Crystallography Open Database
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COD ID  |
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Cell parameters | Cell volume |
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|---|---|---|---|---|---|---|
| 4101586 | CIF | C24 H44 O P2 Pd | P 21 21 21 | 11.3334; 14.8825; 15.6938 90; 90; 90 | 2647.06 | Fulmer, Gregory R.; Muller, Richard P.; Kemp, Richard A.; Goldberg, Karen I. Hydrogenolysis of Palladium(II) Hydroxide and Methoxide Pincer Complexes JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1346 |
| 4101587 | CIF | C24 H48 O3 P2 Pd | P b c a | 11.0895; 15.69; 30.3155 90; 90; 90 | 5274.7 | Fulmer, Gregory R.; Muller, Richard P.; Kemp, Richard A.; Goldberg, Karen I. Hydrogenolysis of Palladium(II) Hydroxide and Methoxide Pincer Complexes JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1346 |
| 4101588 | CIF | C25 H46 O P2 Pd | P 21 21 21 | 9.9429; 14.7868; 18.02 90; 90; 90 | 2649.43 | Fulmer, Gregory R.; Muller, Richard P.; Kemp, Richard A.; Goldberg, Karen I. Hydrogenolysis of Palladium(II) Hydroxide and Methoxide Pincer Complexes JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1346 |
| 4101589 | CIF | C14 H19 Br O4 | P 1 21 1 | 7.2459; 8.6833; 11.2308 90; 104.73; 90 | 683.4 | Gao, Shuanhu; Wang, Oiaoling; Chen, Chuo Synthesis and Structure Revision of Nakiterpiosin JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1410 |
| 4101590 | CIF | C15 H17 Br Cl2 O3 | P 21 21 21 | 7.136; 14.06; 16.616 90; 90; 90 | 1667.12 | Gao, Shuanhu; Wang, Oiaoling; Chen, Chuo Synthesis and Structure Revision of Nakiterpiosin JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1410 |
| 4101591 | CIF | Na6 Sn2 Zn | C 1 2/m 1 | 10.077; 5.4733; 9.316 90; 98.07; 90 | 508.7 | Kim, Sung-Jin; Kraus, Florian; Faessler, Thomas F. Na6ZnSn2, Na4.24K1.76(1)ZnSn2, and Na20Zn8Sn11: Three Intermetallic Structures Containing the Linear {Sn-Zn-Sn}(6-) Unit JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1469-1478 |
| 4101592 | CIF | K1.76 Na4.24 Sn2 Zn | P 1 21/c 1 | 11.5716; 9.8617; 11.382 90; 119.334; 90 | 1132.32 | Kim, Sung-Jin; Kraus, Florian; Faessler, Thomas F. Na6ZnSn2, Na4.24K1.76(1)ZnSn2, and Na20Zn8Sn11: Three Intermetallic Structures Containing the Linear {Sn-Zn-Sn}(6-) Unit JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1469-1478 |
| 4101593 | CIF | Na20 Sn11 Zn8 | C 1 2/c 1 | 16.1505; 9.2762; 27.594 90; 102.969; 90 | 4028.6 | Kim, Sung-Jin; Kraus, Florian; Faessler, Thomas F. Na6ZnSn2, Na4.24K1.76(1)ZnSn2, and Na20Zn8Sn11: Three Intermetallic Structures Containing the Linear {Sn-Zn-Sn}(6-) Unit JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1469-1478 |
| 4101594 | CIF | C22 H22 O3 | P 1 21/c 1 | 14.601; 9.537; 14.72 90; 117.062; 90 | 1825.5 | Koyama, Ichiro; Kurahashi, Takuya; Matsubara, Seijiro Nickel-Catalyzed {[}4+2] Cycloaddition of Enones with Alkynes JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1350 |
| 4101595 | CIF | C24 H24 O3 | P 1 21/c 1 | 14.527; 9.394; 15.537 90; 114.869; 90 | 1923.6 | Koyama, Ichiro; Kurahashi, Takuya; Matsubara, Seijiro Nickel-Catalyzed {[}4+2] Cycloaddition of Enones with Alkynes JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1350 |
| 4101596 | CIF | C22.5 H30 N2 Ni O3 | P -1 | 10.5195; 10.9929; 11.5575 66.224; 67.551; 76.882 | 1126.2 | Koyama, Ichiro; Kurahashi, Takuya; Matsubara, Seijiro Nickel-Catalyzed {[}4+2] Cycloaddition of Enones with Alkynes JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1350 |
| 4101597 | CIF | C18 H14 Cl N O3 | P 1 21/n 1 | 9.4768; 10.58; 31.161 90; 94.53; 90 | 3114.6 | Liang, Yong; Jiao, Lei; Zhang, Shiwei; Yu, Zhi-Xiang; Xu, Jiaxi New Insights into the Torquoselectivity of the Staudinger Reaction JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1542-1549 |
| 4101598 | CIF | C18 H14 Cl N O3 | P 1 21/c 1 | 16.082; 12.461; 7.8035 90; 102.1; 90 | 1529 | Liang, Yong; Jiao, Lei; Zhang, Shiwei; Yu, Zhi-Xiang; Xu, Jiaxi New Insights into the Torquoselectivity of the Staudinger Reaction JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1542-1549 |
| 4101599 | CIF | C46 H44 B2 F8 Fe N4 P2 | P 43 21 2 | 11.8743; 11.8743; 33.2046 90; 90; 90 | 4681.8 | Mikhailine, Alexandre; Lough, Alan J.; Morris, Robert H. Efficient Asymmetric Transfer Hydrogenation of Ketones Catalyzed by an Iron Complex Containing a P-N-N-P Tetradentate Ligand Formed by Template Synthesis JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1394 |
| 4101600 | CIF | C34 H38 Mo O2 Rh2 S4 | P b c a | 21.049; 14.373; 22.479 90; 90; 90 | 6801 | Muratsugu, Satoshi; Sodeyama, Keitaro; Kitamura, Fusao; Sugimoto, Manabu; Tsuneyuki, Shinji; Miyashita, Seiji; Kato, Tatsuhisa; Nishihara, Hiroshi Two-Electron Reduction of a Rh-Mo-Rh Dithiolato Complex To Form a Triplet Ground State Associated with a Change in CO Coordination Mode JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1388 |
| 4101601 | CIF | C13 H10 I N3 | P 1 21/c 1 | 22.7489; 6.5732; 7.9998 90; 99.563; 90 | 1179.61 | Rodriguez-Rodriguez, Cristina; Sanchez de Groot, Natalia; Rimola, Albert; Alvarez-Larena, Angel; Lloveras, Vega; Vidal-Gancedo, Jose; Ventura, Salvador; Vendrell, Josep; Sodupe, Mariona; Gonzalez-Duarte, Pilar Design, Selection, and Characterization of Thioflavin-Based Intercalation Compounds with Metal Chelating Properties for Application in Alzheimer's Disease JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1436-1451 |
| 4101602 | CIF | C13 H8 I N O S | P 1 21/c 1 | 14.7636; 4.7515; 18.0167 90; 106.323; 90 | 1212.9 | Rodriguez-Rodriguez, Cristina; Sanchez de Groot, Natalia; Rimola, Albert; Alvarez-Larena, Angel; Lloveras, Vega; Vidal-Gancedo, Jose; Ventura, Salvador; Vendrell, Josep; Sodupe, Mariona; Gonzalez-Duarte, Pilar Design, Selection, and Characterization of Thioflavin-Based Intercalation Compounds with Metal Chelating Properties for Application in Alzheimer's Disease JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1436-1451 |
| 4101603 | CIF | C13 H8 I N O2 | P 2 21 21 | 5.8887; 14.6161; 27.273 90; 90; 90 | 2347.4 | Rodriguez-Rodriguez, Cristina; Sanchez de Groot, Natalia; Rimola, Albert; Alvarez-Larena, Angel; Lloveras, Vega; Vidal-Gancedo, Jose; Ventura, Salvador; Vendrell, Josep; Sodupe, Mariona; Gonzalez-Duarte, Pilar Design, Selection, and Characterization of Thioflavin-Based Intercalation Compounds with Metal Chelating Properties for Application in Alzheimer's Disease JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2009, 131, 1436-1451 |
| 4101667 | CIF | C21 H16 Br N O3 | P 21 21 21 | 5.6298; 8.2145; 37.372 90; 90; 90 | 1728.3 | Duffey, Trisha A.; Shaw, Scott A.; Vedejs, Edwin AcOLeDMAP and BnOLeDMAP: conformationally restricted nucleophilic catalysts for enantioselective rearrangement of indolyl acetates and carbonates. Journal of the American Chemical Society, 2009, 131, 14-15 |
| 4101668 | CIF | C25 H20 Br N O3 | P 1 | 7.2377; 10.127; 15.948 103.179; 96.629; 109.845 | 1046.6 | Duffey, Trisha A.; Shaw, Scott A.; Vedejs, Edwin AcOLeDMAP and BnOLeDMAP: conformationally restricted nucleophilic catalysts for enantioselective rearrangement of indolyl acetates and carbonates. Journal of the American Chemical Society, 2009, 131, 14-15 |
| 4101669 | CIF | C22 H29 N3 O3 | P 21 21 21 | 8.3738; 11.4894; 21.864 90; 90; 90 | 2103.5 | Duffey, Trisha A.; Shaw, Scott A.; Vedejs, Edwin AcOLeDMAP and BnOLeDMAP: conformationally restricted nucleophilic catalysts for enantioselective rearrangement of indolyl acetates and carbonates. Journal of the American Chemical Society, 2009, 131, 14-15 |
| 4101670 | CIF | C51 H81 Cl4 N O2 P2 Ru S | P -1 | 12.5925; 13.144; 19.0071 89.02; 74.248; 63.938 | 2700.9 | Yun, Sang Young; Kim, Mansuk; Lee, Daesung; Wink, Donald J. Structure and reactivity of alkynyl ruthenium alkylidenes. Journal of the American Chemical Society, 2009, 131, 24-25 |
| 4101671 | CIF | C53 H72 Cl2 N3 O2 P Ru S | P 1 21/n 1 | 13.111; 22.22; 18.014 90; 94.542; 90 | 5231.5 | Yun, Sang Young; Kim, Mansuk; Lee, Daesung; Wink, Donald J. Structure and reactivity of alkynyl ruthenium alkylidenes. Journal of the American Chemical Society, 2009, 131, 24-25 |
| 4101672 | CIF | C34 H48 Cl5 O P Ru | P -1 | 9.152; 12.81; 15.916 77.958; 81.559; 84.934 | 1801.9 | Yun, Sang Young; Kim, Mansuk; Lee, Daesung; Wink, Donald J. Structure and reactivity of alkynyl ruthenium alkylidenes. Journal of the American Chemical Society, 2009, 131, 24-25 |
| 4101673 | CIF | C18 H22 Cl2 F24 N2 O8 P4 Pt2 | P -1 | 9.034; 9.516; 11.485 84.428; 81.872; 83.45 | 967.7 | Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G. Chlorine photoelimination from a diplatinum core: circumventing the back reaction. Journal of the American Chemical Society, 2009, 131, 28-29 |
| 4101674 | CIF | C18 H22 Cl6 F24 N2 O8 P4 Pt2 | C 1 2/c 1 | 23.3862; 8.7562; 22.1281 90; 109.955; 90 | 4259.2 | Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G. Chlorine photoelimination from a diplatinum core: circumventing the back reaction. Journal of the American Chemical Society, 2009, 131, 28-29 |
| 4101675 | CIF | C18 H22 Cl4 F24 N2 O8 P4 Pt2 | P 1 21/n 1 | 10.499; 13.544; 29.154 90; 99.423; 90 | 4090 | Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G. Chlorine photoelimination from a diplatinum core: circumventing the back reaction. Journal of the American Chemical Society, 2009, 131, 28-29 |
| 4101676 | CIF | C77 H96.26 Cl1.74 O4.13 Pt2 | P -1 | 15.295; 15.739; 16.395 82.06; 76.309; 62.259 | 3392.1 | Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G. Chlorine photoelimination from a diplatinum core: circumventing the back reaction. Journal of the American Chemical Society, 2009, 131, 28-29 |
| 4101677 | CIF | C18 H22 Cl4 F24 N2 O8 P4 Pt2 | P -1 | 11.621; 16.506; 22.836 91.323; 90.869; 110.373 | 4104 | Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G. Chlorine photoelimination from a diplatinum core: circumventing the back reaction. Journal of the American Chemical Society, 2009, 131, 28-29 |
| 4101678 | CIF | C72 H82 B2 Fe N12 | C 1 c 1 | 25.0365; 11.1259; 24.5183 90; 113.503; 90 | 6263.1 | Ni, Zhaoping; Shores, Matthew P Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors. Journal of the American Chemical Society, 2009, 131, 32-33 |
| 4101679 | CIF | C72 H82 B2 Fe N12 | C 1 c 1 | 25.4833; 11.1536; 24.7455 90; 113.466; 90 | 6451.7 | Ni, Zhaoping; Shores, Matthew P Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors. Journal of the American Chemical Society, 2009, 131, 32-33 |
| 4101680 | CIF | C72 H82 B2 Fe N12 | P 1 21 1 | 13.4698; 18.017; 13.9282 90; 115.011; 90 | 3063.2 | Ni, Zhaoping; Shores, Matthew P Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors. Journal of the American Chemical Society, 2009, 131, 32-33 |
| 4101681 | CIF | C49 H62 B Br Fe N12 O | P 1 21/c 1 | 9.3168; 31.7028; 16.0446 90; 90.283; 90 | 4739 | Ni, Zhaoping; Shores, Matthew P Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors. Journal of the American Chemical Society, 2009, 131, 32-33 |
| 4101682 | CIF | C48 H62 B Br Fe N12 | P 1 21/c 1 | 9.4246; 31.7843; 16.3078 90; 90; 90 | 4885.1 | Ni, Zhaoping; Shores, Matthew P Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors. Journal of the American Chemical Society, 2009, 131, 32-33 |
| 4101683 | CIF | C40 H50 Fe N4 | P 1 21/n 1 | 11.849; 16.5426; 18.2817 90; 92.494; 90 | 3580.1 | Russell, Sarah K.; Lobkovsky, Emil; Chirik, Paul J. N-N bond cleavage in diazoalkanes by a bis(imino)pyridine iron complex. Journal of the American Chemical Society, 2009, 131, 36-37 |
| 4101684 | CIF | C5 H13 Cl3 Co N2 | P 1 21 1 | 7.02; 8.139; 9.731 90; 104.87; 90 | 537.4 | Ye, Heng-Yun; Fu, Da-Wei; Zhang, Yi; Zhang, Wen; Xiong, Ren-Gen; Huang, Songping D Hydrogen-bonded ferroelectrics based on metal-organic coordination. Journal of the American Chemical Society, 2009, 131, 42-43 |
| 4101685 | CIF | C5 H13 Cl3 N2 Zn | P 1 21 1 | 7.0385; 8.1172; 9.754 90; 105.06; 90 | 538.1 | Ye, Heng-Yun; Fu, Da-Wei; Zhang, Yi; Zhang, Wen; Xiong, Ren-Gen; Huang, Songping D Hydrogen-bonded ferroelectrics based on metal-organic coordination. Journal of the American Chemical Society, 2009, 131, 42-43 |
| 4101686 | CIF | C22 H13 B F12 O | P 1 21/n 1 | 18.1452; 12.6687; 19.7459 90; 112.809; 90 | 4184.2 | Ullrich, Matthias; Lough, Alan J.; Stephan, Douglas W. Reversible, metal-free, heterolytic activation of H2 at room temperature. Journal of the American Chemical Society, 2009, 131, 52-53 |
| 4101687 | CIF | C36 H38 B F12 P | R 3 :H | 16.964; 16.964; 9.963 90; 90; 120 | 2483 | Ullrich, Matthias; Lough, Alan J.; Stephan, Douglas W. Reversible, metal-free, heterolytic activation of H2 at room temperature. Journal of the American Chemical Society, 2009, 131, 52-53 |
| 4101688 | CIF | C32 H26 N4 O4 | P 1 2/c 1 | 14.7861; 12.0082; 15.9814 90; 105.197; 90 | 2738.3 | Kawabata, Takeo; Jiang, Changsheng; Hayashi, Kazuhiro; Tsubaki, Kazunori; Yoshimura, Tomoyuki; Majumdar, Swapan; Sasamori, Takahiro; Tokitoh, Norihiro Axially chiral binaphthyl surrogates with an inner N-H-N hydrogen bond. Journal of the American Chemical Society, 2009, 131, 54-55 |
| 4101689 | CIF | C60.25 H87.25 Br2 Mo N2 O2 P1.25 Si | P 21 21 21 | 10.8412; 18.736; 29.809 90; 90; 90 | 6054.8 | Marinescu, Smaranda C.; Schrock, Richard R.; Li, Bo; Hoveyda, Amir H. Inversion of configuration at the metal in diastereomeric imido alkylidene monoaryloxide monopyrrolide complexes of molybdenum. Journal of the American Chemical Society, 2009, 131, 58-59 |
| 4101690 | CIF | C130 H102.75 Cl3 F30 P11 Re2 S6 | C 1 2/c 1 | 29.009; 22.577; 43.99 90; 96.182; 90 | 28643 | Grapperhaus, Craig A.; Ouch, Kagna; Mashuta, Mark S. Redox-regulated ethylene binding to a rhenium-thiolate complex. Journal of the American Chemical Society, 2009, 131, 64-65 |
| 4101691 | CIF | C24 H20 Ag N6 P | P 1 2/n 1 | 16.4246; 7.3362; 19.1152 90; 103.219; 90 | 2242.24 | Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias The binary silver nitrogen anion [Ag(N3)2]-. Journal of the American Chemical Society, 2009, 131, 72-74 |
| 4101692 | CIF | C18 H15 Ag N6 S | C 1 c 1 | 16.3409; 10.5219; 10.6388 90; 94.213; 90 | 1824.3 | Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias The binary silver nitrogen anion [Ag(N3)2]-. Journal of the American Chemical Society, 2009, 131, 72-74 |
| 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 |
| 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 |
| 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 |
| 4101696 | CIF | C29 H32 O | P 1 21/c 1 | 15.109; 6.1735; 24.395 90; 91.535; 90 | 2274.6 | Mitchell, Reginald H.; Zhang, Rui; Berg, David J.; Twamley, Brendan; Williams, Richard Vaughan Measuring aromaticity with the dimethyldihydropyrene ring current probe. Experimental and computational studies of the fulvenes and the strongly antiaromatic cyclopentadienone reveal large Mills-Nixon-type bond localization effects. Synthesis of fulvene-fused dihydropyrenes. Journal of the American Chemical Society, 2009, 131, 189-199 |
| 4101697 | CIF | C29 H34 O | P -1 | 9.685; 10.666; 12.406 112.859; 91.953; 103.258 | 1138.5 | Mitchell, Reginald H.; Zhang, Rui; Berg, David J.; Twamley, Brendan; Williams, Richard Vaughan Measuring aromaticity with the dimethyldihydropyrene ring current probe. Experimental and computational studies of the fulvenes and the strongly antiaromatic cyclopentadienone reveal large Mills-Nixon-type bond localization effects. Synthesis of fulvene-fused dihydropyrenes. Journal of the American Chemical Society, 2009, 131, 189-199 |
| 4101698 | CIF | C34 H20 F4 N0 O4 P2 W | P n m a | 16.893; 21.358; 8.0731 90; 90; 90 | 2912.8 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101699 | CIF | C7 H6 Cl N2 O4 Re | P 1 21/c 1 | 8.8522; 10.297; 12.389 90; 107.84; 90 | 1075 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101700 | CIF | C36 H30 Cl F2 N2 O6 P2 Re | P -1 | 9.03; 10.898; 19.929 75.388; 82.356; 68.013 | 1758.1 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101701 | CIF | C36 H24 F3 N2 O3 P2 Re | P 1 21/c 1 | 9.8118; 19.1632; 17.1424 90; 93.836; 90 | 3216 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101702 | CIF | C36 H26.5 Cl3 F2 N2 O2.25 P2 Re | P -1 | 9.9913; 10.8606; 18.072 96.301; 101.241; 114.69 | 1706.9 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101703 | CIF | C7 H6 Br Mn N2 O4 | P 1 21/c 1 | 12.506; 13.456; 12.976 90; 91.53; 90 | 2182.8 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101704 | CIF | C37 H26 Br Cl2 F2 Mn N2 O3 P2 | P 1 21/c 1 | 16.493; 11.902; 18.845 90; 105.589; 90 | 3563.2 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101705 | CIF | C27 H35 N3 O2 | P 1 21/c 1 | 13.051; 9.533; 20.391 90; 101.09; 90 | 2490 | Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach. Journal of the American Chemical Society, 2009, 131, 357-367 |
| 4101706 | CIF | C43 H34 Cl4 F4 N4 O6 P2 Re2 | P -1 | 11.465; 11.577; 18.72 91.16; 103.05; 104.05 | 2340.7 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101707 | CIF | C30 H41 N3 O2 | C 1 2/c 1 | 51.292; 13.2238; 29.0236 90; 118.497; 90 | 17301 | Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach. Journal of the American Chemical Society, 2009, 131, 357-367 |
| 4101708 | CIF | C48 H50 Cl F4 N2 O6 P2 Re | P -1 | 11.201; 11.8; 20.504 92.239; 100.058; 117.123 | 2353.1 | Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt Metal template controlled formation of [11]ane-P2C(NHC) macrocycles. Journal of the American Chemical Society, 2009, 131, 306-317 |
| 4101709 | CIF | C38 H41 N3 O2 | P 1 21/c 1 | 11.3812; 24.8447; 12.4766 90; 116.154; 90 | 3166.7 | Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach. Journal of the American Chemical Society, 2009, 131, 357-367 |
| 4101710 | CIF | C30 H41 N3 O2 | P -1 | 7.5388; 13.771; 14.573 93.35; 102.371; 100.33 | 1446.4 | Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach. Journal of the American Chemical Society, 2009, 131, 357-367 |
| 4103745 | CIF | C17 H30 O3 | P 21 21 2 | 17.084; 9.2508; 10.2983 90; 90; 90 | 1627.55 | Kevin M. McQuaid; Dalibor Sames C-H Bond Functionalization via Hydride Transfer: Lewis Acid Catalyzed Alkylation Reactions by Direct Intramolecular Coupling of sp3 C-H Bonds and Reactive Alkenyl Oxocarbenium Intermediates Journal of the American Chemical Society, 2009, 131, 402-403 |
| 4103746 | CIF | C14 H13 O2 | P 21 21 21 | 9.6931; 9.8584; 11.9252 90; 90; 90 | 1139.55 | Kevin M. McQuaid; Dalibor Sames C-H Bond Functionalization via Hydride Transfer: Lewis Acid Catalyzed Alkylation Reactions by Direct Intramolecular Coupling of sp3 C-H Bonds and Reactive Alkenyl Oxocarbenium Intermediates Journal of the American Chemical Society, 2009, 131, 402-403 |
| 4103747 | CIF | C16 H14 N2 O5 | P -1 | 8.595; 9.799; 10.014 71.928; 85.027; 68.533 | 745.8 | Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism Journal of the American Chemical Society, 2009, 131, 570-576 |
| 4103748 | CIF | C70 H79 Ag N4 O7 P2 | P 21 21 21 | 17.451; 17.675; 21.505 90; 90; 90 | 6633 | Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism Journal of the American Chemical Society, 2009, 131, 570-576 |
| 4103749 | CIF | C20 H19 Cl N2 O5 | P 21 21 21 | 8.8375; 11.63; 18.584 90; 90; 90 | 1910.1 | Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism Journal of the American Chemical Society, 2009, 131, 570-576 |
| 4103750 | CIF | C15 H17 N O5 | P 21 21 21 | 6.4323; 9.5882; 23.5349 90; 90; 90 | 1451.5 | Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism Journal of the American Chemical Society, 2009, 131, 570-576 |
| 4103751 | CIF | C16 H18 N6 O2 | P -1 | 6.4306; 10.05; 11.98 84.052; 84.765; 88.383 | 766.7 | Roslyn S. Butler; Pamela Cohn; Phillip Tenzel; Khalil A. Abboud; Ronald K. Castellano Synthesis, Photophysical Behavior, and Electronic Structure of Push-Pull Purines Journal of the American Chemical Society, 2009, 131, 623-633 |
| 4103752 | CIF | C18 H21 N7 O3 | P 1 21/n 1 | 10.6415; 13.5541; 13.043 90; 107.01; 90 | 1799 | Roslyn S. Butler; Pamela Cohn; Phillip Tenzel; Khalil A. Abboud; Ronald K. Castellano Synthesis, Photophysical Behavior, and Electronic Structure of Push-Pull Purines Journal of the American Chemical Society, 2009, 131, 623-633 |
| 4103753 | CIF | C16 H36 Fe N2 | P 21 21 21 | 7.7544; 11.0912; 22.122 90; 90; 90 | 1902.6 | William M. Reiff; Charles E. Schulz; Myung-Hwan Whangbo; Jung In Seo; Yoon Sup Lee; Gregory R. Potratz; Charles W. Spicer; Gregory S. Girolami Consequences of a Linear Two-Coordinate Geometry for the Orbital Magnetism and Jahn-Teller Distortion Behavior of the High Spin Iron(II) Complex Fe[N(t-Bu)2]2 Journal of the American Chemical Society, 2009, 131, 404-405 |
| 4103754 | CIF | C6 H13 N3 O7 | P -1 | 4.4968; 10.4078; 11.821 70.645; 85.722; 84.971 | 519.36 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103755 | CIF | C8 H22 N4 O8 | P 1 21/c 1 | 13.9089; 7.685; 14.2279 90; 97.758; 90 | 1506.9 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103756 | CIF | C10 H26 N4 O8 | P 1 21/n 1 | 8.969; 7.779; 11.803 90; 95.522; 90 | 819.7 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103757 | CIF | C12 H26 N4 O6 | P -1 | 9.962; 9.965; 10.064 70.093; 69.558; 66.216 | 833.1 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103758 | CIF | C14 H30 N4 O6 | P -1 | 9.365; 12.6982; 12.7582 75.762; 75.679; 82.023 | 1420 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103759 | CIF | C11 H21 N3 O6 | P -1 | 5.0096; 11.818; 14.202 74.787; 81.591; 77.922 | 789.7 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103760 | CIF | C12 H23 N3 O6 | P 1 21/n 1 | 4.994; 16.209; 20.341 90; 90.221; 90 | 1646.5 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103761 | CIF | C20 H26 N4 O6 | P -1 | 4.9193; 10.2941; 10.765 88.508; 76.911; 85.008 | 528.95 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103762 | CIF | C18 H34 N4 O6 | P -1 | 5.0552; 9.651; 11.101 81.894; 81.684; 83.687 | 528.3 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103763 | CIF | C24 H26 N4 O6 | P 1 21/n 1 | 4.943; 23.463; 10.699 90; 101.774; 90 | 1214.7 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103764 | CIF | C28 H26 N4 O6 | P -1 | 4.931; 10.017; 13.738 85.899; 84.56; 85.141 | 671.7 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103765 | CIF | C28 H30 N4 O8 | P 1 21/c 1 | 15.822; 9.289; 9.526 90; 100.914; 90 | 1375 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103766 | CIF | C30 H34 N4 O8 | P 1 21/c 1 | 13.594; 8.266; 13.865 90; 100.435; 90 | 1532.2 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103767 | CIF | C28 H26 N4 O6 | P -1 | 4.8862; 10.072; 13.67 79.154; 88.615; 85.662 | 658.8 | Zhong Li; Frank W. Fowler; Joseph W. Lauher Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene Journal of the American Chemical Society, 2009, 131, 634-643 |
| 4103768 | CIF | C12 H12 N2 O2 | P 1 21/n 1 | 7.6165; 16.5619; 16.8917 90; 92.805; 90 | 2128.23 | Jian Dong; Kyril M. Solntsev; Laren M. Tolbert Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing Journal of the American Chemical Society, 2009, 131, 662-670 |
| 4103769 | CIF | C13 H14 N2 O2 | P 1 21/n 1 | 11.4832; 7.7162; 13.3246 90; 102.553; 90 | 1152.43 | Jian Dong; Kyril M. Solntsev; Laren M. Tolbert Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing Journal of the American Chemical Society, 2009, 131, 662-670 |
| 4103770 | CIF | C18 H24 N2 O2 | P -1 | 7.4623; 10.0972; 11.7537 88.216; 79.002; 71.188 | 822.48 | Jian Dong; Kyril M. Solntsev; Laren M. Tolbert Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing Journal of the American Chemical Society, 2009, 131, 662-670 |
| 4103771 | CIF | C24 H36 N2 O2 | P -1 | 7.4678; 10.2078; 15.4909 85.971; 85.619; 71.602 | 1115.91 | Jian Dong; Kyril M. Solntsev; Laren M. Tolbert Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing Journal of the American Chemical Society, 2009, 131, 662-670 |
| 4103772 | CIF | C25 H17 Al Cl2 N6 O3 | P -1 | 7.9946; 12.0879; 13.1153 70.346; 82.95; 84.082 | 1181.98 | Szu-Hung Liao; Jin-Ruei Shiu; Shun-Wei Liu; Shi-Jay Yeh; Yu-Hung Chen; Chin-Ti Chen; Tahsin J. Chow; Chih-I Wu Hydroxynaphthyridine-Derived Group III Metal Chelates: Wide Band Gap and Deep Blue Analogues of Green Alq3(Tris(8-hydroxyquinolate)aluminum) and Their Versatile Applications for Organic Light-Emitting Diodes Journal of the American Chemical Society, 2009, 131, 763-777 |
| 4103773 | CIF | C13 H15 N O6 V | P 1 21/n 1 | 6.2898; 16.096; 14.357 90; 90.204; 90 | 1453.5 | Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; Andrew D. Sutton; David L. Thorn Aerobic Oxidation of Pinacol by Vanadium(V) Dipicolinate Complexes: Evidence for Reduction to Vanadium(III) Journal of the American Chemical Society, 2009, 131, 428-429 |
| 4103774 | CIF | C17 H13 N3 O5 V | P 21 21 21 | 9.6731; 9.8036; 16.6299 90; 90; 90 | 1577 | Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; Andrew D. Sutton; David L. Thorn Aerobic Oxidation of Pinacol by Vanadium(V) Dipicolinate Complexes: Evidence for Reduction to Vanadium(III) Journal of the American Chemical Society, 2009, 131, 428-429 |
| 4103775 | CIF | C44 H36 N8 O9 V2 | C 1 2/c 1 | 28.459; 8.6208; 19.834 90; 121.545; 90 | 4147 | Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; Andrew D. Sutton; David L. Thorn Aerobic Oxidation of Pinacol by Vanadium(V) Dipicolinate Complexes: Evidence for Reduction to Vanadium(III) Journal of the American Chemical Society, 2009, 131, 428-429 |
| 4103776 | CIF | C36 H92 K12 N24 O82 V18 | I 4/m | 39.761; 39.761; 14.6366 90; 90; 90 | 23140 | Xikui Fang; Paul Kögerler; Lyle Isaacs; Sayaka Uchida; Noritaka Mizuno Cucurbit[n]uril-Polyoxoanion Hybrids Journal of the American Chemical Society, 2009, 131, 432-433 |
| 4103777 | CIF | C72 H144 N36 Na12 O93 V18 | C 1 2/c 1 | 14.5575; 31.58; 38.173 90; 90.127; 90 | 17549 | Xikui Fang; Paul Kögerler; Lyle Isaacs; Sayaka Uchida; Noritaka Mizuno Cucurbit[n]uril-Polyoxoanion Hybrids Journal of the American Chemical Society, 2009, 131, 432-433 |
| 4103778 | CIF | C37 H54 N4 O V | P 1 21/c 1 | 17.972; 10.7424; 18.427 90; 93.794; 90 | 3549.8 | Jared S. Silvia; Christopher C. Cummins Two-Electron Reduction of a Vanadium(V) Nitride by CO To Release Cyanate and Open a Coordination Site Journal of the American Chemical Society, 2009, 131, 446-447 |
| 4103779 | CIF | C15 H17 F2 N O2 | P 21 21 21 | 7.273; 8.7412; 20.8648 90; 90; 90 | 1326.5 | Robert Webster; Christian Böing; Mark Lautens Reagent-Controlled Regiodivergent Resolution of Unsymmetrical Oxabicyclic Alkenes Using a Cationic Rhodium Catalyst Journal of the American Chemical Society, 2009, 131, 444-445 |
| 4103780 | CIF | C15 H17 F2 N O2 | P 1 21 1 | 7.5519; 7.8449; 11.5761 90; 91.663; 90 | 685.52 | Robert Webster; Christian Böing; Mark Lautens Reagent-Controlled Regiodivergent Resolution of Unsymmetrical Oxabicyclic Alkenes Using a Cationic Rhodium Catalyst Journal of the American Chemical Society, 2009, 131, 444-445 |
| 4103781 | CIF | C39.5 H45 O8 P Pd S2 | P -1 | 10.2115; 11.9691; 15.3437 96.244; 95.976; 91.175 | 1853.1 | Damien Guironnet; Philipp Roesle; Thomas Rünzi; Inigo Göttker-Schnetmann; Stefan Mecking Insertion Polymerization of Acrylate Journal of the American Chemical Society, 2009, 131, 422-423 |
| 4103782 | CIF | C27 H35 Ni O8 P S2 | P -1 | 10.9981; 12.0103; 12.0742 83.154; 67.82; 88.107 | 1466.2 | Damien Guironnet; Philipp Roesle; Thomas Rünzi; Inigo Göttker-Schnetmann; Stefan Mecking Insertion Polymerization of Acrylate Journal of the American Chemical Society, 2009, 131, 422-423 |
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