, 1594-1601 |
| 4124087 | CIF | N O4 Ti2.85 | C m c m | 3.804; 9.6486; 9.8688 90; 90; 90 | 362.217 | Hyett, G.; Green, M.A.; Parkin, I.P. The use of combinatorial chemical vapor deposition in the synthesis of Ti(3-delta) O4 N with 0.06 < delta < 0.25: a titanium oxynitride phase isostructural to anosovite Journal of the American Chemical Society, 2007, 129, 15541-15548 |
| 4124088 | CIF | Ga8.2 H23 K8.16 O51.5 Si11.8 | I 21 21 21 | 13.7948; 13.7061; 6.5916 90; 90; 90 | 1246.29 | Lee Yongjae; Celestian, A.J.; Kim Sun Jin; Bull, I.; Kao Chichang; Parise, J.B.; Vogt, T. Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite Journal of the American Chemical Society, 2007, 129, 13744-13748 |
| 4124089 | CIF | Ga8.2 H22.6 K8 O51.3 Si11.8 | I 21 21 21 | 13.7298; 13.5815; 6.5589 90; 90; 90 | 1223.05 | Lee Yongjae; Kim Sun Jin; Bull, I.; Kao Chichang; Celestian, A.J.; Parise, J.B.; Vogt, T. Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite Journal of the American Chemical Society, 2007, 129, 13744-13748 |
| 4124090 | CIF | Ga8.2 H23.2 K8 O51.6 Si11.8 | I 21 21 21 | 13.7587; 13.655; 6.5728 90; 90; 90 | 1234.86 | Lee Yongjae; Kim Sun Jin; Celestian, A.J.; Bull, I.; Parise, J.B.; Kao Chichang; Vogt, T. Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite Journal of the American Chemical Society, 2007, 129, 13744-13748 |
| 4124091 | CIF | Ga8.2 H19.6 K8.32 O49.8 Si11.8 | I -4 2 d | 13.7026; 13.7026; 6.56 90; 90; 90 | 1231.71 | Lee Yongjae; Kim Sun Jin; Celestian, A.J.; Bull, I.; Parise, J.B.; Kao Chichang; Vogt, T. Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite Journal of the American Chemical Society, 2007, 129, 13744-13748 |
| 4124092 | CIF | Ga8.2 H17.2 K8.08 O48.6 Si11.8 | I -4 2 d | 13.6873; 13.6873; 6.5445 90; 90; 90 | 1226.06 | Lee Yongjae; Vogt, T.; Bull, I.; Celestian, A.J.; Kim Sun Jin; Parise, J.B.; Kao Chichang Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite Journal of the American Chemical Society, 2007, 129, 13744-13748 |
| 4124093 | CIF | Ga8.2 K7.36 O40 Si11.8 | I -4 2 d | 12.7372; 12.7372; 6.563 90; 90; 90 | 1064.76 | Lee Yongjae; Kim Sun Jin; Celestian, A.J.; Bull, I.; Parise, J.B.; Kao Chichang; Vogt, T. Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite Journal of the American Chemical Society, 2007, 129, 13744-13748 |
| 4124108 | CIF | O2 Tc | P 1 21/c 1 | 5.68908; 4.75461; 5.51948 90; 121.453; 90 | 127.361 | Rodriguez, E.E.; Poineau, F.; Llobet, A.; Sattelberger, A.P.; Bhattacharjee, J.; Waghmare, U.V.; Hartmann, T.; Cheetham, A.K. Structural studies of Tc O2 by neutron powder diffraction and first-principles calculation Journal of the American Chemical Society, 2007, 129, 10244-10248 |
| 4124109 | CIF | Ce K2 O8 P2 | I 41/a m d :1 | 7.0325; 7.0325; 16.6798 90; 90; 90 | 824.917 | Salvado, M.A.; Trobajo, C.; Pertierra, P.; Garcia, J.R. Crystal structure of a cerium(IV) bis(phosphate) derivative Journal of the American Chemical Society, 2007, 129, 10970-10971 |
| 4124117 | CIF | O2.33333 Si | P 1 | 9.115429; 9.115429; 8.8639 81.3651; 98.6349; 69.0757 | 663.38 | Zicovich-Wilson, C.M.; Durand-Niconoff, J.S.; San-Roman, M.L.; Camblor, M.A.; Pascale, F. Structure, vibrational analysis, and insights into host-guest interactions in as-synthesized pure silica ITQ-12 zeolite by periodic B3LYP calculations Journal of the American Chemical Society, 2007, 129, 11512-11523 |
| 4124118 | CIF | O2 Si | P 1 | 9.208837; 9.174551; 8.984374 81.0227; 98.2014; 68.4861 | 680.826 | Zicovich-Wilson, C.M.; San-Roman, M.L.; Camblor, M.A.; Pascale, F.; Durand-Niconoff, J.S. Structure, vibrational analysis, and insights into host-guest interactions in as-synthesized pure silica ITQ-12 zeolite by periodic B3LYP calculations Journal of the American Chemical Society, 2007, 129, 11512-11523 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!