Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4129971 | CIF | C32 H54 B4 O8 | P 1 21/c 1 | 15.2146; 10.8264; 22.5475 90; 109.475; 90 | 3501.5 | Palmer, W. Neil; Obligacion, Jennifer V.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed Benzylic Borylation: Enabling Polyborylation and Functionalization of Remote, Unactivated C(sp(3))-H Bonds. Journal of the American Chemical Society, 2016, 138, 766-769 |
| 4129972 | CIF | C25 H41 B3 O6 | P 21 21 21 | 10.8115; 15.2429; 16.7747 90; 90; 90 | 2764.4 | Palmer, W. Neil; Obligacion, Jennifer V.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed Benzylic Borylation: Enabling Polyborylation and Functionalization of Remote, Unactivated C(sp(3))-H Bonds. Journal of the American Chemical Society, 2016, 138, 766-769 |
| 4129973 | CIF | C6 H2 F I N2 S | P -1 | 7.1942; 7.6321; 8.348 70.391; 67.906; 65.029 | 376.38 | Shi, Qinqin; Zhang, Siyuan; Zhang, Junxiang; Oswald, Victoria F.; Amassian, Aram; Marder, Seth R.; Blakey, Simon B. KO(t)Bu-Initiated Aryl C-H Iodination: A Powerful Tool for the Synthesis of High Electron Affinity Compounds. Journal of the American Chemical Society, 2016, 138, 3946-3949 |
| 4129974 | CIF | C3 Br I2 N S | P 21 21 21 | 4.21; 13.2907; 14.1228 90; 90; 90 | 790.22 | Shi, Qinqin; Zhang, Siyuan; Zhang, Junxiang; Oswald, Victoria F.; Amassian, Aram; Marder, Seth R.; Blakey, Simon B. KO(t)Bu-Initiated Aryl C-H Iodination: A Powerful Tool for the Synthesis of High Electron Affinity Compounds. Journal of the American Chemical Society, 2016, 138, 3946-3949 |
| 4129975 | CIF | C50 H74 Cu2 N6 O19 | R -3 :H | 18.473; 18.473; 52.11 90; 90; 120 | 15400 | Yan, Yong; Juríček, Michal; Coudert, François-Xavier; Vermeulen, Nicolaas A.; Grunder, Sergio; Dailly, Anne; Lewis, William; Blake, Alexander J.; Stoddart, J. Fraser; Schröder, Martin Non-Interpenetrated Metal-Organic Frameworks Based on Copper(II) Paddlewheel and Oligoparaxylene-Isophthalate Linkers: Synthesis, Structure, and Gas Adsorption. Journal of the American Chemical Society, 2016, 138, 3371-3381 |
| 4129976 | CIF | C61 H91 Cu2 N7 O21 | R -3 :H | 18.3194; 18.3194; 65.6209 90; 90; 120 | 19072 | Yan, Yong; Juríček, Michal; Coudert, François-Xavier; Vermeulen, Nicolaas A.; Grunder, Sergio; Dailly, Anne; Lewis, William; Blake, Alexander J.; Stoddart, J. Fraser; Schröder, Martin Non-Interpenetrated Metal-Organic Frameworks Based on Copper(II) Paddlewheel and Oligoparaxylene-Isophthalate Linkers: Synthesis, Structure, and Gas Adsorption. Journal of the American Chemical Society, 2016, 138, 3371-3381 |
| 4129977 | CIF | C54.25 H34 Cd2 N13 O15 | P 2 21 21 | 8.6935; 25.5171; 32.5555 90; 90; 90 | 7221.9 | Koo, Jin Young; Yakiyama, Yumi; Lee, Gil Ryeong; Lee, Jinho; Choi, Hee Cheul; Morita, Yasushi; Kawano, Masaki Selective Formation of Conductive Network by Radical-Induced Oxidation. Journal of the American Chemical Society, 2016, 138, 1776-1779 |
| 4129978 | CIF | C80.5 H49 Cd2.5 N19.5 O23 | P 1 2/n 1 | 17.868; 15.1867; 33.7475 90; 98.694; 90 | 9052.4 | Koo, Jin Young; Yakiyama, Yumi; Lee, Gil Ryeong; Lee, Jinho; Choi, Hee Cheul; Morita, Yasushi; Kawano, Masaki Selective Formation of Conductive Network by Radical-Induced Oxidation. Journal of the American Chemical Society, 2016, 138, 1776-1779 |
| 4129979 | CIF | C81 H27 Bi9 O63 | P -3 | 47.21; 47.21; 9.9682 90; 90; 120 | 19240.5 | Inge, A. Ken; Köppen, Milan; Su, Jie; Feyand, Mark; Xu, Hongyi; Zou, Xiaodong; O'Keeffe, Michael; Stock, Norbert Unprecedented Topological Complexity in a Metal-Organic Framework Constructed from Simple Building Units. Journal of the American Chemical Society, 2016, 138, 1970-1976 |
| 4129980 | CIF | C41 H57 Cu6 I4 N11 O3 | P 61 2 2 | 22.901; 22.901; 22.272 90; 90; 120 | 10116 | Luo, Xiaolong; Cao, Yu; Wang, Tao; Li, Guanghua; Li, Jiangang; Yang, Yonggang; Xu, Zhongxuan; Zhang, Jian; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Host-Guest Chirality Interplay: A Mutually Induced Formation of a Chiral ZMOF and Its Double-Helix Polymer Guests. Journal of the American Chemical Society, 2016, 138, 786-789 |
| 4129981 | CIF | C41 H57 Cu6 I4 N11 O3 | P 61 2 2 | 22.22; 22.22; 22.487 90; 90; 120 | 9615 | Luo, Xiaolong; Cao, Yu; Wang, Tao; Li, Guanghua; Li, Jiangang; Yang, Yonggang; Xu, Zhongxuan; Zhang, Jian; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Host-Guest Chirality Interplay: A Mutually Induced Formation of a Chiral ZMOF and Its Double-Helix Polymer Guests. Journal of the American Chemical Society, 2016, 138, 786-789 |
| 4129982 | CIF | C41 H57 Cu6 I4 N11 O3 | P 65 2 2 | 22.92; 22.92; 22.27 90; 90; 120 | 10132 | Luo, Xiaolong; Cao, Yu; Wang, Tao; Li, Guanghua; Li, Jiangang; Yang, Yonggang; Xu, Zhongxuan; Zhang, Jian; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Host-Guest Chirality Interplay: A Mutually Induced Formation of a Chiral ZMOF and Its Double-Helix Polymer Guests. Journal of the American Chemical Society, 2016, 138, 786-789 |
| 4129983 | CIF | C27 H25 N O4 | P n a 21 | 25.893; 12.995; 6.5547 90; 90; 90 | 2205.5 | Liu, Yuesheng; Wang, Lijun; Deng, Liang Selective Double Carbomagnesiation of Internal Alkynes Catalyzed by Iron-N-Heterocyclic Carbene Complexes: A Convenient Method to Highly Substituted 1,3-Dienyl Magnesium Reagents. Journal of the American Chemical Society, 2016, 138, 112-115 |
| 4129984 | CIF | C29 H35 I | P 1 21/c 1 | 17.4002; 8.8803; 18.069 90; 113.935; 90 | 2551.9 | Liu, Yuesheng; Wang, Lijun; Deng, Liang Selective Double Carbomagnesiation of Internal Alkynes Catalyzed by Iron-N-Heterocyclic Carbene Complexes: A Convenient Method to Highly Substituted 1,3-Dienyl Magnesium Reagents. Journal of the American Chemical Society, 2016, 138, 112-115 |
| 4129985 | CIF | C55 H54 O | P 1 21/n 1 | 14.9865; 7.9786; 34.6321 90; 101.364; 90 | 4059.8 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129986 | CIF | C39 H25 F12 O | C 1 2/c 1 | 32.7089; 14.2715; 15.626 90; 104.233; 90 | 7070.4 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129987 | CIF | C26 H19 F5 O | P -1 | 7.7536; 8.4647; 16.2224 83.656; 80.33; 65.602 | 954.85 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129988 | CIF | C102 H108 O6 | P -1 | 10.948; 12.0802; 16.2323 69.553; 76.264; 79.814 | 1943.58 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129989 | CIF | C50 H50 O | P 1 21/c 1 | 9.2447; 27.6365; 14.8907 90; 98.658; 90 | 3761.1 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129990 | CIF | C58 H60 O2 | C 1 2/c 1 | 26.3642; 16.1386; 23.42 90; 119.461; 90 | 8676.2 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129991 | CIF | C108 H112 Cl6 O6 | P -1 | 15.7254; 16.3; 19.7644 88.0843; 73.1877; 70.5165 | 4560.7 | Hu, Pan; Lee, Sangsu; Herng, Tun Seng; Aratani, Naoki; Gonçalves, Théo P; Qi, Qingbiao; Shi, Xueliang; Yamada, Hiroko; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Toward Tetraradicaloid: The Effect of Fusion Mode on Radical Character and Chemical Reactivity. Journal of the American Chemical Society, 2016, 138, 1065-1077 |
| 4129992 | CIF | C52 H28.5 B Cl1.5 F20 O Zr | P 1 21/c 1 | 12.797; 21.5812; 17.5714 90; 93.118; 90 | 4845.6 | Metters, Owen J.; Forrest, Sebastian J. K.; Sparkes, Hazel A.; Manners, Ian; Wass, Duncan F. Small Molecule Activation by Intermolecular Zr(IV)-Phosphine Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 1994-2003 |
| 4129993 | CIF | C59 H46 B Cl F20 O Zr | P 1 21/c 1 | 14.7527; 18.8854; 19.4012 90; 93.297; 90 | 5396.43 | Metters, Owen J.; Forrest, Sebastian J. K.; Sparkes, Hazel A.; Manners, Ian; Wass, Duncan F. Small Molecule Activation by Intermolecular Zr(IV)-Phosphine Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 1994-2003 |
| 4129994 | CIF | C60 H56 B F20 O3 P Zr | P 1 21 1 | 9.9785; 31.1578; 10.1034 90; 113.626; 90 | 2877.95 | Metters, Owen J.; Forrest, Sebastian J. K.; Sparkes, Hazel A.; Manners, Ian; Wass, Duncan F. Small Molecule Activation by Intermolecular Zr(IV)-Phosphine Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 1994-2003 |
| 4129995 | CIF | C53 H34 B Cl F20 O2 Zr | P -1 | 13.3376; 13.821; 14.9684 74.9625; 66.3765; 89.8892 | 2425.17 | Metters, Owen J.; Forrest, Sebastian J. K.; Sparkes, Hazel A.; Manners, Ian; Wass, Duncan F. Small Molecule Activation by Intermolecular Zr(IV)-Phosphine Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 1994-2003 |
| 4129996 | CIF | C63 H54 B Cl F20 O2 Zr | P 1 21/n 1 | 10.6322; 31.07; 17.1127 90; 96.56; 90 | 5616 | Metters, Owen J.; Forrest, Sebastian J. K.; Sparkes, Hazel A.; Manners, Ian; Wass, Duncan F. Small Molecule Activation by Intermolecular Zr(IV)-Phosphine Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 1994-2003 |
| 4129997 | CIF | C79 H62 B F20 O P Zr | P -1 | 12.6964; 15.2765; 19.25 73.594; 74.388; 82.392 | 3443.1 | Metters, Owen J.; Forrest, Sebastian J. K.; Sparkes, Hazel A.; Manners, Ian; Wass, Duncan F. Small Molecule Activation by Intermolecular Zr(IV)-Phosphine Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 1994-2003 |
| 4129998 | CIF | C29 H31 Cl3 Fe N2 | P 1 21/n 1 | 13.4486; 10.8936; 18.8713 90; 94.695; 90 | 2755.4 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4129999 | CIF | C41 H47 Cl3 F Fe N3 | P 1 21/c 1 | 12.1706; 16.847; 19.035 90; 93.66; 90 | 3894.9 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130000 | CIF | C57 H56 Cl6 F6 Fe2 N5 | P -1 | 12.748; 13.0508; 19.9343 96.724; 96.731; 113.915 | 2961 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130001 | CIF | C65 H63 Cl6 F12 Fe2 N6 | P 1 21/c 1 | 13.6061; 31.1222; 17.3548 90; 103.397; 90 | 7148.9 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130002 | CIF | C32.5 H32.5 Cl2 F6 Fe N3 | C 1 2/c 1 | 22.108; 11.9657; 25.005 90; 90; 90 | 6614.8 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130003 | CIF | C37 H35 Cl3 F6 Fe N3 | P -1 | 12.267; 12.613; 13.807 76.462; 82.7; 71.185 | 1962.8 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130004 | CIF | C23 H25 Cl4 Fe N2 | C 1 c 1 | 15.064; 17.537; 11.077 90; 126.613; 90 | 2348.9 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130005 | CIF | C39 H33 Cl2 F12 Fe N4 | P -1 | 11.6153; 11.8003; 16.1066 73.913; 88.916; 85.031 | 2113.2 | Iovan, Diana A.; Betley, Theodore A. Characterization of Iron-Imido Species Relevant for N-Group Transfer Chemistry. Journal of the American Chemical Society, 2016, 138, 1983-1993 |
| 4130006 | CIF | C80 H178 Cs2 O26 S2 Si6 U2 | P -1 | 13.793; 15.003; 17.037 110.736; 109.193; 94.824 | 3032.6 | Chatelain, Lucile; Scopelliti, Rosario; Mazzanti, Marinella Synthesis and Structure of Nitride-Bridged Uranium(III) Complexes. Journal of the American Chemical Society, 2016, 138, 1784-1787 |
| 4130007 | CIF | C80 H178 Cs2 N O26 Si6 U2 | P 1 21/n 1 | 14.155; 29.331; 27.558 90; 91.061; 90 | 11440 | Chatelain, Lucile; Scopelliti, Rosario; Mazzanti, Marinella Synthesis and Structure of Nitride-Bridged Uranium(III) Complexes. Journal of the American Chemical Society, 2016, 138, 1784-1787 |
| 4130008 | CIF | C72 H162 Cs3 N O24 Si6 U2 | P n n 2 | 14.215; 17.0473; 24.193 90; 90; 90 | 5862.6 | Chatelain, Lucile; Scopelliti, Rosario; Mazzanti, Marinella Synthesis and Structure of Nitride-Bridged Uranium(III) Complexes. Journal of the American Chemical Society, 2016, 138, 1784-1787 |
| 4130009 | CIF | C140 H158 N10 O4 Si4 | P -1 | 10.949; 14.788; 19.821 96.298; 93.114; 100.111 | 3131.5 | Endres, Alexander H.; Schaffroth, Manuel; Paulus, Fabian; Reiss, Hilmar; Wadepohl, Hubert; Rominger, Frank; Krämer, Roland; Bunz, Uwe H. F. Coronene-Containing N-Heteroarenes: 13 Rings in a Row. Journal of the American Chemical Society, 2016, 138, 1792-1795 |
| 4130010 | CIF | C134 H144 Cl18 N10 O4 Si4 | P -1 | 10.9819; 14.4594; 21.1642 87.3478; 88.199; 86.441 | 3349.25 | Endres, Alexander H.; Schaffroth, Manuel; Paulus, Fabian; Reiss, Hilmar; Wadepohl, Hubert; Rominger, Frank; Krämer, Roland; Bunz, Uwe H. F. Coronene-Containing N-Heteroarenes: 13 Rings in a Row. Journal of the American Chemical Society, 2016, 138, 1792-1795 |
| 4130011 | CIF | C140 H182 N10 O18 Si4 | P -1 | 8.16795; 17.8145; 23.4233 79.0943; 89.6706; 77.4838 | 3264.98 | Endres, Alexander H.; Schaffroth, Manuel; Paulus, Fabian; Reiss, Hilmar; Wadepohl, Hubert; Rominger, Frank; Krämer, Roland; Bunz, Uwe H. F. Coronene-Containing N-Heteroarenes: 13 Rings in a Row. Journal of the American Chemical Society, 2016, 138, 1792-1795 |
| 4130012 | CIF | C37 H62 Co N6 O2 | P 1 21/n 1 | 11.15; 16.151; 22.239 90; 104.421; 90 | 3879 | Corcos, Amanda R.; Villanueva, Omar; Walroth, Richard C.; Sharma, Savita K.; Bacsa, John; Lancaster, Kyle M.; MacBeth, Cora E.; Berry, John F. Oxygen Activation by Co(II) and a Redox Non-Innocent Ligand: Spectroscopic Characterization of a Radical-Co(II)-Superoxide Complex with Divergent Catalytic Reactivity. Journal of the American Chemical Society, 2016, 138, 1796-1799 |
| 4130013 | CIF | C279 H178 Ag28 Au34 | P 1 21/c 1 | 36.8939; 22.066; 39.9832 90; 102.216; 90 | 31813.3 | Wang, Yu; Wan, Xian-Kai; Ren, Liting; Su, Haifeng; Li, Gang; Malola, Sami; Lin, Shuichao; Tang, Zichao; Häkkinen, Hannu; Teo, Boon K.; Wang, Quan-Ming; Zheng, Nanfeng Atomically Precise Alkynyl-Protected Metal Nanoclusters as a Model Catalyst: Observation of Promoting Effect of Surface Ligands on Catalysis by Metal Nanoparticles. Journal of the American Chemical Society, 2016, 138, 3278-3281 |
| 4130014 | CIF | C24 H21 B F4 Fe N5 O S | P b c a | 11.72284; 14.8569; 28.5647 90; 90; 90 | 4974.97 | McQuilken, Alison C.; Matsumura, Hirotoshi; Dürr, Maximilian; Confer, Alex M.; Sheckelton, John P.; Siegler, Maxime A.; McQueen, Tyrel M.; Ivanović-Burmazović, Ivana; Moënne-Loccoz, Pierre; Goldberg, David P. Photoinitiated Reactivity of a Thiolate-Ligated, Spin-Crossover Nonheme {FeNO}(7) Complex with Dioxygen. Journal of the American Chemical Society, 2016, 138, 3107-3117 |
| 4130015 | CIF | C89 H67 F12 N11 O6 P2 Ru | P -1 | 14.701; 14.717; 22.163 73.645; 72.336; 62.544 | 3997 | Nakamura, Takashi; Kimura, Hikaru; Okuhara, Takashi; Yamamura, Masaki; Nabeshima, Tatsuya A Hierarchical Self-Assembly System Built Up from Preorganized Tripodal Helical Metal Complexes. Journal of the American Chemical Society, 2016, 138, 794-797 |
| 4130016 | CIF | C8 H10 Cu N6 O7 | I m a 2 | 13.6081; 9.9487; 9.4287 90; 90; 90 | 1276.48 | Dos Santos, Leonardo H. R.; Lanza, Arianna; Barton, Alyssa M.; Brambleby, Jamie; Blackmore, William J. A.; Goddard, Paul A.; Xiao, Fan; Williams, Robert C.; Lancaster, Tom; Pratt, Francis L.; Blundell, Stephen J.; Singleton, John; Manson, Jamie L.; Macchi, Piero Experimental and Theoretical Electron Density Analysis of Copper Pyrazine Nitrate Quasi-Low-Dimensional Quantum Magnets. Journal of the American Chemical Society, 2016, 138, 2280-2291 |
| 4130017 | CIF | C4 H4 Cu N4 O6 | P m n a | 6.70122; 5.11854; 11.63508 90; 90; 90 | 399.089 | Dos Santos, Leonardo H. R.; Lanza, Arianna; Barton, Alyssa M.; Brambleby, Jamie; Blackmore, William J. A.; Goddard, Paul A.; Xiao, Fan; Williams, Robert C.; Lancaster, Tom; Pratt, Francis L.; Blundell, Stephen J.; Singleton, John; Manson, Jamie L.; Macchi, Piero Experimental and Theoretical Electron Density Analysis of Copper Pyrazine Nitrate Quasi-Low-Dimensional Quantum Magnets. Journal of the American Chemical Society, 2016, 138, 2280-2291 |
| 4130018 | CIF | C20 H8 B F5 O2 | P 1 21/c 1 | 7.047; 14.854; 15.221 90; 97.455; 90 | 1579.8 | Longobardi, Lauren E.; Liu, Lei; Grimme, Stefan; Stephan, Douglas W. Stable Borocyclic Radicals via Frustrated Lewis Pair Hydrogenations. Journal of the American Chemical Society, 2016, 138, 2500-2503 |
| 4130019 | CIF | C26 H8 B F10 O2 | P 1 21/c 1 | 13.1089; 23.2919; 14.0746 90; 99.583; 90 | 4237.4 | Longobardi, Lauren E.; Liu, Lei; Grimme, Stefan; Stephan, Douglas W. Stable Borocyclic Radicals via Frustrated Lewis Pair Hydrogenations. Journal of the American Chemical Society, 2016, 138, 2500-2503 |
| 4130020 | CIF | C46 H38 B Co F10 O2 | P 1 21/c 1 | 11.0423; 16.9039; 21.2807 90; 97.057; 90 | 3942.1 | Longobardi, Lauren E.; Liu, Lei; Grimme, Stefan; Stephan, Douglas W. Stable Borocyclic Radicals via Frustrated Lewis Pair Hydrogenations. Journal of the American Chemical Society, 2016, 138, 2500-2503 |
| 4130021 | CIF | C38 H18 B Co F10 O2 | C 1 2/c 1 | 25.3133; 15.9662; 16.4 90; 117.857; 90 | 5860.1 | Longobardi, Lauren E.; Liu, Lei; Grimme, Stefan; Stephan, Douglas W. Stable Borocyclic Radicals via Frustrated Lewis Pair Hydrogenations. Journal of the American Chemical Society, 2016, 138, 2500-2503 |
| 4130022 | CIF | C28.5 H9 B Cl F10 O2 | P b c n | 17.3619; 20.3198; 13.4759 90; 90; 90 | 4754.2 | Longobardi, Lauren E.; Liu, Lei; Grimme, Stefan; Stephan, Douglas W. Stable Borocyclic Radicals via Frustrated Lewis Pair Hydrogenations. Journal of the American Chemical Society, 2016, 138, 2500-2503 |
| 4130023 | CIF | C33 H10 B Cl2 F15 O2 | P -1 | 10.9016; 11.8469; 11.8554 84.408; 80.506; 88.459 | 1502.9 | Longobardi, Lauren E.; Liu, Lei; Grimme, Stefan; Stephan, Douglas W. Stable Borocyclic Radicals via Frustrated Lewis Pair Hydrogenations. Journal of the American Chemical Society, 2016, 138, 2500-2503 |
| 4130024 | CIF | C59.8 H66.2 Cl3 N4 Ni O | I 41/a :2 | 26.8014; 26.8014; 30.1916 90; 90; 90 | 21687 | Martinez, Gabriel Espinosa; Ocampo, Cristian; Park, Yun Ji; Fout, Alison R. Accessing Pincer Bis(carbene) Ni(IV) Complexes from Ni(II) via Halogen and Halogen Surrogates. Journal of the American Chemical Society, 2016, 138, 4290-4293 |
| 4130025 | CIF | C44 H45 Br N4 Ni | P -1 | 8.6747; 13.9513; 16.8043 111.461; 101.546; 97.071 | 1810.91 | Martinez, Gabriel Espinosa; Ocampo, Cristian; Park, Yun Ji; Fout, Alison R. Accessing Pincer Bis(carbene) Ni(IV) Complexes from Ni(II) via Halogen and Halogen Surrogates. Journal of the American Chemical Society, 2016, 138, 4290-4293 |
| 4130026 | CIF | C44 H45 Br3 N4 Ni | P 1 21/n 1 | 13.3193; 18.921; 15.612 90; 90.851; 90 | 3934 | Martinez, Gabriel Espinosa; Ocampo, Cristian; Park, Yun Ji; Fout, Alison R. Accessing Pincer Bis(carbene) Ni(IV) Complexes from Ni(II) via Halogen and Halogen Surrogates. Journal of the American Chemical Society, 2016, 138, 4290-4293 |
| 4130027 | CIF | C15 H22 N2 O4 Pd S2 | P 1 21/c 1 | 9.294; 11.7682; 16.3112 90; 90.1712; 90 | 1784 | Sberegaeva, Anna V.; Zavalij, Peter Y.; Vedernikov, Andrei N. Oxidation of a Monomethylpalladium(II) Complex with O2 in Water: Tuning Reaction Selectivity to Form Ethane, Methanol, or Methylhydroperoxide. Journal of the American Chemical Society, 2016, 138, 1446-1455 |
| 4130028 | CIF | C16 H16 N2 O5 S | P 21 21 21 | 8.7745; 10.2125; 17.6501 90; 90; 90 | 1581.62 | Moreno, Jesus; Picazo, Elias; Morrill, Lucas A.; Smith, Joel M.; Garg, Neil K. Enantioselective Total Syntheses of Akuammiline Alkaloids (+)-Strictamine, (-)-2(S)-Cathafoline, and (-)-Aspidophylline A. Journal of the American Chemical Society, 2016, 138, 1162-1165 |
| 4130029 | CIF | C45 H29 N4 O15 Zn | P 1 21/n 1 | 11.7654; 10.6457; 29.5927 90; 97.818; 90 | 3672.1 | Zeng, Le; Liu, Tao; He, Cheng; Shi, Dongying; Zhang, Feili; Duan, Chunying Organized Aggregation Makes Insoluble Perylene Diimide Efficient for the Reduction of Aryl Halides via Consecutive Visible Light-Induced Electron-Transfer Processes. Journal of the American Chemical Society, 2016, 138, 3958-3961 |
| 4130030 | CIF | C44 H32 Cl2 F12 Rh2 | C 1 2 1 | 22.5853; 18.2181; 22.6199 90; 101.533; 90 | 9119.3 | Chen, Diao; Zhu, Dong-Xing; Xu, Ming-Hua Rhodium(I)-Catalyzed Highly Enantioselective Insertion of Carbenoid into Si-H: Efficient Access to Functional Chiral Silanes. Journal of the American Chemical Society, 2016, 138, 1498-1501 |
| 4130031 | CIF | C21 H22 B O4.5 | P 1 21/n 1 | 19.7607; 10.0627; 20.2687 90; 114.396; 90 | 3670.5 | Faizi, Darius J.; Issaian, Adena; Davis, Ashlee J.; Blum, Suzanne A. Catalyst-Free Synthesis of Borylated Lactones from Esters via Electrophilic Oxyboration. Journal of the American Chemical Society, 2016, 138, 2126-2129 |
| 4130032 | CIF | C22 H19 N3 O2 | P 1 21/c 1 | 22.185; 5.4792; 15.545 90; 108.489; 90 | 1792.1 | Hong, Miao; Tang, Xiaoyan; Falivene, Laura; Caporaso, Lucia; Cavallo, Luigi; Chen, Eugene Y.-X. Proton-Transfer Polymerization by N-Heterocyclic Carbenes: Monomer and Catalyst Scopes and Mechanism for Converting Dimethacrylates into Unsaturated Polyesters. Journal of the American Chemical Society, 2016, 138, 2021-2035 |
| 4130033 | CIF | C23 H23 N3 O3 | P 1 21 1 | 10.2142; 18.8081; 10.5146 90; 90.0144; 90 | 2019.96 | Hong, Miao; Tang, Xiaoyan; Falivene, Laura; Caporaso, Lucia; Cavallo, Luigi; Chen, Eugene Y.-X. Proton-Transfer Polymerization by N-Heterocyclic Carbenes: Monomer and Catalyst Scopes and Mechanism for Converting Dimethacrylates into Unsaturated Polyesters. Journal of the American Chemical Society, 2016, 138, 2021-2035 |
| 4130034 | CIF | C33 H37 N O5 | P 1 21 1 | 10.6171; 14.0098; 18.6989 90; 94.495; 90 | 2772.78 | Liu, Chun; Oblak, E. Zachary; Vander Wal, Mark N.; Dilger, Andrew K.; Almstead, Danielle K.; MacMillan, David W. C. Oxy-Allyl Cation Catalysis: An Enantioselective Electrophilic Activation Mode. Journal of the American Chemical Society, 2016, 138, 2134-2137 |
| 4130035 | CIF | C21 H20 Br N O2 | I 1 2 1 | 22.756; 5.9048; 27.03 90; 95.999; 90 | 3612.1 | Liu, Chun; Oblak, E. Zachary; Vander Wal, Mark N.; Dilger, Andrew K.; Almstead, Danielle K.; MacMillan, David W. C. Oxy-Allyl Cation Catalysis: An Enantioselective Electrophilic Activation Mode. Journal of the American Chemical Society, 2016, 138, 2134-2137 |
| 4130036 | CIF | C18 H17 I O4 | P 1 21/c 1 | 9.27; 7.881; 22.818 90; 99.868; 90 | 1642.3 | Jia, Kunfang; Zhang, Fuyuan; Huang, Hanchu; Chen, Yiyun Visible-Light-Induced Alkoxyl Radical Generation Enables Selective C(sp(3))-C(sp(3)) Bond Cleavage and Functionalizations. Journal of the American Chemical Society, 2016, 138, 1514-1517 |
| 4130037 | CIF | C150 H296 O25.5 P12 Pd55 | C 1 2/c 1 | 31.0979; 20.9092; 32.2003 90; 98.199; 90 | 20723.7 | Erickson, Jeremiah D.; Mednikov, Evgueni G.; Ivanov, Sergei A.; Dahl, Lawrence F. Isolation and Structural Characterization of a Mackay 55-Metal-Atom Two-Shell Icosahedron of Pseudo-Ih Symmetry, Pd55L12(μ3-CO)20 (L = PR3, R = Isopropyl): Comparative Analysis with Interior Two-Shell Icosahedral Geometries in Capped Three-Shell Pd145, Pt-Centered Four-Shell Pd-Pt M165, and Four-Shell Au133 Nanoclusters. Journal of the American Chemical Society, 2016, 138, 1502-1505 |
| 4130038 | CIF | C134 H266 O21 P12 Pd55 | P 1 21/n 1 | 19.1528; 25.4979; 19.907 90; 93.43; 90 | 9704.3 | Erickson, Jeremiah D.; Mednikov, Evgueni G.; Ivanov, Sergei A.; Dahl, Lawrence F. Isolation and Structural Characterization of a Mackay 55-Metal-Atom Two-Shell Icosahedron of Pseudo-Ih Symmetry, Pd55L12(μ3-CO)20 (L = PR3, R = Isopropyl): Comparative Analysis with Interior Two-Shell Icosahedral Geometries in Capped Three-Shell Pd145, Pt-Centered Four-Shell Pd-Pt M165, and Four-Shell Au133 Nanoclusters. Journal of the American Chemical Society, 2016, 138, 1502-1505 |
| 4130039 | CIF | C26 H47 N6 O2 P | P 1 21/c 1 | 15.1689; 9.4736; 20.5469 90; 102.81; 90 | 2879.19 | Buß, Florenz; Mehlmann, Paul; Mück-Lichtenfeld, Christian; Bergander, Klaus; Dielmann, Fabian Reversible Carbon Dioxide Binding by Simple Lewis Base Adducts with Electron-Rich Phosphines. Journal of the American Chemical Society, 2016, 138, 1840-1843 |
| 4130040 | CIF | C25 H47 N6 P | C 1 c 1 | 18.29; 11.5237; 13.3929 90; 109.359; 90 | 2663.2 | Buß, Florenz; Mehlmann, Paul; Mück-Lichtenfeld, Christian; Bergander, Klaus; Dielmann, Fabian Reversible Carbon Dioxide Binding by Simple Lewis Base Adducts with Electron-Rich Phosphines. Journal of the American Chemical Society, 2016, 138, 1840-1843 |
| 4130041 | CIF | C25 H47 Au Cl N6 P | P 1 21/n 1 | 17.3449; 9.8012; 17.5758 90; 96.5693; 90 | 2968.28 | Buß, Florenz; Mehlmann, Paul; Mück-Lichtenfeld, Christian; Bergander, Klaus; Dielmann, Fabian Reversible Carbon Dioxide Binding by Simple Lewis Base Adducts with Electron-Rich Phosphines. Journal of the American Chemical Society, 2016, 138, 1840-1843 |
| 4130042 | CIF | C50 H94 Cl4 N12 P2 Pd2 | P -1 | 10.7627; 11.3637; 14.0991 70.7991; 70.3104; 88.7659 | 1525.49 | Buß, Florenz; Mehlmann, Paul; Mück-Lichtenfeld, Christian; Bergander, Klaus; Dielmann, Fabian Reversible Carbon Dioxide Binding by Simple Lewis Base Adducts with Electron-Rich Phosphines. Journal of the American Chemical Society, 2016, 138, 1840-1843 |
| 4130043 | CIF | C25 H42 Mn N O2 P2 | P b c a | 11.723; 16.048; 28.56 90; 90; 90 | 5373 | Nerush, Alexander; Vogt, Matthias; Gellrich, Urs; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Template Catalysis by Metal-Ligand Cooperation. C-C Bond Formation via Conjugate Addition of Non-activated Nitriles under Mild, Base-free Conditions Catalyzed by a Manganese Pincer Complex. Journal of the American Chemical Society, 2016, 138, 6985-6997 |
| 4130044 | CIF | C37 H57 Mn N2 O3 P2 | P -1 | 11.956; 12.902; 13.4 116.17; 91.63; 98.83 | 1822.4 | Nerush, Alexander; Vogt, Matthias; Gellrich, Urs; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Template Catalysis by Metal-Ligand Cooperation. C-C Bond Formation via Conjugate Addition of Non-activated Nitriles under Mild, Base-free Conditions Catalyzed by a Manganese Pincer Complex. Journal of the American Chemical Society, 2016, 138, 6985-6997 |
| 4130045 | CIF | C408 H357 In37 O102 P20 | P -1 | 24.2059; 25.05; 42.793 94.394; 91.966; 115.651 | 23256 | Gary, Dylan C.; Flowers, Sarah E.; Kaminsky, Werner; Petrone, Alessio; Li, Xiaosong; Cossairt, Brandi M. Single-Crystal and Electronic Structure of a 1.3 nm Indium Phosphide Nanocluster. Journal of the American Chemical Society, 2016, 138, 1510-1513 |
| 4130046 | CIF | C408 H359 In37 O103 P20 | P -1 | 23.5228; 24.1862; 43.037 84.905; 88.006; 63.079 | 21744.9 | Gary, Dylan C.; Flowers, Sarah E.; Kaminsky, Werner; Petrone, Alessio; Li, Xiaosong; Cossairt, Brandi M. Single-Crystal and Electronic Structure of a 1.3 nm Indium Phosphide Nanocluster. Journal of the American Chemical Society, 2016, 138, 1510-1513 |
| 4130047 | CIF | C22 H20 N2 O | P c a 21 | 22.245; 9.3234; 8.4228 90; 90; 90 | 1746.9 | Paul, Mathias; Breugst, Martin; Neudörfl, Jörg-Martin; Sunoj, Raghavan B.; Berkessel, Albrecht Keto-Enol Thermodynamics of Breslow Intermediates. Journal of the American Chemical Society, 2016, 138, 5044-5051 |
| 4130048 | CIF | C8 H7 Br O3 | P c c 2 | 7.5391; 19.828; 5.4014 90; 90; 90 | 807.43 | Paul, Mathias; Breugst, Martin; Neudörfl, Jörg-Martin; Sunoj, Raghavan B.; Berkessel, Albrecht Keto-Enol Thermodynamics of Breslow Intermediates. Journal of the American Chemical Society, 2016, 138, 5044-5051 |
| 4130049 | CIF | C39 H27 N O3 | P -1 | 8.5877; 12.6416; 14.4046 109.408; 101.699; 100.565 | 1390.1 | Mondal, Bijnaneswar; Acharyya, Koushik; Howlader, Prodip; Mukherjee, Partha Sarathi Molecular Cage Impregnated Palladium Nanoparticles: Efficient, Additive-Free Heterogeneous Catalysts for Cyanation of Aryl Halides. Journal of the American Chemical Society, 2016, 138, 1709-1716 |
| 4130050 | CIF | C65 H38 Cu4 N12 O20 | C 2 2 2 | 46.0575; 20.9442; 14.1001 90; 90; 90 | 13601.5 | Li, Pei-Zhou; Wang, Xiao-Jun; Liu, Jia; Lim, Jie Sheng; Zou, Ruqiang; Zhao, Yanli A Triazole-Containing Metal-Organic Framework as a Highly Effective and Substrate Size-Dependent Catalyst for CO2 Conversion. Journal of the American Chemical Society, 2016, 138, 2142-2145 |
| 4130051 | CIF | C28 H28 Br N Si | P 1 21 1 | 5.8781; 10.3144; 21.1393 90; 94.3996; 90 | 1277.88 | Paioti, Paulo H. S.; Abboud, Khalil A.; Aponick, Aaron Catalytic Enantioselective Synthesis of Amino Skipped Diynes. Journal of the American Chemical Society, 2016, 138, 2150-2153 |
| 4130052 | CIF | C17 H18 Cl2 Fe N2 | P n a 21 | 10.473; 22.252; 7.486 90; 90; 90 | 1745 | Thacker, Nathan C.; Lin, Zekai; Zhang, Teng; Gilhula, James C.; Abney, Carter W.; Lin, Wenbin Robust and Porous β-Diketiminate-Functionalized Metal-Organic Frameworks for Earth-Abundant-Metal-Catalyzed C-H Amination and Hydrogenation. Journal of the American Chemical Society, 2016, 138, 3501-3509 |
| 4130053 | CIF | C17 H18 Cl2 Co N2 | P n a 21 | 10.305; 22.491; 7.4571 90; 90; 90 | 1728.3 | Thacker, Nathan C.; Lin, Zekai; Zhang, Teng; Gilhula, James C.; Abney, Carter W.; Lin, Wenbin Robust and Porous β-Diketiminate-Functionalized Metal-Organic Frameworks for Earth-Abundant-Metal-Catalyzed C-H Amination and Hydrogenation. Journal of the American Chemical Society, 2016, 138, 3501-3509 |
| 4130054 | CIF | C24 H16 Ga Mg2 N3 O16 | P -4 3 n | 22.0354; 22.0354; 22.0354 90; 90; 90 | 10699.5 | Zhai, Quan-Guo; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun Systematic and Dramatic Tuning on Gas Sorption Performance in Heterometallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 2524-2527 |
| 4130055 | CIF | C24 H16 Co2 In N3 O16 | P -4 3 n | 22.2973; 22.2973; 22.2973 90; 90; 90 | 11085.5 | Zhai, Quan-Guo; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun Systematic and Dramatic Tuning on Gas Sorption Performance in Heterometallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 2524-2527 |
| 4130056 | CIF | C24 H16 In Mg2 N3 O16 | P -4 3 n | 22.3051; 22.3051; 22.3051 90; 90; 90 | 11097.2 | Zhai, Quan-Guo; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun Systematic and Dramatic Tuning on Gas Sorption Performance in Heterometallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 2524-2527 |
| 4130057 | CIF | C24 H16 In Mn2 N3 O16 | P -4 3 n | 22.4704; 22.4704; 22.4704 90; 90; 90 | 11345.7 | Zhai, Quan-Guo; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun Systematic and Dramatic Tuning on Gas Sorption Performance in Heterometallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 2524-2527 |
| 4130058 | CIF | C24 H16 In N3 Ni2 O16 | P -4 3 n | 22.1152; 22.1152; 22.1152 90; 90; 90 | 10816.2 | Zhai, Quan-Guo; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun Systematic and Dramatic Tuning on Gas Sorption Performance in Heterometallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 2524-2527 |
| 4130059 | CIF | C24 H16 Mg2 N3 O16 V | P -4 3 n | 21.9692; 21.9692; 21.9692 90; 90; 90 | 10603.3 | Zhai, Quan-Guo; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun Systematic and Dramatic Tuning on Gas Sorption Performance in Heterometallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 2524-2527 |
| 4130060 | CIF | C25 H27 N O2 | C 1 2 1 | 21.2783; 6.1728; 18.1174 90; 116.907; 90 | 2122 | Wu, Jicheng; Zhao, Changgui; Wang, Jian Enantioselective Intermolecular Enamide-Aldehyde Cross-Coupling Catalyzed by Chiral N-Heterocyclic Carbenes. Journal of the American Chemical Society, 2016, 138, 4706-4709 |
| 4130061 | CIF | C138 H149 Cl2 N2 O12 Rh2 | P 1 21/n 1 | 16.3695; 32.1947; 25.1628 90; 95.3565; 90 | 13203.2 | Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 2945-2948 |
| 4130062 | CIF | C122 H118 N2 O8 Rh2 | P -1 | 27.186; 27.8325; 33.4902 99.9773; 105.885; 117.467 | 20250 | Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 2945-2948 |
| 4130063 | CIF | C120 H114 N2 O8 Rh2 | C 1 2/c 1 | 39.8848; 17.5558; 39.2586 90; 118.601; 90 | 24134.9 | Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 2945-2948 |
| 4130064 | CIF | C116 H120 O10 Rh2 | I 41/a :2 | 20.7033; 20.7033; 43.9483 90; 90; 90 | 18837.4 | Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 2945-2948 |
| 4130065 | CIF | C127 H137 Cl3 N4 O9 Rh2 | P 1 21/c 1 | 17.3805; 25.1289; 25.2907 90; 98.602; 90 | 10921.5 | Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 2945-2948 |
| 4130066 | CIF | C126 H130 N2 O10 Rh2 | P 21 21 21 | 18.3091; 21.6571; 27.5325 90; 90; 90 | 10917.2 | Sanada, Kazuma; Ube, Hitoshi; Shionoya, Mitsuhiko Rotational Control of a Dirhodium-Centered Supramolecular Four-Gear System by Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 2945-2948 |
| 4130067 | CIF | C32 H50 Mn N O3 P2 | P 1 21/c 1 | 13.1263; 12.6361; 19.5781 90; 100.158; 90 | 3196.4 | Mukherjee, Arup; Nerush, Alexander; Leitus, Gregory; Shimon, Linda J. W.; Ben David, Yehoshoa; Espinosa Jalapa, Noel Angel; Milstein, David Manganese-Catalyzed Environmentally Benign Dehydrogenative Coupling of Alcohols and Amines to Form Aldimines and H2: A Catalytic and Mechanistic Study. Journal of the American Chemical Society, 2016, 138, 4298-4301 |
| 4130068 | CIF | C32 H48 Mn N O3 P2 | P -1 | 8.6891; 10.049; 18.36 91.73; 92.06; 103.07 | 1559.4 | Mukherjee, Arup; Nerush, Alexander; Leitus, Gregory; Shimon, Linda J. W.; Ben David, Yehoshoa; Espinosa Jalapa, Noel Angel; Milstein, David Manganese-Catalyzed Environmentally Benign Dehydrogenative Coupling of Alcohols and Amines to Form Aldimines and H2: A Catalytic and Mechanistic Study. Journal of the American Chemical Society, 2016, 138, 4298-4301 |
| 4130069 | CIF | C25 H44 Mn N O2 P2 | P 21 21 21 | 11.819; 14.961; 15.364 90; 90; 90 | 2716.7 | Mukherjee, Arup; Nerush, Alexander; Leitus, Gregory; Shimon, Linda J. W.; Ben David, Yehoshoa; Espinosa Jalapa, Noel Angel; Milstein, David Manganese-Catalyzed Environmentally Benign Dehydrogenative Coupling of Alcohols and Amines to Form Aldimines and H2: A Catalytic and Mechanistic Study. Journal of the American Chemical Society, 2016, 138, 4298-4301 |
| 4130070 | CIF | C22 H21 Cl N6 O3 | P -1 | 8.8088; 9.7607; 13.1099 88.133; 78.48; 84.582 | 1099.44 | 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 |
| 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 |
| 4130072 | CIF | C34 H50 B N4 O0.58 P | P 21 21 21 | 11.8285; 11.8866; 22.494 90; 90; 90 | 3162.7 | Mummadi, Suresh; Unruh, Daniel K.; Zhao, Jiyang; Li, Shuhua; Krempner, Clemens "Inverse" Frustrated Lewis Pairs‒Activation of Dihydrogen with Organosuperbases and Moderate to Weak Lewis Acids. Journal of the American Chemical Society, 2016, 138, 3286-3289 |
| 4130073 | CIF | C37 H58 B D3 N4 P | P -1 | 9.063; 12.103; 18.177 101.964; 92.065; 108.926 | 1834 | Mummadi, Suresh; Unruh, Daniel K.; Zhao, Jiyang; Li, Shuhua; Krempner, Clemens "Inverse" Frustrated Lewis Pairs‒Activation of Dihydrogen with Organosuperbases and Moderate to Weak Lewis Acids. Journal of the American Chemical Society, 2016, 138, 3286-3289 |
| 4130074 | CIF | C33 H50 B N4 P | P -3 | 11.0056; 11.0056; 15.0573 90; 90; 120 | 1579.4 | Mummadi, Suresh; Unruh, Daniel K.; Zhao, Jiyang; Li, Shuhua; Krempner, Clemens "Inverse" Frustrated Lewis Pairs‒Activation of Dihydrogen with Organosuperbases and Moderate to Weak Lewis Acids. Journal of the American Chemical Society, 2016, 138, 3286-3289 |
| 4130075 | CIF | C26.45 H57.09 B N4 O0.86 P | P 21 3 | 14.2996; 14.2996; 14.2996 90; 90; 90 | 2924 | Mummadi, Suresh; Unruh, Daniel K.; Zhao, Jiyang; Li, Shuhua; Krempner, Clemens "Inverse" Frustrated Lewis Pairs‒Activation of Dihydrogen with Organosuperbases and Moderate to Weak Lewis Acids. Journal of the American Chemical Society, 2016, 138, 3286-3289 |
| 4130076 | CIF | C42 H50 O5 W | P -1 | 10.6056; 11.5564; 15.585 82.8305; 83.6334; 83.687 | 1874.5 | Gonsales, Stella A.; Kubo, Tomohiro; Flint, Madison K.; Abboud, Khalil A.; Sumerlin, Brent S.; Veige, Adam S. Highly Tactic Cyclic Polynorbornene: Stereoselective Ring Expansion Metathesis Polymerization of Norbornene Catalyzed by a New Tethered Tungsten-Alkylidene Catalyst. Journal of the American Chemical Society, 2016, 138, 4996-4999 |
| 4130077 | CIF | C62 H72 O6 W2 | P 1 21/n 1 | 15.3264; 18.753; 18.9589 90; 103.362; 90 | 5301.6 | Gonsales, Stella A.; Kubo, Tomohiro; Flint, Madison K.; Abboud, Khalil A.; Sumerlin, Brent S.; Veige, Adam S. Highly Tactic Cyclic Polynorbornene: Stereoselective Ring Expansion Metathesis Polymerization of Norbornene Catalyzed by a New Tethered Tungsten-Alkylidene Catalyst. Journal of the American Chemical Society, 2016, 138, 4996-4999 |
| 4130078 | CIF | C19 H23 N3 Ni | I 41/a :2 | 28.4649; 28.4649; 17.3837 90; 90; 90 | 14085.2 | Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning Bimetallic C-C Bond-Forming Reductive Elimination from Nickel. Journal of the American Chemical Society, 2016, 138, 4779-4786 |
| 4130079 | CIF | C16 H18 N2 Ni O2 | P 1 21/c 1 | 17.2307; 12.1517; 14.5044 90; 104.451; 90 | 2940.9 | Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning Bimetallic C-C Bond-Forming Reductive Elimination from Nickel. Journal of the American Chemical Society, 2016, 138, 4779-4786 |
| 4130080 | CIF | C26 H22 N2 Ni O2 | P -1 | 8.765; 11.0263; 11.2797 94.9041; 104.468; 93.8012 | 1047.3 | Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning Bimetallic C-C Bond-Forming Reductive Elimination from Nickel. Journal of the American Chemical Society, 2016, 138, 4779-4786 |
| 4130081 | CIF | C39 H41 N3 Ni | P 1 21/n 1 | 17.304; 11.1832; 18.209 90; 114.263; 90 | 3212.4 | Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning Bimetallic C-C Bond-Forming Reductive Elimination from Nickel. Journal of the American Chemical Society, 2016, 138, 4779-4786 |
| 4130082 | CIF | C34 H36 N4 Ni | P 1 21/n 1 | 12.3392; 15.9041; 14.8784 90; 103.314; 90 | 2841.3 | Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning Bimetallic C-C Bond-Forming Reductive Elimination from Nickel. Journal of the American Chemical Society, 2016, 138, 4779-4786 |
| 4130083 | CIF | C32 H30 N6 Ni | P 1 21/n 1 | 10.695; 15.081; 33.05 90; 99.27; 90 | 5261 | Xu, Hongwei; Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Zhang, Yingkai; Diao, Tianning Bimetallic C-C Bond-Forming Reductive Elimination from Nickel. Journal of the American Chemical Society, 2016, 138, 4779-4786 |
| 4130084 | CIF | C25 H35 Al N2 | C 1 2/c 1 | 15.382; 7.1655; 21.607 90; 90.107; 90 | 2381.5 | Yang, Zhi; Zhong, Mingdong; Ma, Xiaoli; Nijesh, Karikkeeriyil; De, Susmita; Parameswaran, Pattiyil; Roesky, Herbert W. An Aluminum Dihydride Working as a Catalyst in Hydroboration and Dehydrocoupling. Journal of the American Chemical Society, 2016, 138, 2548-2551 |
| 4130085 | CIF | C27 H28 N4 O4 | P b c a | 8.8093; 18.443; 31.202 90; 90; 90 | 5069.4 | Dai, Jianxin; Wang, Minyan; Chai, Guobi; Fu, Chunling; Ma, Shengming A Practical Solution to Stereodefined Tetrasubstituted Olefins. Journal of the American Chemical Society, 2016, 138, 2532-2535 |
| 4130086 | CIF | C14 H26 F4 N4 O2 Zn | C 1 2/c 1 | 18.0565; 9.8443; 13.4192 90; 128.544; 90 | 1865.6 | Xu, Long; Vicic, David A. Direct Difluoromethylation of Aryl Halides via Base Metal Catalysis at Room Temperature. Journal of the American Chemical Society, 2016, 138, 2536-2539 |
| 4130087 | CIF | C26 H32 F2 N2 Ni | P 1 21/c 1 | 8.3717; 18.9906; 12.6955 90; 101.361; 90 | 1978.8 | Xu, Long; Vicic, David A. Direct Difluoromethylation of Aryl Halides via Base Metal Catalysis at Room Temperature. Journal of the American Chemical Society, 2016, 138, 2536-2539 |
| 4130088 | CIF | C58 H84 Si5 | C 1 2/c 1 | 19.681; 11.242; 24.5359 90; 90.623; 90 | 5428 | Shintani, Ryo; Iino, Ryo; Nozaki, Kyoko Rhodium-Catalyzed Stitching Reaction: Convergent Synthesis of Quinoidal Fused Oligosiloles. Journal of the American Chemical Society, 2016, 138, 3635-3638 |
| 4130089 | CIF | C26 H28 Si | P 1 21/n 1 | 8.4888; 14.564; 17.222 90; 95.98; 90 | 2117.6 | Shintani, Ryo; Iino, Ryo; Nozaki, Kyoko Rhodium-Catalyzed Stitching Reaction: Convergent Synthesis of Quinoidal Fused Oligosiloles. Journal of the American Chemical Society, 2016, 138, 3635-3638 |
| 4130090 | CIF | C42 H56 Si3 | C 1 2/c 1 | 20.217; 10.913; 17.757 90; 102.872; 90 | 3819.2 | Shintani, Ryo; Iino, Ryo; Nozaki, Kyoko Rhodium-Catalyzed Stitching Reaction: Convergent Synthesis of Quinoidal Fused Oligosiloles. Journal of the American Chemical Society, 2016, 138, 3635-3638 |
| 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 |
| 4130092 | CIF | C9 H8 F3 N O2 | P b c n | 24.3659; 10.1608; 7.6406 90; 90; 90 | 1891.64 | Nagamani, Chikkannagari; Liu, Huiying; Moore, Jeffrey S. Mechanogeneration of Acid from Oxime Sulfonates. Journal of the American Chemical Society, 2016, 138, 2540-2543 |
| 4130093 | CIF | C24 H18 F6 N2 O8 S2 | P -1 | 9.1636; 11.8078; 25.3656 95.096; 100.04; 90.1 | 2691.5 | Nagamani, Chikkannagari; Liu, Huiying; Moore, Jeffrey S. Mechanogeneration of Acid from Oxime Sulfonates. Journal of the American Chemical Society, 2016, 138, 2540-2543 |
| 4130094 | CIF | C18 H22 F5 N O3 | P 61 | 9.8252; 9.8252; 34.0247 90; 90; 120 | 2844.51 | Mahender Reddy, Karla; Bhimireddy, Eswar; Thirupathi, Barla; Breitler, Simon; Yu, Shunming; Corey, E. J. Cationic Chiral Fluorinated Oxazaborolidines. More Potent, Second-Generation Catalysts for Highly Enantioselective Cycloaddition Reactions. Journal of the American Chemical Society, 2016, 138, 2443-2453 |
| 4130095 | CIF | C19 H22 Fe N2 O | P 21 21 21 | 8.4957; 13.2816; 14.4218 90; 90; 90 | 1627.3 | Gao, De-Wei; Gu, Qing; You, Shu-Li An Enantioselective Oxidative C-H/C-H Cross-Coupling Reaction: Highly Efficient Method To Prepare Planar Chiral Ferrocenes. Journal of the American Chemical Society, 2016, 138, 2544-2547 |
| 4130096 | CIF | C23 H22 Cl Fe N S | P 1 21 1 | 6.883; 10.729; 27.388 90; 95.788; 90 | 2012 | Gao, De-Wei; Gu, Qing; You, Shu-Li An Enantioselective Oxidative C-H/C-H Cross-Coupling Reaction: Highly Efficient Method To Prepare Planar Chiral Ferrocenes. Journal of the American Chemical Society, 2016, 138, 2544-2547 |
| 4130097 | CIF | C36 H56 B2 F8 N6 | P 21 21 21 | 9.3232; 9.8579; 43.235 90; 90; 90 | 3973.6 | Dong, Shunxi; Frings, Marcus; Cheng, Hanchao; Wen, Jian; Zhang, Duo; Raabe, Gerhard; Bolm, Carsten Organocatalytic Kinetic Resolution of Sulfoximines. Journal of the American Chemical Society, 2016, 138, 2166-2169 |
| 4130098 | CIF | C23 H44 Ir N P2 | P 42 n m | 11.527; 11.527; 9.5824 90; 90; 90 | 1273.2 | Feller, Moran; Gellrich, Urs; Anaby, Aviel; Diskin-Posner, Yael; Milstein, David Reductive Cleavage of CO2 by Metal-Ligand-Cooperation Mediated by an Iridium Pincer Complex. Journal of the American Chemical Society, 2016, 138, 6445-6454 |
| 4130099 | CIF | C28 H50 Ir N O5 P2 | P 21 21 21 | 12.2328; 15.8577; 16.0723 90; 90; 90 | 3117.77 | Feller, Moran; Gellrich, Urs; Anaby, Aviel; Diskin-Posner, Yael; Milstein, David Reductive Cleavage of CO2 by Metal-Ligand-Cooperation Mediated by an Iridium Pincer Complex. Journal of the American Chemical Society, 2016, 138, 6445-6454 |
| 4130100 | CIF | C28 H50 Cl6 Ir N O4 P2 | P 1 21/c 1 | 16.6996; 15.2679; 16.3378 90; 116.667; 90 | 3722.52 | Feller, Moran; Gellrich, Urs; Anaby, Aviel; Diskin-Posner, Yael; Milstein, David Reductive Cleavage of CO2 by Metal-Ligand-Cooperation Mediated by an Iridium Pincer Complex. Journal of the American Chemical Society, 2016, 138, 6445-6454 |
| 4130101 | CIF | C216 H96 Cl6 Fe27 N144 O24 | F m -3 c | 37.2012; 37.2012; 37.2012 90; 90; 90 | 51484 | Reed, Douglas A.; Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Herm, Zoey R.; Grandjean, Fernande; Long, Jeffrey R. Reversible CO Scavenging via Adsorbate-Dependent Spin State Transitions in an Iron(II)-Triazolate Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 5594-5602 |
| 4130102 | CIF | C264 H240 Cl6 Fe27 N168 O24 | F m -3 c | 38.068; 38.068; 38.068 90; 90; 90 | 55167 | Reed, Douglas A.; Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Herm, Zoey R.; Grandjean, Fernande; Long, Jeffrey R. Reversible CO Scavenging via Adsorbate-Dependent Spin State Transitions in an Iron(II)-Triazolate Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 5594-5602 |
| 4130103 | CIF | C33 H45 B N2 O | P -1 | 10.29; 12.272; 12.856 81.821; 80.193; 69.109 | 1488.7 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130104 | CIF | C33 H45 B N2 O | P 1 21/c 1 | 14.976; 12.583; 16.265 90; 91.2967; 90 | 3064 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130105 | CIF | C70 H96 B2 Li2 N4 O3 | C 1 2/c 1 | 20.296; 20.622; 17.131 90; 115.831; 90 | 6454 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130106 | CIF | C73 H96 B2 Li2 N4 O2 | C 1 2/c 1 | 20.625; 20.977; 17.1 90; 117.341; 90 | 6572 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130107 | CIF | C36 H53 B N2 O Si | P 1 21/n 1 | 17.16; 12.447; 18.046 90; 116.401; 90 | 3452 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130108 | CIF | C34 H47 B N2 O | P -1 | 9.434; 9.442; 18.382 83.43; 76.38; 77.01 | 1547.4 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130109 | CIF | C36 H49 B N2 O | P 1 2/a 1 | 15.408; 11.14; 18.912 90; 93.473; 90 | 3240.2 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130110 | CIF | C33 H44 B F N2 O | P -1 | 10.399; 12.57; 12.868 80.845; 78.888; 66.991 | 1512.7 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130111 | CIF | C33 H42 B F N2 O | P 21 21 21 | 12.153; 13.653; 18.121 90; 90; 90 | 3006.7 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130112 | CIF | C33 H44 B F N2 O | P -1 | 12.868; 13.76; 18.432 101.98; 101.462; 101.586 | 3027 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130113 | CIF | C33 H42 B F N2 O | P 21 21 21 | 11.941; 13.3; 18.914 90; 90; 90 | 3004 | Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society, 2016, 138, 3548-3552 |
| 4130114 | CIF | C20 H44 Cl2 Mg2 N2 O2 | P 1 21/n 1 | 9.766; 9.648; 14.138 90; 110; 90 | 1251.8 | Neufeld, Roman; Teuteberg, Thorsten L.; Herbst-Irmer, Regine; Mata, Ricardo A.; Stalke, Dietmar Solution Structures of Hauser Base (i)Pr2NMgCl and Turbo-Hauser Base (i)Pr2NMgCl·LiCl in THF and the Influence of LiCl on the Schlenk-Equilibrium. Journal of the American Chemical Society, 2016, 138, 4796-4806 |
| 4130115 | CIF | C20 H21 N O2 S | P -1 | 8.1845; 10.3787; 11.7173 116.156; 99.215; 95.524 | 866.09 | Feng, Jian-Jun; Lin, Tao-Yan; Zhu, Chao-Ze; Wang, Huamin; Wu, Hai-Hong; Zhang, Junliang The Divergent Synthesis of Nitrogen Heterocycles by Rhodium(I)-Catalyzed Intermolecular Cycloadditions of Vinyl Aziridines and Alkynes. Journal of the American Chemical Society, 2016, 138, 2178-2181 |
| 4130116 | CIF | C24 H23 N O2 S | P 1 21 1 | 12.0001; 7.6608; 12.186 90; 114.84; 90 | 1016.6 | Feng, Jian-Jun; Lin, Tao-Yan; Zhu, Chao-Ze; Wang, Huamin; Wu, Hai-Hong; Zhang, Junliang The Divergent Synthesis of Nitrogen Heterocycles by Rhodium(I)-Catalyzed Intermolecular Cycloadditions of Vinyl Aziridines and Alkynes. Journal of the American Chemical Society, 2016, 138, 2178-2181 |
| 4130117 | CIF | C34 H35 Cl2 I3 | P -1 | 10.9584; 11.099; 15.2278 75.3898; 76.1879; 70.6752 | 1666.62 | Lee, Semin; Yang, Anna; Moneypenny, 2nd, Timothy P; Moore, Jeffrey S. Kinetically Trapped Tetrahedral Cages via Alkyne Metathesis. Journal of the American Chemical Society, 2016, 138, 2182-2185 |
| 4130118 | CIF | C148 H136 Cl12 | I 41/a :2 | 18.9935; 18.9935; 50.612 90; 90; 90 | 18258.4 | Lee, Semin; Yang, Anna; Moneypenny, 2nd, Timothy P; Moore, Jeffrey S. Kinetically Trapped Tetrahedral Cages via Alkyne Metathesis. Journal of the American Chemical Society, 2016, 138, 2182-2185 |
| 4130119 | CIF | C34 H44 F2 Ni O4 P2 | P 21 21 21 | 14.283; 14.834; 16.192 90; 90; 90 | 3431 | Shevlin, Michael; Friedfeld, Max R.; Sheng, Huaming; Pierson, Nicholas A.; Hoyt, Jordan M.; Campeau, Louis-Charles; Chirik, Paul J. Nickel-Catalyzed Asymmetric Alkene Hydrogenation of α,β-Unsaturated Esters: High-Throughput Experimentation-Enabled Reaction Discovery, Optimization, and Mechanistic Elucidation. Journal of the American Chemical Society, 2016, 138, 3562-3569 |
| 4130120 | CIF | C22 H20 O2 | P 1 21/n 1 | 12.5333; 7.8729; 16.2274 90; 91.735; 90 | 1600.48 | Mitra, Nirmal K.; Meudom, Rolande; Corzo, Hector H.; Gorden, John D.; Merner, Bradley L. Overcoming Strain-Induced Rearrangement Reactions: A Mild Dehydrative Aromatization Protocol for Synthesis of Highly Distorted p-Phenylenes. Journal of the American Chemical Society, 2016, 138, 3235-3240 |
| 4130121 | CIF | C21 H18 O2 | P b c a | 19.549; 8.1172; 19.927 90; 90; 90 | 3162.1 | Mitra, Nirmal K.; Meudom, Rolande; Corzo, Hector H.; Gorden, John D.; Merner, Bradley L. Overcoming Strain-Induced Rearrangement Reactions: A Mild Dehydrative Aromatization Protocol for Synthesis of Highly Distorted p-Phenylenes. Journal of the American Chemical Society, 2016, 138, 3235-3240 |
| 4130122 | CIF | C87.5 H119.5 N14 O21 Zn4 | P 1 21/n 1 | 14.7663; 26.944; 24.182 90; 101.593; 90 | 9424.9 | Zhang, Huacheng; Lee, Juhoon; Lammer, Aaron D.; Chi, Xiaodong; Brewster, James T.; Lynch, Vincent M.; Li, Hao; Zhang, Zhan; Sessler, Jonathan L. Self-Assembled Pyridine-Dipyrrolate Cages. Journal of the American Chemical Society, 2016, 138, 4573-4579 |
| 4130123 | CIF | C26 H34 N4 O5 | P -1 | 4.9105; 10.503; 24.057 85.058; 88.604; 88.473 | 1235.4 | Zhang, Huacheng; Lee, Juhoon; Lammer, Aaron D.; Chi, Xiaodong; Brewster, James T.; Lynch, Vincent M.; Li, Hao; Zhang, Zhan; Sessler, Jonathan L. Self-Assembled Pyridine-Dipyrrolate Cages. Journal of the American Chemical Society, 2016, 138, 4573-4579 |
| 4130124 | CIF | C39.5 H65 Cl N4 O5 | P 1 21/c 1 | 18.156; 9.0535; 25.803 90; 106.877; 90 | 4058.7 | Zhang, Huacheng; Lee, Juhoon; Lammer, Aaron D.; Chi, Xiaodong; Brewster, James T.; Lynch, Vincent M.; Li, Hao; Zhang, Zhan; Sessler, Jonathan L. Self-Assembled Pyridine-Dipyrrolate Cages. Journal of the American Chemical Society, 2016, 138, 4573-4579 |
| 4130125 | CIF | C209 H267 N33 O41 Zn8 | P -1 | 15.916; 18.83; 19.364 105.094; 103.903; 91.781 | 5412 | Zhang, Huacheng; Lee, Juhoon; Lammer, Aaron D.; Chi, Xiaodong; Brewster, James T.; Lynch, Vincent M.; Li, Hao; Zhang, Zhan; Sessler, Jonathan L. Self-Assembled Pyridine-Dipyrrolate Cages. Journal of the American Chemical Society, 2016, 138, 4573-4579 |
| 4130126 | CIF | C38 H45 I N2 O7 | P 1 21/n 1 | 18.3255; 9.8329; 21.8331 90; 113.534; 90 | 3606.9 | Cai, Lingchao; Zhang, Kui; Kwon, Ohyun Catalytic Asymmetric Total Synthesis of (-)-Actinophyllic Acid. Journal of the American Chemical Society, 2016, 138, 3298-3301 |
| 4130127 | CIF | C26 H30 N2 O7 | P -1 | 9.1811; 11.1546; 11.7517 94.3941; 97.2458; 92.0699 | 1189.11 | Cai, Lingchao; Zhang, Kui; Kwon, Ohyun Catalytic Asymmetric Total Synthesis of (-)-Actinophyllic Acid. Journal of the American Chemical Society, 2016, 138, 3298-3301 |
| 4130128 | CIF | C17 H12 O S | P 21 21 21 | 10.28646; 13.11062; 18.6124 90; 90; 90 | 2510.1 | Kathayat, Rahul S.; Yang, Lijun; Sattasathuchana, Tosaporn; Zoppi, Laura; Baldridge, Kim K.; Linden, Anthony; Finney, Nathaniel S. On the Origins of Nonradiative Excited State Relaxation in Aryl Sulfoxides Relevant to Fluorescent Chemosensing. Journal of the American Chemical Society, 2016, 138, 15889-15895 |
| 4130129 | CIF | C17 H12 O S | P b c a | 14.1029; 10.42061; 16.6896 90; 90; 90 | 2452.72 | Kathayat, Rahul S.; Yang, Lijun; Sattasathuchana, Tosaporn; Zoppi, Laura; Baldridge, Kim K.; Linden, Anthony; Finney, Nathaniel S. On the Origins of Nonradiative Excited State Relaxation in Aryl Sulfoxides Relevant to Fluorescent Chemosensing. Journal of the American Chemical Society, 2016, 138, 15889-15895 |
| 4130130 | CIF | C19 H20 F3 Fe N9 O4 S | P 1 21/c 1 | 12.6972; 12.3023; 15.4558 90; 113.068; 90 | 2221.23 | Kupper, Claudia; Rees, Julian A.; Dechert, Sebastian; DeBeer, Serena; Meyer, Franc Complete Series of {FeNO}(8), {FeNO}(7), and {FeNO}(6) Complexes Stabilized by a Tetracarbene Macrocycle. Journal of the American Chemical Society, 2016, 138, 7888-7898 |
| 4130131 | CIF | C20 H20 F6 Fe N10 O9 S2 | P -1 | 10.1194; 11.5579; 13.5781 74.854; 86.99; 67.327 | 1412.4 | Kupper, Claudia; Rees, Julian A.; Dechert, Sebastian; DeBeer, Serena; Meyer, Franc Complete Series of {FeNO}(8), {FeNO}(7), and {FeNO}(6) Complexes Stabilized by a Tetracarbene Macrocycle. Journal of the American Chemical Society, 2016, 138, 7888-7898 |
| 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 |
| 4130133 | CIF | C18 H19 N O2 | P 21 21 21 | 7.8819; 12.8093; 14.6769 90; 90; 90 | 1481.8 | Liang, Xiao; Jiang, Shi-Zhi; Wei, Kun; Yang, Yu-Rong Enantioselective Total Synthesis of (-)-Alstoscholarisine A. Journal of the American Chemical Society, 2016, 138, 2560-2562 |
| 4130134 | CIF | C264 H236 Cl6 Co20 N8 O52 S16 | P 4/m n c | 30.4471; 30.4471; 21.8623 90; 90; 90 | 20267 | Hang, Xinxin; Liu, Bing; Zhu, Xiaofei; Wang, Shentang; Han, Haitao; Liao, Wuping; Liu, Yunling; Hu, Chunhua Discrete {Ni40} Coordination Cage: A Calixarene-Based Johnson-Type (J17) Hexadecahedron. Journal of the American Chemical Society, 2016, 138, 2969-2972 |
| 4130135 | CIF | C626.14 H574.08 Cl6 N18.73 Ni40 O115.47 S40 | P 1 2/n 1 | 36.664; 34.101; 46.617 90; 92.414; 90 | 58233 | Hang, Xinxin; Liu, Bing; Zhu, Xiaofei; Wang, Shentang; Han, Haitao; Liao, Wuping; Liu, Yunling; Hu, Chunhua Discrete {Ni40} Coordination Cage: A Calixarene-Based Johnson-Type (J17) Hexadecahedron. Journal of the American Chemical Society, 2016, 138, 2969-2972 |
| 4130136 | CIF | C54.4 H43.61 B F15 N3 O Re | P -1 | 12.0773; 13.7901; 16.7455 69.605; 74.537; 72.549 | 2452.4 | Lambic, Nikola S.; Sommer, Roger D.; Ison, Elon A. Transition-Metal Oxos as the Lewis Basic Component of Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 4832-4842 |
| 4130137 | CIF | C31 H29 F5 N3 O Re | P c c n | 24.5115; 24.6966; 18.6378 90; 90; 90 | 11282.4 | Lambic, Nikola S.; Sommer, Roger D.; Ison, Elon A. Transition-Metal Oxos as the Lewis Basic Component of Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 4832-4842 |
| 4130138 | CIF | C50 H37 B F15 N3 O Re | P 41 21 2 | 16.2377; 16.2377; 36.5045 90; 90; 90 | 9624.9 | Lambic, Nikola S.; Sommer, Roger D.; Ison, Elon A. Transition-Metal Oxos as the Lewis Basic Component of Frustrated Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 4832-4842 |
| 4130139 | CIF | C33 H17 F4 Ir N2 O4 | P 1 21/c 1 | 15.8657; 20.21; 8.2946 90; 102.559; 90 | 2596 | Chen, Tsun-Ren; Wu, Fang-Siou; Lee, Hsiu-Pen; Chen, Kelvin H.-C. Diiridium Bimetallic Complexes Function as a Redox Switch To Directly Split Carbonate into Carbon Monoxide and Oxygen. Journal of the American Chemical Society, 2016, 138, 3643-3646 |
| 4130140 | CIF | C54 H28 Cl4 F8 Ir2 N4 O6 | C c c a :2 | 14.2793; 16.5304; 23.6 90; 90; 90 | 5570.6 | Chen, Tsun-Ren; Wu, Fang-Siou; Lee, Hsiu-Pen; Chen, Kelvin H.-C. Diiridium Bimetallic Complexes Function as a Redox Switch To Directly Split Carbonate into Carbon Monoxide and Oxygen. Journal of the American Chemical Society, 2016, 138, 3643-3646 |
| 4130141 | CIF | C108 H122 B2 N4 O14 | C 1 2/c 1 | 14.485; 32.392; 20.582 90; 103.16; 90 | 9403 | Suzuki, Yoshimasa; Nakamura, Taiki; Iida, Hiroki; Ousaka, Naoki; Yashima, Eiji Allosteric Regulation of Unidirectional Spring-like Motion of Double-Stranded Helicates. Journal of the American Chemical Society, 2016, 138, 4852-4859 |
| 4130142 | CIF | C122 H156 B2 N6 O12 | P 1 21 1 | 16.291; 15.03; 24.604 90; 102.476; 90 | 5882.1 | Suzuki, Yoshimasa; Nakamura, Taiki; Iida, Hiroki; Ousaka, Naoki; Yashima, Eiji Allosteric Regulation of Unidirectional Spring-like Motion of Double-Stranded Helicates. Journal of the American Chemical Society, 2016, 138, 4852-4859 |
| 4130143 | CIF | C47 H35.5 Cu2 F14 N9.5 O5 P2 | P 1 21/n 1 | 10.2462; 21.4566; 22.8408 90; 96.132; 90 | 4992.8 | Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes. Journal of the American Chemical Society, 2016, 138, 6484-6491 |
| 4130144 | CIF | C78 H57 B Cu2 F8 N6 | P -1 | 9.9438; 16.1553; 20.9439 87.583; 76.604; 75.168 | 3163.41 | Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes. Journal of the American Chemical Society, 2016, 138, 6484-6491 |
| 4130145 | CIF | C88 H47 B Cu2 F38 N6 | P 1 21/c 1 | 20.3441; 21.4651; 20.4182 90; 112.805; 90 | 8219.4 | Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes. Journal of the American Chemical Society, 2016, 138, 6484-6491 |
| 4130146 | CIF | C43.39 H27.78 Cl1.77 Cu2 F14 N9 O8 S4 | C 1 2/c 1 | 25.2803; 15.4022; 27.2625 90; 106.227; 90 | 10192.4 | Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes. Journal of the American Chemical Society, 2016, 138, 6484-6491 |
| 4130147 | CIF | C53 H37.5 Cu2 F10.5 N7 O4 S2 | C 1 2/c 1 | 23.1071; 19.4719; 22.4403 90; 91.37; 90 | 10093.9 | Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes. Journal of the American Chemical Society, 2016, 138, 6484-6491 |
| 4130148 | CIF | C40 H25 Cu2 F14 N8 O8 S4 | P -1 | 12.678; 15.1192; 16.6712 66.681; 74.49; 71.718 | 2748.56 | Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes. Journal of the American Chemical Society, 2016, 138, 6484-6491 |
| 4130149 | CIF | C27 H20 B F5 N2 O | P 21 21 21 | 8.3517; 14.6007; 18.7457 90; 90; 90 | 2285.86 | Chernichenko, Konstantin; Lindqvist, Markus; Kótai, Bianka; Nieger, Martin; Sorochkina, Kristina; Pápai, Imre; Repo, Timo Metal-Free sp(2)-C-H Borylation as a Common Reactivity Pattern of Frustrated 2-Aminophenylboranes. Journal of the American Chemical Society, 2016, 138, 4860-4868 |
| 4130150 | CIF | C35 H29 B2 F10 N2 S | P 1 21/c 1 | 13.185; 9.417; 26.849 90; 93.44; 90 | 3327.6 | Chernichenko, Konstantin; Lindqvist, Markus; Kótai, Bianka; Nieger, Martin; Sorochkina, Kristina; Pápai, Imre; Repo, Timo Metal-Free sp(2)-C-H Borylation as a Common Reactivity Pattern of Frustrated 2-Aminophenylboranes. Journal of the American Chemical Society, 2016, 138, 4860-4868 |
| 4130151 | CIF | C39 H40 B N | P 1 21/c 1 | 19.18; 18.5354; 18.4087 90; 115.643; 90 | 5899.9 | Chernichenko, Konstantin; Lindqvist, Markus; Kótai, Bianka; Nieger, Martin; Sorochkina, Kristina; Pápai, Imre; Repo, Timo Metal-Free sp(2)-C-H Borylation as a Common Reactivity Pattern of Frustrated 2-Aminophenylboranes. Journal of the American Chemical Society, 2016, 138, 4860-4868 |
| 4130152 | CIF | C91.33 H136 F6 N2 Nb2 O8 P4 S2 | P -1 | 10.46; 12.8017; 18.4489 78.432; 82.776; 70.576 | 2277.8 | Kurogi, Takashi; Carroll, Patrick J.; Mindiola, Daniel J. A Terminally Bound Niobium Methylidyne. Journal of the American Chemical Society, 2016, 138, 4306-4309 |
| 4130153 | CIF | C45 H75 N Nb O P2 | P -1 | 12.3046; 12.9264; 15.7965 112.094; 104.837; 90.285 | 2235.9 | Kurogi, Takashi; Carroll, Patrick J.; Mindiola, Daniel J. A Terminally Bound Niobium Methylidyne. Journal of the American Chemical Society, 2016, 138, 4306-4309 |
| 4130154 | CIF | C39 H58 N Nb O P2 | P 1 21/c 1 | 19.897; 9.6269; 20.0101 90; 94.974; 90 | 3818.4 | Kurogi, Takashi; Carroll, Patrick J.; Mindiola, Daniel J. A Terminally Bound Niobium Methylidyne. Journal of the American Chemical Society, 2016, 138, 4306-4309 |
| 4130155 | CIF | C45 H71 F3 N Nb O4 P2 S | P -1 | 12.2863; 15.2474; 15.3656 61.451; 89.192; 75.707 | 2431.9 | Kurogi, Takashi; Carroll, Patrick J.; Mindiola, Daniel J. A Terminally Bound Niobium Methylidyne. Journal of the American Chemical Society, 2016, 138, 4306-4309 |
| 4130156 | CIF | C50 H85 Cl2 N Nb O P2 | I 41/a :2 | 13.2018; 13.2018; 57.5706 90; 90; 90 | 10033.8 | Kurogi, Takashi; Carroll, Patrick J.; Mindiola, Daniel J. A Terminally Bound Niobium Methylidyne. Journal of the American Chemical Society, 2016, 138, 4306-4309 |
| 4130157 | CIF | C96 H64 N12 O30 Zr6 | F m -3 m | 32.499; 32.499; 32.499 90; 90; 90 | 34325 | Zhang, Teng; Manna, Kuntal; Lin, Wenbin Metal-Organic Frameworks Stabilize Solution-Inaccessible Cobalt Catalysts for Highly Efficient Broad-Scope Organic Transformations. Journal of the American Chemical Society, 2016, 138, 3241-3249 |
| 4130158 | CIF | C25.33 H26.67 Co N4 O0.33 | C 1 2/c 1 | 25.4633; 12.1607; 22.1318 90; 107.914; 90 | 6520.9 | Zhang, Teng; Manna, Kuntal; Lin, Wenbin Metal-Organic Frameworks Stabilize Solution-Inaccessible Cobalt Catalysts for Highly Efficient Broad-Scope Organic Transformations. Journal of the American Chemical Society, 2016, 138, 3241-3249 |
| 4130159 | CIF | C155 H164 Cl4 O12 P4 Pd2 | P 1 21 1 | 15.041; 20.148; 24.408 90; 93.946; 90 | 7379.2 | Liu, Yang; Xie, Yinjun; Wang, Hongli; Huang, Hanmin Enantioselective Aminomethylamination of Conjugated Dienes with Aminals Enabled by Chiral Palladium Complex-Catalyzed C-N Bond Activation. Journal of the American Chemical Society, 2016, 138, 4314-4317 |
| 4130160 | CIF | C41 H42 Cl4 N2 O2 | P 1 | 11.208; 13.107; 14.164 78.649; 72.073; 77.763 | 1915.3 | Liu, Yang; Xie, Yinjun; Wang, Hongli; Huang, Hanmin Enantioselective Aminomethylamination of Conjugated Dienes with Aminals Enabled by Chiral Palladium Complex-Catalyzed C-N Bond Activation. Journal of the American Chemical Society, 2016, 138, 4314-4317 |
| 4130161 | CIF | C39 H40 N2 | C 1 2 1 | 26.346; 9.78; 12.743 90; 101.641; 90 | 3215.9 | Liu, Yang; Xie, Yinjun; Wang, Hongli; Huang, Hanmin Enantioselective Aminomethylamination of Conjugated Dienes with Aminals Enabled by Chiral Palladium Complex-Catalyzed C-N Bond Activation. Journal of the American Chemical Society, 2016, 138, 4314-4317 |
| 4130162 | CIF | C74 H70 Cl4 O2 P2 | P 21 21 21 | 14.0399; 18.7329; 25.5734 90; 90; 90 | 6726 | Liu, Yang; Xie, Yinjun; Wang, Hongli; Huang, Hanmin Enantioselective Aminomethylamination of Conjugated Dienes with Aminals Enabled by Chiral Palladium Complex-Catalyzed C-N Bond Activation. Journal of the American Chemical Society, 2016, 138, 4314-4317 |
| 4130163 | CIF | C73 H60 Dy Ga4 N7 O22 | P 1 21/c 1 | 17.1202; 17.1515; 28.505 90; 122.17; 90 | 7085.1 | Chow, Chun Y.; Eliseeva, Svetlana V.; Trivedi, Evan R.; Nguyen, Tu N.; Kampf, Jeff W.; Petoud, Stéphane; Pecoraro, Vincent L. Ga(3+)/Ln(3+) Metallacrowns: A Promising Family of Highly Luminescent Lanthanide Complexes That Covers Visible and Near-Infrared Domains. Journal of the American Chemical Society, 2016, 138, 5100-5109 |
| 4130164 | CIF | C360 H288 Cd6 F72 N36 O24 P12 | P -1 | 13.9491; 38.2556; 42.6514 105.529; 92.47; 91.599 | 21890.5 | Wang, Shih-Yu; Fu, Jun-Hao; Liang, Yen-Peng; He, Yun-Jui; Chen, Yu-Sheng; Chan, Yi-Tsu Metallo-Supramolecular Self-Assembly of a Multicomponent Ditrigon Based on Complementary Terpyridine Ligand Pairing. Journal of the American Chemical Society, 2016, 138, 3651-3654 |
| 4130165 | CIF | C61 H51 Cd F12 N7 O5 P2 | F d d 2 | 28.017; 54.0051; 15.5349 90; 90; 90 | 23505.2 | Wang, Shih-Yu; Fu, Jun-Hao; Liang, Yen-Peng; He, Yun-Jui; Chen, Yu-Sheng; Chan, Yi-Tsu Metallo-Supramolecular Self-Assembly of a Multicomponent Ditrigon Based on Complementary Terpyridine Ligand Pairing. Journal of the American Chemical Society, 2016, 138, 3651-3654 |
| 4130166 | CIF | C20 H20 Cl N2 O4 | P -1 | 5.8557; 9.2297; 17.447 96.214; 95.884; 90.396 | 932.3 | Huang, Rong; Chang, Xin; Li, Jun; Wang, Chun-Jiang Cu(I)-Catalyzed Asymmetric Multicomponent Cascade Inverse Electron-Demand Aza-Diels-Alder/Nucleophilic Addition/Ring-Opening Reaction Involving 2-Methoxyfurans as Efficient Dienophiles. Journal of the American Chemical Society, 2016, 138, 3998-4001 |
| 4130167 | CIF | C11 H11 Br O2 | P 1 21 1 | 8.205; 7.412; 8.636 90; 100.618; 90 | 516.2 | Garza, Victoria J.; Krische, Michael J. Hydroxymethylation beyond Carbonylation: Enantioselective Iridium-Catalyzed Reductive Coupling of Formaldehyde with Allylic Acetates via Enantiotopic π-Facial Discrimination. Journal of the American Chemical Society, 2016, 138, 3655-3658 |
| 4130168 | CIF | C26 H31 Cu F3 N4 O6 S | C 1 2/c 1 | 20.569; 15.5906; 18.3755 90; 104.318; 90 | 5709.7 | Lionetti, Davide; de Ruiter, Graham; Agapie, Theodor A trans-Hyponitrite Intermediate in the Reductive Coupling and Deoxygenation of Nitric Oxide by a Tricopper-Lewis Acid Complex. Journal of the American Chemical Society, 2016, 138, 5008-5011 |
| 4130169 | CIF | C162 H179 Cu6 F18 N33 O28 S6 Y2 | P -1 | 13.8507; 16.8194; 21.214 105.556; 105.602; 94.915 | 4518.8 | Lionetti, Davide; de Ruiter, Graham; Agapie, Theodor A trans-Hyponitrite Intermediate in the Reductive Coupling and Deoxygenation of Nitric Oxide by a Tricopper-Lewis Acid Complex. Journal of the American Chemical Society, 2016, 138, 5008-5011 |
| 4130170 | CIF | C36 H44 N22 O12 S2 Zn5 | I -4 2 d | 18.76; 18.76; 17.999 90; 90; 90 | 6335 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130171 | CIF | C26 H20 N10 O12 S3 Zn4 | P 6/m c c | 24.775; 24.775; 31.869 90; 90; 120 | 16940.5 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130172 | CIF | C58 H46 N20 O24 S3 Zn8 | P -3 c 1 | 16.294; 16.294; 31.752 90; 90; 120 | 7300.6 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130173 | CIF | C64 H52 N20 O24 S9 Zn8 | P -3 c 1 | 18.213; 18.213; 31.7057 90; 90; 120 | 9108.2 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130174 | CIF | C70 H52 N20 O24 S3 Zn8 | P -3 c 1 | 18.748; 18.748; 31.892 90; 90; 120 | 9708 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130175 | CIF | C76 H58 N22 O24 S3 Zn8 | C 1 2/m 1 | 34.858; 38.935; 19.106 90; 121.613; 90 | 22083 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130176 | CIF | C88 H64 N20 O24 S3 Zn8 | C 1 2/m 1 | 52.786; 21.894; 33.863 90; 129.9; 90 | 30023.3 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130177 | CIF | C106 H70 N26 O24 S3 Zn9.5 | C m c e | 26.0154; 70.791; 43.7088 90; 90; 90 | 80497 | Qin, Jun-Sheng; Du, Dong-Ying; Li, Mian; Lian, Xi-Zhen; Dong, Long-Zhang; Bosch, Mathieu; Su, Zhong-Min; Zhang, Qiang; Li, Shun-Li; Lan, Ya-Qian; Yuan, Shuai; Zhou, Hong-Cai Derivation and Decoration of Nets with Trigonal-Prismatic Nodes: A Unique Route to Reticular Synthesis of Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 5299-5307 |
| 4130178 | CIF | C39 H22 B F10 O P | C 1 2/c 1 | 38.7892; 10.0101; 19.4349 90; 117.371; 90 | 6701.43 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130179 | CIF | C39.14 H28.28 B2 Cl0.28 F10 N O P | P -1 | 11.8302; 13.0209; 13.4767 65.883; 67.537; 78.866 | 1749.3 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130180 | CIF | C40 H30 B2 F10 N O P | P -1 | 10.0982; 19.7298; 20.527 81.7674; 84.2722; 78.4057 | 3954.32 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130181 | CIF | C41 H32 B2 F10 N O P | P 1 21/c 1 | 10.2093; 15.8891; 22.2346 90; 94.2105; 90 | 3597.09 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130182 | CIF | C43 H36 B2 Cl2 F10 N O P | P 1 21/c 1 | 13.1679; 15.0411; 20.7964 90; 94.719; 90 | 4104.97 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130183 | CIF | C39 H32 B3 F10 N2 O P | P 1 21/c 1 | 9.9719; 17.3317; 21.4305 90; 91.939; 90 | 3701.71 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130184 | CIF | C94 H102 B6 F20 N4 O5 P2 | P 1 21/n 1 | 10.7616; 29.2049; 15.4643 90; 106.367; 90 | 4663.3 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130185 | CIF | C40 H28 B2 Cl2 F10 N O P | P -1 | 12.4563; 12.7878; 13.9516 97.1164; 110.102; 96.6299 | 2040.88 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130186 | CIF | C91 H90 B2 Cl2 O2 P2 | C 1 2/c 1 | 21.3231; 8.5517; 41.7671 90; 101.146; 90 | 7472.5 | Mo, Zhenbo; Rit, Arnab; Campos, Jesús; Kolychev, Eugene L.; Aldridge, Simon Catalytic B-N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism. Journal of the American Chemical Society, 2016, 138, 3306-3309 |
| 4130187 | CIF | C25 H25 F N2 O6 S | P 21 21 21 | 6.5466; 14.9516; 50.431 90; 90; 90 | 4936.3 | Trost, Barry M.; Saget, Tanguy; Hung, Chao-I Joey Direct Catalytic Asymmetric Mannich Reactions for the Construction of Quaternary Carbon Stereocenters. Journal of the American Chemical Society, 2016, 138, 3659-3662 |
| 4130188 | CIF | C13 H12 N2 | P b c a | 15.4073; 13.5221; 20.4502 90; 90; 90 | 4260.6 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130189 | CIF | C21 H20 Cl6 N2 O9 Pd2 | P 1 21/c 1 | 19.6236; 14.018; 22.9158 90; 111.508; 90 | 5864.8 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130190 | CIF | C69 H62 Cl18 N8 O20 Pd4 | P -1 | 12.919; 14.743; 25.813 89.68; 85.15; 66.57 | 4493 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130191 | CIF | C28 H20 Cl6 N4 O6 Pd | P -1 | 5.9835; 10.44; 12.697 73.333; 88.112; 88.791 | 759.36 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130192 | CIF | C22.87 H25.87 Cl5.6 N2 O8 Pd2 | P 1 21/n 1 | 11.337; 20.912; 13.689 90; 97.432; 90 | 3218 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130193 | CIF | C18.47 H19.47 Cl4.42 N2 O4 Pd | P 1 21/n 1 | 10.376; 12.988; 17.735 90; 101.52; 90 | 2341.9 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130194 | CIF | C23 H8 F18 N2 O13 Pd2 | P 1 21/n 1 | 14.8547; 16.258; 15.2201 90; 115.105; 90 | 3328.5 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130195 | CIF | C19 H8 F12 N2 O9 Pd | P -1 | 11.0499; 11.1974; 11.2382 96.618; 114.186; 99.355 | 1225.77 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130196 | CIF | C43.54 H49.54 Cl4.63 N4 O10 Pd2 | P -1 | 12.971; 13.996; 15.387 73.854; 72.031; 80.916 | 2544.4 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130197 | CIF | C50 H12 F20 N4 O10 Pd2 | P 1 2/c 1 | 24.5357; 8.7047; 26.4314 90; 122.616; 90 | 4754.9 | White, Paul B.; Jaworski, Jonathan N.; Fry, Charles G.; Dolinar, Brian S.; Guzei, Ilia A.; Stahl, Shannon S. Structurally Diverse Diazafluorene-Ligated Palladium(II) Complexes and Their Implications for Aerobic Oxidation Reactions. Journal of the American Chemical Society, 2016, 138, 4869-4880 |
| 4130198 | CIF | C28 H16 F6 S4 Ta | P -4 21 c | 13.763; 13.763; 6.746 90; 90; 90 | 1277.8 | Kiyota, Yasuhiro; Kadoya, Tomofumi; Yamamoto, Kaoru; Iijima, Kodai; Higashino, Toshiki; Kawamoto, Tadashi; Takimiya, Kazuo; Mori, Takehiko Benzothienobenzothiophene-Based Molecular Conductors: High Conductivity, Large Thermoelectric Power Factor, and One-Dimensional Instability. Journal of the American Chemical Society, 2016, 138, 3920-3925 |
| 4130199 | CIF | C28 H16 F6 S4 Sb | P -4 21 c | 13.7406; 13.7406; 6.744 90; 90; 90 | 1273.3 | Kiyota, Yasuhiro; Kadoya, Tomofumi; Yamamoto, Kaoru; Iijima, Kodai; Higashino, Toshiki; Kawamoto, Tadashi; Takimiya, Kazuo; Mori, Takehiko Benzothienobenzothiophene-Based Molecular Conductors: High Conductivity, Large Thermoelectric Power Factor, and One-Dimensional Instability. Journal of the American Chemical Society, 2016, 138, 3920-3925 |
| 4130200 | CIF | C28 H16 As F6 S4 | P -4 21 c | 13.5835; 13.5835; 6.737 90; 90; 90 | 1243.1 | Kiyota, Yasuhiro; Kadoya, Tomofumi; Yamamoto, Kaoru; Iijima, Kodai; Higashino, Toshiki; Kawamoto, Tadashi; Takimiya, Kazuo; Mori, Takehiko Benzothienobenzothiophene-Based Molecular Conductors: High Conductivity, Large Thermoelectric Power Factor, and One-Dimensional Instability. Journal of the American Chemical Society, 2016, 138, 3920-3925 |
| 4130201 | CIF | C19 H18 Br N O | P 21 21 21 | 8.8403; 9.8113; 18.8722 90; 90; 90 | 1636.9 | Liu, Ren-Rong; Li, Bao-Le; Lu, Jun; Shen, Chong; Gao, Jian-Rong; Jia, Yi-Xia Palladium/l-Proline-Catalyzed Enantioselective α-Arylative Desymmetrization of Cyclohexanones. Journal of the American Chemical Society, 2016, 138, 5198-5201 |
| 4130202 | CIF | C12 H25 B10 Ir S2 | P b c a | 11.8131; 12.9608; 26.409 90; 90; 90 | 4043.4 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130203 | CIF | C30 H37 B10 F3 Ir P S2 | P 1 21/c 1 | 16.7982; 12.1828; 21.8063 90; 109.582; 90 | 4204.5 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130204 | CIF | C33 H46 B10 Ir O3 P S2 | P -1 | 11.9911; 18.2907; 19.1405 93.963; 92.945; 95.033 | 4164.8 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130205 | CIF | C18 H40 B10 Ir P S2 | P n a 21 | 22.537; 9.9686; 12.6468 90; 90; 90 | 2841.3 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130206 | CIF | C30 H40 B10 Ir P S2 | P 1 21/c 1 | 17.2081; 11.4691; 21.3963 90; 125.744; 90 | 3427.4 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130207 | CIF | C30 H37 B10 F3 Ir P S2 | P 1 21/c 1 | 15.507; 19.538; 22.556 90; 91.978; 90 | 6830 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130208 | CIF | C33 H46 B10 Ir O3 P S2 | P 1 2/c 1 | 12.019; 9.9038; 38.907 90; 93.446; 90 | 4622.9 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130209 | CIF | C18 H40 B10 Ir P S2 | P -1 | 9.1894; 10.8105; 14.5584 85.042; 89.59; 74.622 | 1389.1 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130210 | CIF | C30 H40 B10 Ir P S2 | P 1 21/c 1 | 12.281; 14.51; 19.708 90; 101.393; 90 | 3442.7 | Zhang, Xiaolei; Dai, Huimin; Yan, Hong; Zou, Wenli; Cremer, Dieter B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding. Journal of the American Chemical Society, 2016, 138, 4334-4337 |
| 4130211 | CIF | C132 H112 S8 | P -1 | 16.2172; 17.2657; 21.5757 85.709; 68.48; 64.959 | 5068.6 | Fujikawa, Takao; Segawa, Yasutomo; Itami, Kenichiro Synthesis and Structural Features of Quadruple Helicenes: Highly Distorted π Systems Enabled by Accumulation of Helical Repulsions. Journal of the American Chemical Society, 2016, 138, 3587-3595 |
| 4130212 | CIF | C66 H56 S4 | P 1 21/n 1 | 17.2313; 12.0935; 25.119 90; 106.951; 90 | 5007.1 | Fujikawa, Takao; Segawa, Yasutomo; Itami, Kenichiro Synthesis and Structural Features of Quadruple Helicenes: Highly Distorted π Systems Enabled by Accumulation of Helical Repulsions. Journal of the American Chemical Society, 2016, 138, 3587-3595 |
| 4130213 | CIF | C52 H61 Al P2 Pt | P 1 21/n 1 | 11.6412; 17.092; 23.7775 90; 100.771; 90 | 4647.69 | Devillard, Marc; Declercq, Richard; Nicolas, Emmanuel; Ehlers, Andreas W.; Backs, Jana; Saffon-Merceron, Nathalie; Bouhadir, Ghenwa; Slootweg, J. Chris; Uhl, Werner; Bourissou, Didier A Significant but Constrained Geometry Pt→Al Interaction: Fixation of CO2 and CS2, Activation of H2 and PhCONH2. Journal of the American Chemical Society, 2016, 138, 4917-4926 |
| 4130214 | CIF | C108 H126 Al2 O4.5 P4 Pt2 | P -1 | 12.5062; 18.9753; 21.519 97.69; 92.244; 108.259 | 4788 | Devillard, Marc; Declercq, Richard; Nicolas, Emmanuel; Ehlers, Andreas W.; Backs, Jana; Saffon-Merceron, Nathalie; Bouhadir, Ghenwa; Slootweg, J. Chris; Uhl, Werner; Bourissou, Didier A Significant but Constrained Geometry Pt→Al Interaction: Fixation of CO2 and CS2, Activation of H2 and PhCONH2. Journal of the American Chemical Society, 2016, 138, 4917-4926 |
| 4130215 | CIF | C53 H61 Al P2 Pt S2 | P 1 21/c 1 | 20.0944; 14.1515; 17.3483 90; 100.857; 90 | 4845 | Devillard, Marc; Declercq, Richard; Nicolas, Emmanuel; Ehlers, Andreas W.; Backs, Jana; Saffon-Merceron, Nathalie; Bouhadir, Ghenwa; Slootweg, J. Chris; Uhl, Werner; Bourissou, Didier A Significant but Constrained Geometry Pt→Al Interaction: Fixation of CO2 and CS2, Activation of H2 and PhCONH2. Journal of the American Chemical Society, 2016, 138, 4917-4926 |
| 4130216 | CIF | C60 H70 Al Cl2 N O P2 Pt | C 1 c 1 | 15.9092; 23.258; 16.4934 90; 110.253; 90 | 5725.5 | Devillard, Marc; Declercq, Richard; Nicolas, Emmanuel; Ehlers, Andreas W.; Backs, Jana; Saffon-Merceron, Nathalie; Bouhadir, Ghenwa; Slootweg, J. Chris; Uhl, Werner; Bourissou, Didier A Significant but Constrained Geometry Pt→Al Interaction: Fixation of CO2 and CS2, Activation of H2 and PhCONH2. Journal of the American Chemical Society, 2016, 138, 4917-4926 |
| 4130217 | CIF | C8 H4 D1.82 In O5 | I 41 2 2 | 15.49394; 15.49394; 12.31213 90; 90; 90 | 2955.68 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130218 | CIF | C8 H4 D3.21 In O5 | I 41 2 2 | 15.49227; 15.49227; 12.31047 90; 90; 90 | 2954.64 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130219 | CIF | C8 H4 D5.98 In O5 | I 41 2 2 | 15.48888; 15.48888; 12.30827 90; 90; 90 | 2952.82 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130220 | CIF | C8 H4 D9.67 In O5 | I 41 2 2 | 15.48281; 15.48281; 12.3009 90; 90; 90 | 2948.74 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130221 | CIF | C8 H4 D12.17 In O5 | I 41 2 2 | 15.49785; 15.49785; 12.3052 90; 90; 90 | 2955.5 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130222 | CIF | C8 H4 In O5 | I 41 2 2 | 15.46363; 15.46363; 12.29044 90; 90; 90 | 2938.94 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130223 | CIF | C9.09 H4 D4.35 In O5 | I 41 2 2 | 15.46363; 15.46363; 12.29044 90; 90; 90 | 2938.94 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130224 | CIF | C10.09 H4 D8.36 In O5 | I 41 2 2 | 15.43745; 15.43745; 12.2848 90; 90; 90 | 2927.65 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130225 | CIF | C11.11 H4 D12.44 In O5 | I 41 2 2 | 15.5019; 15.5019; 12.306 90; 90; 90 | 2957.24 | Savage, Mathew; da Silva, Ivan; Johnson, Mark; Carter, Joseph H.; Newby, Ruth; Suyetin, Mikhail; Besley, Elena; Manuel, Pascal; Rudić, Svemir; Fitch, Andrew N.; Murray, Claire; David, William I. F.; Yang, Sihai; Schröder, Martin Observation of Binding and Rotation of Methane and Hydrogen within a Functional Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 9119-9127 |
| 4130226 | CIF | C131 H112 F48 N16 O P8 | P 1 21/c 1 | 9.6472; 14.2251; 26.6001 90; 93.415; 90 | 3643.91 | Dale, Edward J.; Ferris, Daniel P.; Vermeulen, Nicolaas A.; Henkelis, James J.; Popovs, Ilja; Juríček, Michal; Barnes, Jonathan C.; Schneebeli, Severin T.; Stoddart, J. Fraser Cooperative Reactivity in an Extended-Viologen-Based Cyclophane. Journal of the American Chemical Society, 2016, 138, 3667-3670 |
| 4130227 | CIF | C77 H60 F24 N6 O P4 | P -1 | 10.5028; 11.0221; 21.9016 82.419; 82.604; 63.647 | 2245 | Dale, Edward J.; Ferris, Daniel P.; Vermeulen, Nicolaas A.; Henkelis, James J.; Popovs, Ilja; Juríček, Michal; Barnes, Jonathan C.; Schneebeli, Severin T.; Stoddart, J. Fraser Cooperative Reactivity in an Extended-Viologen-Based Cyclophane. Journal of the American Chemical Society, 2016, 138, 3667-3670 |
| 4130228 | CIF | C42 H35 F24 N5 P4 | I c m a | 11.465; 22.063; 23.253 90; 90; 90 | 5881.9 | Dale, Edward J.; Ferris, Daniel P.; Vermeulen, Nicolaas A.; Henkelis, James J.; Popovs, Ilja; Juríček, Michal; Barnes, Jonathan C.; Schneebeli, Severin T.; Stoddart, J. Fraser Cooperative Reactivity in an Extended-Viologen-Based Cyclophane. Journal of the American Chemical Society, 2016, 138, 3667-3670 |
| 4130229 | CIF | C92 H68 F24 N6 P4 | C 1 2/m 1 | 24.3589; 16.5544; 10.64 90; 108.44; 90 | 4070.3 | Dale, Edward J.; Ferris, Daniel P.; Vermeulen, Nicolaas A.; Henkelis, James J.; Popovs, Ilja; Juríček, Michal; Barnes, Jonathan C.; Schneebeli, Severin T.; Stoddart, J. Fraser Cooperative Reactivity in an Extended-Viologen-Based Cyclophane. Journal of the American Chemical Society, 2016, 138, 3667-3670 |
| 4130230 | CIF | C76 H58 F24 N6 P4 | C 1 2/m 1 | 24.3589; 16.5544; 10.64 90; 108.44; 90 | 4070.3 | Dale, Edward J.; Ferris, Daniel P.; Vermeulen, Nicolaas A.; Henkelis, James J.; Popovs, Ilja; Juríček, Michal; Barnes, Jonathan C.; Schneebeli, Severin T.; Stoddart, J. Fraser Cooperative Reactivity in an Extended-Viologen-Based Cyclophane. Journal of the American Chemical Society, 2016, 138, 3667-3670 |
| 4130231 | CIF | C7 H10 B N O4 | P -1 | 3.7693; 8.5103; 14.0577 93.315; 91.465; 94.628 | 448.51 | Mfuh, Adelphe M.; Doyle, John D.; Chhetri, Bhuwan; Arman, Hadi D.; Larionov, Oleg V. Scalable, Metal- and Additive-Free, Photoinduced Borylation of Haloarenes and Quaternary Arylammonium Salts. Journal of the American Chemical Society, 2016, 138, 2985-2988 |
| 4130232 | CIF | C28 H48 Si2 U | P -1 | 9.477; 10.236; 17.108 79.721; 75.293; 73.022 | 1525.5 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130233 | CIF | C48 H50 U | P -1 | 10.679; 10.686; 18.045 75.212; 89.597; 67.141 | 1824.8 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130234 | CIF | C36 H54 Si2 U | P 1 n 1 | 10.937; 20.247; 16.033 90; 92.007; 90 | 3548 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130235 | CIF | C30 H48 Si2 U | P 1 21/c 1 | 10.638; 17.957; 16.468 90; 96.93; 90 | 3122.8 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130236 | CIF | C46 H52 N2 U | P -1 | 10.067; 13.204; 15.629 91.041; 93.523; 106.663 | 1985.1 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130237 | CIF | C72 H92 N4 U2 | P -1 | 10; 10.239; 30.016 88.261; 88.141; 89.215 | 3070 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130238 | CIF | C46 H50 N2 U | P -1 | 10.435; 20.16; 20.298 64.74; 83.339; 82.279 | 3819 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130239 | CIF | C30 H51 N3 U | P 1 21/c 1 | 11.055; 15.371; 17.245 90; 90.119; 90 | 2930 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130240 | CIF | C41 H70 N2 Si2 U | P 1 21/c 1 | 18.785; 11.512; 19.584 90; 101.439; 90 | 4151 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130241 | CIF | C34 H44 N2 U | P 1 21/c 1 | 10.2536; 14.957; 20.016 90; 95.213; 90 | 3057 | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. Journal of the American Chemical Society, 2016, 138, 5130-5142 |
| 4130242 | CIF | C206 H162 N4 | P -1 | 10.4496; 21.0182; 23.6119 114.188; 96.984; 97.993 | 4592.2 | Jiang, Xing; O'Brien, Zachary J; Yang, Song; Lai, Lan Huong; Buenaflor, Jeffrey; Tan, Colleen; Khan, Saeed; Houk, K. N.; Garcia-Garibay, Miguel A Crystal Fluidity Reflected by Fast Rotational Motion at the Core, Branches, and Peripheral Aromatic Groups of a Dendrimeric Molecular Rotor. Journal of the American Chemical Society, 2016, 138, 4650-4656 |
| 4130243 | CIF | C21 H22 N2 O4 | P 1 21 1 | 6.90752; 7.97355; 15.9186 90; 100.406; 90 | 862.336 | Kirillova, Mariia S.; Muratore, Michael E.; Dorel, Ruth; Echavarren, Antonio M. Concise Total Synthesis of Lundurines A-C Enabled by Gold Catalysis and a Homodienyl Retro-Ene/Ene Isomerization. Journal of the American Chemical Society, 2016, 138, 3671-3674 |
| 4130244 | CIF | C22 H29 I N2 O3 | P 1 21 1 | 10.2983; 8.8605; 12.0623 90; 93.01; 90 | 1099.14 | Kirillova, Mariia S.; Muratore, Michael E.; Dorel, Ruth; Echavarren, Antonio M. Concise Total Synthesis of Lundurines A-C Enabled by Gold Catalysis and a Homodienyl Retro-Ene/Ene Isomerization. Journal of the American Chemical Society, 2016, 138, 3671-3674 |
| 4130245 | CIF | C21 H22 N2 O4 | P 21 21 2 | 20.6494; 12.6339; 6.81766 90; 90; 90 | 1778.61 | Kirillova, Mariia S.; Muratore, Michael E.; Dorel, Ruth; Echavarren, Antonio M. Concise Total Synthesis of Lundurines A-C Enabled by Gold Catalysis and a Homodienyl Retro-Ene/Ene Isomerization. Journal of the American Chemical Society, 2016, 138, 3671-3674 |
| 4130246 | CIF | C21 H20 N2 O6 | P 21 21 21 | 5.8695; 9.7673; 33.518 90; 90; 90 | 1921.56 | Park, Jung-Woo; Chen, Zhiwei; Dong, Vy M. Rhodium-Catalyzed Enantioselective Cycloisomerization to Cyclohexenes Bearing Quaternary Carbon Centers. Journal of the American Chemical Society, 2016, 138, 3310-3313 |
| 4130247 | CIF | C14 H11 N O4 | P 1 21 1 | 5.7277; 6.9124; 15.0468 90; 97.42; 90 | 590.75 | Kawamata, Yu; Hashimoto, Takuya; Maruoka, Keiji A Chiral Electrophilic Selenium Catalyst for Highly Enantioselective Oxidative Cyclization. Journal of the American Chemical Society, 2016, 138, 5206-5209 |
| 4130248 | CIF | C20 H30 O3 | P -1 | 6.322; 11.622; 12.849 97.27; 90.705; 100.009 | 921.7 | Kawamata, Yu; Hashimoto, Takuya; Maruoka, Keiji A Chiral Electrophilic Selenium Catalyst for Highly Enantioselective Oxidative Cyclization. Journal of the American Chemical Society, 2016, 138, 5206-5209 |
| 4130249 | CIF | C26 H33 N O5 | P 1 21 1 | 25.1792; 9.4169; 32.0162 90; 105.52; 90 | 7314.6 | Kawamata, Yu; Hashimoto, Takuya; Maruoka, Keiji A Chiral Electrophilic Selenium Catalyst for Highly Enantioselective Oxidative Cyclization. Journal of the American Chemical Society, 2016, 138, 5206-5209 |
| 4130250 | CIF | C25 H16 Al F15 O2 Si | P 1 21/n 1 | 11.885; 14.91; 15.662 90; 83.841; 90 | 2759.4 | Chen, Jiawei; Falivene, Laura; Caporaso, Lucia; Cavallo, Luigi; Chen, Eugene Y.-X. Selective Reduction of CO2 to CH4 by Tandem Hydrosilylation with Mixed Al/B Catalysts. Journal of the American Chemical Society, 2016, 138, 5321-5333 |
| 4130251 | CIF | C25 H16 B F15 O2 Si | P -1 | 9.3295; 10.959; 14.335 105.772; 90.51; 103.244 | 1369 | Chen, Jiawei; Falivene, Laura; Caporaso, Lucia; Cavallo, Luigi; Chen, Eugene Y.-X. Selective Reduction of CO2 to CH4 by Tandem Hydrosilylation with Mixed Al/B Catalysts. Journal of the American Chemical Society, 2016, 138, 5321-5333 |
| 4130252 | CIF | C40 H34 Fe N8 | P 1 21/n 1 | 11.788; 15.996; 19.544 90; 102.051; 90 | 3604 | Travieso-Puente, Raquel; Broekman, J. O. P.; Chang, Mu-Chieh; Demeshko, Serhiy; Meyer, Franc; Otten, Edwin Spin-Crossover in a Pseudo-tetrahedral Bis(formazanate) Iron Complex. Journal of the American Chemical Society, 2016, 138, 5503-5506 |
| 4130253 | CIF | C28 H35 Fe0.5 N4.5 | P 1 2/n 1 | 12.1244; 14.1187; 18.1921 90; 93.083; 90 | 3109.6 | Travieso-Puente, Raquel; Broekman, J. O. P.; Chang, Mu-Chieh; Demeshko, Serhiy; Meyer, Franc; Otten, Edwin Spin-Crossover in a Pseudo-tetrahedral Bis(formazanate) Iron Complex. Journal of the American Chemical Society, 2016, 138, 5503-5506 |
| 4130254 | CIF | C40 H34 Fe N8 | P 1 21/n 1 | 8.5794; 11.7518; 33.5114 90; 95.9494; 90 | 3360.5 | Travieso-Puente, Raquel; Broekman, J. O. P.; Chang, Mu-Chieh; Demeshko, Serhiy; Meyer, Franc; Otten, Edwin Spin-Crossover in a Pseudo-tetrahedral Bis(formazanate) Iron Complex. Journal of the American Chemical Society, 2016, 138, 5503-5506 |
| 4130255 | CIF | C13 H17 N O4 S | P 1 21 1 | 9.271; 8.423; 9.739 90; 114.214; 90 | 693.6 | Hatano, Miyuki; Ebe, Yusuke; Nishimura, Takahiro; Yorimitsu, Hideki Asymmetric Alkylation of N-Sulfonylbenzamides with Vinyl Ethers via C-H Bond Activation Catalyzed by Hydroxoiridium/Chiral Diene Complexes. Journal of the American Chemical Society, 2016, 138, 4010-4013 |
| 4130256 | CIF | C34 H38 N2 O8 S2 | P 21 21 21 | 8.665; 18.938; 21.097 90; 90; 90 | 3462 | Hatano, Miyuki; Ebe, Yusuke; Nishimura, Takahiro; Yorimitsu, Hideki Asymmetric Alkylation of N-Sulfonylbenzamides with Vinyl Ethers via C-H Bond Activation Catalyzed by Hydroxoiridium/Chiral Diene Complexes. Journal of the American Chemical Society, 2016, 138, 4010-4013 |
| 4130257 | CIF | C31 H46 B F8 N5 Ru | P 1 | 9.121; 10.639; 11.3056 67.036; 73.952; 85.831 | 970 | Simonetti, Marco; Perry, Gregory J. P.; Cambeiro, Xacobe C.; Juliá-Hernández, Francisco; Arokianathar, Jude N.; Larrosa, Igor Ru-Catalyzed C-H Arylation of Fluoroarenes with Aryl Halides. Journal of the American Chemical Society, 2016, 138, 3596-3606 |
| 4130258 | CIF | C32 H58 Cl10 N6 Ru3 | C 1 2/m 1 | 21.221; 13.81; 9.163 90; 103.056; 90 | 2615.9 | Simonetti, Marco; Perry, Gregory J. P.; Cambeiro, Xacobe C.; Juliá-Hernández, Francisco; Arokianathar, Jude N.; Larrosa, Igor Ru-Catalyzed C-H Arylation of Fluoroarenes with Aryl Halides. Journal of the American Chemical Society, 2016, 138, 3596-3606 |
| 4130259 | CIF | C30 H54 B2 F8 N6 Ru | P b a n :2 | 10.8977; 34.0657; 11.0451 90; 90; 90 | 4100.4 | Simonetti, Marco; Perry, Gregory J. P.; Cambeiro, Xacobe C.; Juliá-Hernández, Francisco; Arokianathar, Jude N.; Larrosa, Igor Ru-Catalyzed C-H Arylation of Fluoroarenes with Aryl Halides. Journal of the American Chemical Society, 2016, 138, 3596-3606 |
| 4130260 | CIF | C22 H25 Cl3 F4 O2 Ru | P -1 | 9.9568; 10.1815; 13.3346 107.735; 99.041; 94.998 | 1258.4 | Simonetti, Marco; Perry, Gregory J. P.; Cambeiro, Xacobe C.; Juliá-Hernández, Francisco; Arokianathar, Jude N.; Larrosa, Igor Ru-Catalyzed C-H Arylation of Fluoroarenes with Aryl Halides. Journal of the American Chemical Society, 2016, 138, 3596-3606 |
| 4130261 | CIF | C19 H21 Cl5 Fe O3 | P 1 | 7.8369; 11.551; 14.045 109.829; 96.058; 107.644 | 1108.6 | Landry, Matthew L.; Hu, Dennis X.; McKenna, Grace M.; Burns, Noah Z. Catalytic Enantioselective Dihalogenation and the Selective Synthesis of (-)-Deschloromytilipin A and (-)-Danicalipin A. Journal of the American Chemical Society, 2016, 138, 5150-5158 |
| 4130262 | CIF | C15 H16 Br Cl5 O3 | C 1 2 1 | 21.3275; 5.0556; 18.7396 90; 110.71; 90 | 1890 | Landry, Matthew L.; Hu, Dennis X.; McKenna, Grace M.; Burns, Noah Z. Catalytic Enantioselective Dihalogenation and the Selective Synthesis of (-)-Deschloromytilipin A and (-)-Danicalipin A. Journal of the American Chemical Society, 2016, 138, 5150-5158 |
| 4130263 | CIF | C19 H21 Br5 Fe O3 | P 1 21/n 1 | 7.2028; 28.4716; 11.0949 90; 90.106; 90 | 2275.29 | Landry, Matthew L.; Hu, Dennis X.; McKenna, Grace M.; Burns, Noah Z. Catalytic Enantioselective Dihalogenation and the Selective Synthesis of (-)-Deschloromytilipin A and (-)-Danicalipin A. Journal of the American Chemical Society, 2016, 138, 5150-5158 |
| 4130264 | CIF | C15 H16 Br6 O3 | C 1 2 1 | 21.9618; 5.2143; 18.6577 90; 110.597; 90 | 2000 | Landry, Matthew L.; Hu, Dennis X.; McKenna, Grace M.; Burns, Noah Z. Catalytic Enantioselective Dihalogenation and the Selective Synthesis of (-)-Deschloromytilipin A and (-)-Danicalipin A. Journal of the American Chemical Society, 2016, 138, 5150-5158 |
| 4130265 | CIF | C127 H112 Au6 B2 F8 N2 O2 P6 | P 1 | 13.547; 14.829; 15.76 111.55; 93.03; 98.03 | 2897.1 | He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response. Journal of the American Chemical Society, 2016, 138, 5634-5643 |
| 4130266 | CIF | C114 H100 Au6 B2 F8 N2 P6 | P 21 21 21 | 16.145; 17.072; 41.943 90; 90; 90 | 11561 | He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response. Journal of the American Chemical Society, 2016, 138, 5634-5643 |
| 4130267 | CIF | C124 H102 Au6 B2 F8 N2 P6 | P 1 21 1 | 14.004; 17.94; 24.92 90; 105.84; 90 | 6023 | He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response. Journal of the American Chemical Society, 2016, 138, 5634-5643 |
| 4130268 | CIF | C64 H58 Au3 B F4 N O0.5 P3 | C 1 c 1 | 22.493; 12.072; 22.686 90; 103.45; 90 | 5991 | He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response. Journal of the American Chemical Society, 2016, 138, 5634-5643 |
| 4130269 | CIF | C118 H96 Ag2 Au6 B4 F16 N8 P6 | C 1 2/c 1 | 59.465; 21.294; 47.96 90; 114.67; 90 | 55186 | He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response. Journal of the American Chemical Society, 2016, 138, 5634-5643 |
| 4130270 | CIF | C40 H28 O16 Zr3 | P m -3 m | 28.1991; 28.1991; 28.1991 90; 90; 90 | 22423.6 | Wang, Bin; Lv, Xiu-Liang; Feng, Dawei; Xie, Lin-Hua; Zhang, Jian; Li, Ming; Xie, Yabo; Li, Jian-Rong; Zhou, Hong-Cai Highly Stable Zr(IV)-Based Metal-Organic Frameworks for the Detection and Removal of Antibiotics and Organic Explosives in Water. Journal of the American Chemical Society, 2016, 138, 6204-6216 |
| 4130271 | CIF | C25 H26 N2 O5 S | P 1 21/c 1 | 15.0822; 6.6857; 22.5771 90; 93.476; 90 | 2272.4 | Ding, Dong; Mou, Tao; Feng, Minghao; Jiang, Xuefeng Utility of Ligand Effect in Homogenous Gold Catalysis: Enabling Regiodivergent π-Bond-Activated Cyclization. Journal of the American Chemical Society, 2016, 138, 5218-5221 |
| 4130272 | CIF | C24 H22 N2 O4 S | P 1 21/n 1 | 12.9837; 9.529; 17.8751 90; 108.758; 90 | 2094.07 | Ding, Dong; Mou, Tao; Feng, Minghao; Jiang, Xuefeng Utility of Ligand Effect in Homogenous Gold Catalysis: Enabling Regiodivergent π-Bond-Activated Cyclization. Journal of the American Chemical Society, 2016, 138, 5218-5221 |
| 4130273 | CIF | C23 H21 N O3 S | P 1 21/c 1 | 13.2698; 7.9678; 18.6432 90; 102.755; 90 | 1922.52 | Ding, Dong; Mou, Tao; Feng, Minghao; Jiang, Xuefeng Utility of Ligand Effect in Homogenous Gold Catalysis: Enabling Regiodivergent π-Bond-Activated Cyclization. Journal of the American Chemical Society, 2016, 138, 5218-5221 |
| 4130274 | CIF | C24 H22 N2 O4 S | P 64 | 18.7913; 18.7913; 11.3257 90; 90; 120 | 3463.5 | Ding, Dong; Mou, Tao; Feng, Minghao; Jiang, Xuefeng Utility of Ligand Effect in Homogenous Gold Catalysis: Enabling Regiodivergent π-Bond-Activated Cyclization. Journal of the American Chemical Society, 2016, 138, 5218-5221 |
| 4130275 | CIF | C14 H28 N4 O2 | P 1 21 1 | 12.8; 4.5826; 28.8266 90; 96.488; 90 | 1680.06 | 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 |
| 4130276 | CIF | C14 H27 N4 O1.5 | P 1 21/c 1 | 30.18; 4.5911; 23.9057 90; 107.482; 90 | 3159.4 | 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 |
| 4130277 | CIF | C8.73 H16.73 N2.91 O1.09 | P 1 21/c 1 | 27.684; 4.5906; 23.937 90; 113.395; 90 | 2792 | 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 |
| 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 |
| 4130279 | CIF | C14 H28 N4 O2 | P 1 21 1 | 12.766; 4.5679; 28.756 90; 96.47; 90 | 1666.2 | 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 |
| 4130280 | CIF | C30 H29 F3 N4 O | P 1 21/n 1 | 8.3; 20.7517; 15.9111 90; 107.372; 90 | 2615.5 | Radkov, Vasily; Roisnel, Thierry; Trifonov, Alexander; Carpentier, Jean-François; Kirillov, Evgueni Tandem C(sp(2))-OMe Activation/C(sp(2))-C(sp(2)) Coupling in Early Transition-Metal Complexes: Aromatic C-O Activation beyond Late Transition Metals. Journal of the American Chemical Society, 2016, 138, 4350-4353 |
| 4130281 | CIF | C60 H55 F6 N8 O2 Y | P -1 | 12.2688; 14.9603; 17.3736 90.797; 91.86; 96.201 | 3168.02 | Radkov, Vasily; Roisnel, Thierry; Trifonov, Alexander; Carpentier, Jean-François; Kirillov, Evgueni Tandem C(sp(2))-OMe Activation/C(sp(2))-C(sp(2)) Coupling in Early Transition-Metal Complexes: Aromatic C-O Activation beyond Late Transition Metals. Journal of the American Chemical Society, 2016, 138, 4350-4353 |
| 4130282 | CIF | C75 H70 F6 N8 O2 Sc | P -1 | 11.8165; 13.72; 22.645 73.837; 84.453; 64.67 | 3186.1 | Radkov, Vasily; Roisnel, Thierry; Trifonov, Alexander; Carpentier, Jean-François; Kirillov, Evgueni Tandem C(sp(2))-OMe Activation/C(sp(2))-C(sp(2)) Coupling in Early Transition-Metal Complexes: Aromatic C-O Activation beyond Late Transition Metals. Journal of the American Chemical Society, 2016, 138, 4350-4353 |
| 4130283 | CIF | C125 H111 F12 N16 Y2 | P -1 | 13.0597; 13.0509; 33.9213 83.98; 82.797; 75.68 | 5541.3 | Radkov, Vasily; Roisnel, Thierry; Trifonov, Alexander; Carpentier, Jean-François; Kirillov, Evgueni Tandem C(sp(2))-OMe Activation/C(sp(2))-C(sp(2)) Coupling in Early Transition-Metal Complexes: Aromatic C-O Activation beyond Late Transition Metals. Journal of the American Chemical Society, 2016, 138, 4350-4353 |
| 4130284 | CIF | C62 H61 F6 N8 O Sc | P -1 | 12.0429; 13.815; 17.6182 75.629; 79.249; 88.76 | 2788.7 | Radkov, Vasily; Roisnel, Thierry; Trifonov, Alexander; Carpentier, Jean-François; Kirillov, Evgueni Tandem C(sp(2))-OMe Activation/C(sp(2))-C(sp(2)) Coupling in Early Transition-Metal Complexes: Aromatic C-O Activation beyond Late Transition Metals. Journal of the American Chemical Society, 2016, 138, 4350-4353 |
| 4130285 | CIF | C29 H18 Cl2 O4 | P -1 | 7.127; 7.465; 11.374 96.247; 90.085; 100.706 | 590.9 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130286 | CIF | C36 H36 O6 | P -1 | 8.6953; 8.849; 20.955 83.764; 81.19; 89.372 | 1583.9 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130287 | CIF | C31 H22 O5 | P 1 21/n 1 | 16.538; 6.995; 22.907 90; 106.113; 90 | 2546 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130288 | CIF | C76 H72 O17 | P -1 | 9.613; 13.191; 13.847 70.53; 89.281; 79.425 | 1625.1 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130289 | CIF | C59 H38 Cl6 O12 | P -1 | 7.8633; 12.4758; 14.475 87.013; 79.31; 78.04 | 1364.9 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130290 | CIF | C65 H50 O19 | P -1 | 8.0494; 12.367; 14.371 87.308; 76.651; 77.2 | 1357.3 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130291 | CIF | C56 H28 I4 O8 | P -1 | 9.2751; 11.8804; 13.115 103.213; 104.214; 112.564 | 1206.7 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130292 | CIF | C70 H46 N4 O14 | C 1 2/c 1 | 38.92; 4.918; 38.53 90; 101.655; 90 | 7223 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130293 | CIF | C42 H30 N4 O6 | P -1 | 8.896; 9.089; 10.731 88.821; 89.682; 85.649 | 865 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130294 | CIF | C60 H44 N4 O8 | C 1 2 1 | 21.686; 4.784; 27.556 90; 102.913; 90 | 2787 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130295 | CIF | C68 H60 N4 O10 | P c a 21 | 9.9571; 17.4414; 42.952 90; 90; 90 | 7459.3 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130296 | CIF | C56 H68 N4 O8 | P -1 | 10.0954; 16.195; 16.93 105.474; 95.831; 91.576 | 2649.5 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130297 | CIF | C56 H36 N4 O8 | I -4 | 25.112; 25.112; 8.489 90; 90; 90 | 5353 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130298 | CIF | C72 H68 N4 O16 | P -1 | 10.2111; 10.4183; 16.01 78.912; 83.712; 72.751 | 1593.7 | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. Journal of the American Chemical Society, 2016, 138, 5939-5956 |
| 4130299 | CIF | C96 H96 Cu2 F12 N8 P6 | P -1 | 12.1652; 12.9516; 15.5693 73.1952; 74.4114; 77.2486 | 2234.56 | Takeda, Hiroyuki; Ohashi, Kenji; Sekine, Akiko; Ishitani, Osamu Photocatalytic CO2 Reduction Using Cu(I) Photosensitizers with a Fe(II) Catalyst. Journal of the American Chemical Society, 2016, 138, 4354-4357 |
| 4130300 | CIF | C44 H46 Cu F6 N2 P3 | P 1 21/c 1 | 9.6839; 15.3663; 27.7105 90; 96.276; 90 | 4098.77 | Takeda, Hiroyuki; Ohashi, Kenji; Sekine, Akiko; Ishitani, Osamu Photocatalytic CO2 Reduction Using Cu(I) Photosensitizers with a Fe(II) Catalyst. Journal of the American Chemical Society, 2016, 138, 4354-4357 |
| 4130301 | CIF | C24 H6 O18 Zn6 | R -3 c :H | 22.9556; 22.9556; 15.883 90; 90; 120 | 7248.4 | Luo, Feng; Yan, Changsheng; Dang, Lilong; Krishna, Rajamani; Zhou, Wei; Wu, Hui; Dong, Xinglong; Han, Yu; Hu, Tong-Liang; O'Keeffe, Michael; Wang, Lingling; Luo, Mingbiao; Lin, Rui-Biao; Chen, Banglin UTSA-74: A MOF-74 Isomer with Two Accessible Binding Sites per Metal Center for Highly Selective Gas Separation. Journal of the American Chemical Society, 2016, 138, 5678-5684 |
| 4130302 | CIF | C27 H6 O24 Zn6 | R -3 c :H | 22.9511; 22.9511; 15.8965 90; 90; 120 | 7251.7 | Luo, Feng; Yan, Changsheng; Dang, Lilong; Krishna, Rajamani; Zhou, Wei; Wu, Hui; Dong, Xinglong; Han, Yu; Hu, Tong-Liang; O'Keeffe, Michael; Wang, Lingling; Luo, Mingbiao; Lin, Rui-Biao; Chen, Banglin UTSA-74: A MOF-74 Isomer with Two Accessible Binding Sites per Metal Center for Highly Selective Gas Separation. Journal of the American Chemical Society, 2016, 138, 5678-5684 |
| 4130303 | CIF | C12 H3 O10.5 Zn3 | R -3 c :H | 22.917; 22.917; 15.9024 90; 90; 120 | 7232.8 | Luo, Feng; Yan, Changsheng; Dang, Lilong; Krishna, Rajamani; Zhou, Wei; Wu, Hui; Dong, Xinglong; Han, Yu; Hu, Tong-Liang; O'Keeffe, Michael; Wang, Lingling; Luo, Mingbiao; Lin, Rui-Biao; Chen, Banglin UTSA-74: A MOF-74 Isomer with Two Accessible Binding Sites per Metal Center for Highly Selective Gas Separation. Journal of the American Chemical Society, 2016, 138, 5678-5684 |
| 4130304 | CIF | C23 H38 O3 | P 1 | 6.2267; 6.7164; 13.4269 77.552; 80.072; 68.189 | 506.43 | Obradors, Carla; Martinez, Ruben M.; Shenvi, Ryan A. Ph(i-PrO)SiH2: An Exceptional Reductant for Metal-Catalyzed Hydrogen Atom Transfers. Journal of the American Chemical Society, 2016, 138, 4962-4971 |
| 4130305 | CIF | C19 H21 N O3 | P 1 | 6.7858; 7.7709; 8.1797 112.386; 91.911; 96.499 | 394.89 | Hayashi, Masaki; Bachman, Shoshana; Hashimoto, Satoshi; Eichman, Chad C.; Stoltz, Brian M. Ni-Catalyzed Enantioselective C-Acylation of α-Substituted Lactams. Journal of the American Chemical Society, 2016, 138, 8997-9000 |
| 4130306 | CIF | C67 H72 Cl2 N4 O4 Zn | P -1 | 14.397; 14.582; 14.95 77.601; 71.245; 79.726 | 2882.2 | Sakamoto, Ryota; Iwashima, Toshiki; Kögel, Julius F; Kusaka, Shinpei; Tsuchiya, Mizuho; Kitagawa, Yasutaka; Nishihara, Hiroshi Dissymmetric Bis(dipyrrinato)zinc(II) Complexes: Rich Variety and Bright Red to Near-Infrared Luminescence with a Large Pseudo-Stokes Shift. Journal of the American Chemical Society, 2016, 138, 5666-5677 |
| 4130307 | CIF | C73 H70 N4 O Zn | P -1 | 11.873; 13.492; 18.85 94.685; 105.074; 96.671 | 2876.2 | Sakamoto, Ryota; Iwashima, Toshiki; Kögel, Julius F; Kusaka, Shinpei; Tsuchiya, Mizuho; Kitagawa, Yasutaka; Nishihara, Hiroshi Dissymmetric Bis(dipyrrinato)zinc(II) Complexes: Rich Variety and Bright Red to Near-Infrared Luminescence with a Large Pseudo-Stokes Shift. Journal of the American Chemical Society, 2016, 138, 5666-5677 |
| 4130308 | CIF | C21 H26 O4 | P 21 21 21 | 7.7585; 9.1039; 26.2256 90; 90; 90 | 1852.4 | Liu, Wen-Bo; Okamoto, Noriko; Alexy, Eric J.; Hong, Allen Y.; Tran, Kristy; Stoltz, Brian M. Enantioselective γ-Alkylation of α,β-Unsaturated Malonates and Ketoesters by a Sequential Ir-Catalyzed Asymmetric Allylic Alkylation/Cope Rearrangement. Journal of the American Chemical Society, 2016, 138, 5234-5237 |
| 4130309 | CIF | C19 H26 O2 | P 21 21 21 | 6.1787; 9.0018; 29.47 90; 90; 90 | 1639.1 | Liu, Wen-Bo; Okamoto, Noriko; Alexy, Eric J.; Hong, Allen Y.; Tran, Kristy; Stoltz, Brian M. Enantioselective γ-Alkylation of α,β-Unsaturated Malonates and Ketoesters by a Sequential Ir-Catalyzed Asymmetric Allylic Alkylation/Cope Rearrangement. Journal of the American Chemical Society, 2016, 138, 5234-5237 |
| 4130310 | CIF | C26 H27 Cl2 Fe N25 O8 | P 1 21/n 1 | 11.605; 16.245; 20.204 90; 97.184; 90 | 3779 | Myers, Thomas W.; Bjorgaard, Josiah A.; Brown, Kathryn E.; Chavez, David E.; Hanson, Susan K.; Scharff, R. Jason; Tretiak, Sergei; Veauthier, Jacqueline M. Energetic Chromophores: Low-Energy Laser Initiation in Explosive Fe(II) Tetrazine Complexes. Journal of the American Chemical Society, 2016, 138, 4685-4692 |
| 4130311 | CIF | C21 H24 Cl2 Fe N24 O8 | P 1 21/n 1 | 21.211; 8.6644; 21.347 90; 115.966; 90 | 3527.1 | Myers, Thomas W.; Bjorgaard, Josiah A.; Brown, Kathryn E.; Chavez, David E.; Hanson, Susan K.; Scharff, R. Jason; Tretiak, Sergei; Veauthier, Jacqueline M. Energetic Chromophores: Low-Energy Laser Initiation in Explosive Fe(II) Tetrazine Complexes. Journal of the American Chemical Society, 2016, 138, 4685-4692 |
| 4130312 | CIF | C27 H38 Cl2 Fe N24 O9 | P 1 21/c 1 | 19.1; 13.96; 16.03 90; 109.165; 90 | 4037 | Myers, Thomas W.; Bjorgaard, Josiah A.; Brown, Kathryn E.; Chavez, David E.; Hanson, Susan K.; Scharff, R. Jason; Tretiak, Sergei; Veauthier, Jacqueline M. Energetic Chromophores: Low-Energy Laser Initiation in Explosive Fe(II) Tetrazine Complexes. Journal of the American Chemical Society, 2016, 138, 4685-4692 |
| 4130313 | CIF | C39 H62 Cl2 Fe N32 O13 | P -1 | 12.941; 15.79; 16.28 115.955; 100.085; 94.838 | 2896 | Myers, Thomas W.; Bjorgaard, Josiah A.; Brown, Kathryn E.; Chavez, David E.; Hanson, Susan K.; Scharff, R. Jason; Tretiak, Sergei; Veauthier, Jacqueline M. Energetic Chromophores: Low-Energy Laser Initiation in Explosive Fe(II) Tetrazine Complexes. Journal of the American Chemical Society, 2016, 138, 4685-4692 |
| 4130314 | CIF | C10 H8 F2 O2 | P 1 | 5.4814; 8.5363; 10.1397 71.243; 75.321; 76.523 | 428.59 | Borrajo-Calleja, Gustavo M; Bizet, Vincent; Mazet, Clément Palladium-Catalyzed Enantioselective Intermolecular Carboetherification of Dihydrofurans. Journal of the American Chemical Society, 2016, 138, 4014-4017 |
| 4130315 | CIF | C11 H12 O2 | P 21 21 21 | 4.7621; 8.4156; 22.4052 90; 90; 90 | 897.91 | Borrajo-Calleja, Gustavo M; Bizet, Vincent; Mazet, Clément Palladium-Catalyzed Enantioselective Intermolecular Carboetherification of Dihydrofurans. Journal of the American Chemical Society, 2016, 138, 4014-4017 |
| 4130316 | CIF | C18 H18 O2 | P 21 21 21 | 7.43203; 8.92309; 21.25373 90; 90; 90 | 1409.48 | Borrajo-Calleja, Gustavo M; Bizet, Vincent; Mazet, Clément Palladium-Catalyzed Enantioselective Intermolecular Carboetherification of Dihydrofurans. Journal of the American Chemical Society, 2016, 138, 4014-4017 |
| 4130317 | CIF | C54 H72 Co3 O30 P6 S3 | P 63/m | 16.348; 16.348; 14.922 90; 90; 120 | 3454 | Pili, Simona; Argent, Stephen P.; Morris, Christopher G.; Rought, Peter; García-Sakai, Victoria; Silverwood, Ian P.; Easun, Timothy L.; Li, Ming; Warren, Mark R.; Murray, Claire A.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin Proton Conduction in a Phosphonate-Based Metal-Organic Framework Mediated by Intrinsic "Free Diffusion inside a Sphere". Journal of the American Chemical Society, 2016, 138, 6352-6355 |
| 4130318 | CIF | C54 H72 N0 Ni3 O30 P6 S3 | P 63/m | 16.323; 16.323; 14.933 90; 90; 120 | 3446 | Pili, Simona; Argent, Stephen P.; Morris, Christopher G.; Rought, Peter; García-Sakai, Victoria; Silverwood, Ian P.; Easun, Timothy L.; Li, Ming; Warren, Mark R.; Murray, Claire A.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin Proton Conduction in a Phosphonate-Based Metal-Organic Framework Mediated by Intrinsic "Free Diffusion inside a Sphere". Journal of the American Chemical Society, 2016, 138, 6352-6355 |
| 4130319 | CIF | C78.5 H72 | P -1 | 15.8435; 19.3722; 20.9937 94.124; 90.49; 105.769 | 6182.3 | Golder, Matthew R.; Colwell, Curtis E.; Wong, Bryan M.; Zakharov, Lev N.; Zhen, Jingxin; Jasti, Ramesh Iterative Reductive Aromatization/Ring-Closing Metathesis Strategy toward the Synthesis of Strained Aromatic Belts. Journal of the American Chemical Society, 2016, 138, 6577-6582 |
| 4130320 | CIF | C60 H48 O2 | P 1 21/c 1 | 13.3012; 9.9339; 17.0395 90; 110.381; 90 | 2110.53 | Golder, Matthew R.; Colwell, Curtis E.; Wong, Bryan M.; Zakharov, Lev N.; Zhen, Jingxin; Jasti, Ramesh Iterative Reductive Aromatization/Ring-Closing Metathesis Strategy toward the Synthesis of Strained Aromatic Belts. Journal of the American Chemical Society, 2016, 138, 6577-6582 |
| 4130321 | CIF | C28 H29 Rh | P 21 21 21 | 10.2511; 12.0614; 16.84 90; 90; 90 | 2082.1 | Zheng, Jun; Cui, Wen-Jun; Zheng, Chao; You, Shu-Li Synthesis and Application of Chiral Spiro Cp Ligands in Rhodium-Catalyzed Asymmetric Oxidative Coupling of Biaryl Compounds with Alkenes. Journal of the American Chemical Society, 2016, 138, 5242-5245 |
| 4130322 | CIF | C30 H33 O2 Rh | P 21 21 21 | 7.156; 14.439; 23.483 90; 90; 90 | 2426.4 | Zheng, Jun; Cui, Wen-Jun; Zheng, Chao; You, Shu-Li Synthesis and Application of Chiral Spiro Cp Ligands in Rhodium-Catalyzed Asymmetric Oxidative Coupling of Biaryl Compounds with Alkenes. Journal of the American Chemical Society, 2016, 138, 5242-5245 |
| 4130323 | CIF | C40 H50 B2 | P -1 | 6.1037; 10.0273; 14.3207 109.973; 91.761; 90.472 | 823.2 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130324 | CIF | C55.5 H76 B2 Li2 O3 | P 1 21/n 1 | 23.6888; 14.3688; 29.305 90; 100.858; 90 | 9796.2 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130325 | CIF | C60 H90 B2 Li2 O5 | P n a 21 | 26.7566; 10.14; 20.7717 90; 90; 90 | 5635.6 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130326 | CIF | C92 H124 B4 Li4 O3 | C 1 2/c 1 | 28.292; 10.6612; 30.648 90; 113.952; 90 | 8448.2 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130327 | CIF | C56 H82 B2 K2 O4 | P 1 21/c 1 | 15.5756; 21.2523; 17.6877 90; 112.775; 90 | 5398.4 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130328 | CIF | C48 H65 B2 K O2 | P 21 21 21 | 13.6225; 16.3106; 19.6114 90; 90; 90 | 4357.5 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130329 | CIF | C56 H84 B2 K2 O4 | P 1 21/c 1 | 13.834; 19.2446; 21.4964 90; 103.878; 90 | 5555.9 | Kaese, Thomas; Hübner, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Forming B-B Bonds by the Controlled Reduction of a Tetraaryl-diborane(6). Journal of the American Chemical Society, 2016, 138, 6224-6233 |
| 4130330 | CIF | C18 H26 B2 F2 O4 | C 1 2/c 1 | 21.448; 7.166; 12.5448 90; 98.521; 90 | 1906.8 | Zhou, Jing; Kuntze-Fechner, Maximilian W; Bertermann, Rüdiger; Paul, Ursula S. D.; Berthel, Johannes H. J.; Friedrich, Alexandra; Du, Zhenting; Marder, Todd B.; Radius, Udo Preparing (Multi)Fluoroarenes as Building Blocks for Synthesis: Nickel-Catalyzed Borylation of Polyfluoroarenes via C-F Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 5250-5253 |
| 4130331 | CIF | C18 H25 B2 F3 O4 | P 1 21/c 1 | 6.518; 10.4277; 14.3711 90; 97.307; 90 | 968.84 | Zhou, Jing; Kuntze-Fechner, Maximilian W; Bertermann, Rüdiger; Paul, Ursula S. D.; Berthel, Johannes H. J.; Friedrich, Alexandra; Du, Zhenting; Marder, Todd B.; Radius, Udo Preparing (Multi)Fluoroarenes as Building Blocks for Synthesis: Nickel-Catalyzed Borylation of Polyfluoroarenes via C-F Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 5250-5253 |
| 4130332 | CIF | C18 H26 B2 F2 O4 | P 1 21/n 1 | 6.848; 45.132; 9.3766 90; 99.586; 90 | 2857.5 | Zhou, Jing; Kuntze-Fechner, Maximilian W; Bertermann, Rüdiger; Paul, Ursula S. D.; Berthel, Johannes H. J.; Friedrich, Alexandra; Du, Zhenting; Marder, Todd B.; Radius, Udo Preparing (Multi)Fluoroarenes as Building Blocks for Synthesis: Nickel-Catalyzed Borylation of Polyfluoroarenes via C-F Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 5250-5253 |
| 4130333 | CIF | C48 H50 F4 N4 Ni | P b c a | 19.9415; 18.3839; 22.7755 90; 90; 90 | 8349.6 | Zhou, Jing; Kuntze-Fechner, Maximilian W; Bertermann, Rüdiger; Paul, Ursula S. D.; Berthel, Johannes H. J.; Friedrich, Alexandra; Du, Zhenting; Marder, Todd B.; Radius, Udo Preparing (Multi)Fluoroarenes as Building Blocks for Synthesis: Nickel-Catalyzed Borylation of Polyfluoroarenes via C-F Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 5250-5253 |
| 4130334 | CIF | C54 H50 D6 F4 N4 Ni | P -1 | 10.652; 14.778; 14.855 92.736; 101.401; 91.53 | 2288.1 | Zhou, Jing; Kuntze-Fechner, Maximilian W; Bertermann, Rüdiger; Paul, Ursula S. D.; Berthel, Johannes H. J.; Friedrich, Alexandra; Du, Zhenting; Marder, Todd B.; Radius, Udo Preparing (Multi)Fluoroarenes as Building Blocks for Synthesis: Nickel-Catalyzed Borylation of Polyfluoroarenes via C-F Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 5250-5253 |
| 4130335 | CIF | C37 H40.11 Cl5 Cu2 F12 N6.89 O2.78 Sb2 | P -1 | 9.5135; 13.842; 20.1911 106.146; 93.216; 107.792 | 2402.75 | Cao, Rui; Saracini, Claudio; Ginsbach, Jake W.; Kieber-Emmons, Matthew T; Siegler, Maxime A.; Solomon, Edward I.; Fukuzumi, Shunichi; Karlin, Kenneth D. Peroxo and Superoxo Moieties Bound to Copper Ion: Electron-Transfer Equilibrium with a Small Reorganization Energy. Journal of the American Chemical Society, 2016, 138, 7055-7066 |
| 4130336 | CIF | C35 H38 Cu2 F12 N6 O2 Sb2 | P 1 21/n 1 | 13.5404; 11.2264; 26.4611 90; 90.054; 90 | 4022.3 | Cao, Rui; Saracini, Claudio; Ginsbach, Jake W.; Kieber-Emmons, Matthew T; Siegler, Maxime A.; Solomon, Edward I.; Fukuzumi, Shunichi; Karlin, Kenneth D. Peroxo and Superoxo Moieties Bound to Copper Ion: Electron-Transfer Equilibrium with a Small Reorganization Energy. Journal of the American Chemical Society, 2016, 138, 7055-7066 |
| 4130337 | CIF | C38 H44 Cu2 F12 N7 O2 Sb2 | P -1 | 10.81274; 11.4439; 19.1353 78.4517; 78.6462; 73.1423 | 2195.71 | Cao, Rui; Saracini, Claudio; Ginsbach, Jake W.; Kieber-Emmons, Matthew T; Siegler, Maxime A.; Solomon, Edward I.; Fukuzumi, Shunichi; Karlin, Kenneth D. Peroxo and Superoxo Moieties Bound to Copper Ion: Electron-Transfer Equilibrium with a Small Reorganization Energy. Journal of the American Chemical Society, 2016, 138, 7055-7066 |
| 4130338 | CIF | C25 H37 Br2 N3 Ni | P 1 21/c 1 | 14.2268; 14.176; 14.358 90; 118.951; 90 | 2533.84 | Zhou, Wen; Zheng, Shuai; Schultz, Jason W.; Rath, Nigam P.; Mirica, Liviu M. Aromatic Cyanoalkylation through Double C-H Activation Mediated by Ni(III). Journal of the American Chemical Society, 2016, 138, 5777-5780 |
| 4130339 | CIF | C31 H49 Br2 N3 Ni O2 | P 1 21/c 1 | 13.2127; 14.1765; 16.9635 90; 101.342; 90 | 3115.4 | Zhou, Wen; Zheng, Shuai; Schultz, Jason W.; Rath, Nigam P.; Mirica, Liviu M. Aromatic Cyanoalkylation through Double C-H Activation Mediated by Ni(III). Journal of the American Chemical Society, 2016, 138, 5777-5780 |
| 4130340 | CIF | C27 H39 Br F6 N4 Ni P | P 1 21/c 1 | 17.2739; 14.0039; 13.5299 90; 109.966; 90 | 3076.2 | Zhou, Wen; Zheng, Shuai; Schultz, Jason W.; Rath, Nigam P.; Mirica, Liviu M. Aromatic Cyanoalkylation through Double C-H Activation Mediated by Ni(III). Journal of the American Chemical Society, 2016, 138, 5777-5780 |
| 4130341 | CIF | C31 H45 F12 N6 Ni Sb2 | P 1 21/n 1 | 14.908; 14.033; 19.26 90; 102.869; 90 | 3928.1 | Zhou, Wen; Zheng, Shuai; Schultz, Jason W.; Rath, Nigam P.; Mirica, Liviu M. Aromatic Cyanoalkylation through Double C-H Activation Mediated by Ni(III). Journal of the American Chemical Society, 2016, 138, 5777-5780 |
| 4130342 | CIF | C60 H101 F4 N6 Ni2 O7 | P 1 21/c 1 | 15.159; 25.006; 17.605 90; 109.14; 90 | 6305 | Zhou, Wen; Zheng, Shuai; Schultz, Jason W.; Rath, Nigam P.; Mirica, Liviu M. Aromatic Cyanoalkylation through Double C-H Activation Mediated by Ni(III). Journal of the American Chemical Society, 2016, 138, 5777-5780 |
| 4130343 | CIF | C19 H24 F18 Mo O5 | P 1 21/n 1 | 11.4678; 16.8911; 13.8634 90; 91.155; 90 | 2684.8 | von Kugelgen, Stephen; Bellone, Donatela E.; Cloke, Ryan R.; Perkins, Wade S.; Fischer, Felix R. Initiator Control of Conjugated Polymer Topology in Ring-Opening Alkyne Metathesis Polymerization. Journal of the American Chemical Society, 2016, 138, 6234-6239 |
| 4130344 | CIF | C505 H366 B120 F180 Fe10 N71 O30 | P -1 | 29.007; 35.476; 44.206 100.828; 96.645; 96.07 | 44000 | Kieffer, Marion; Pilgrim, Ben S.; Ronson, Tanya K.; Roberts, Derrick A.; Aleksanyan, Mina; Nitschke, Jonathan R. Perfluorinated Ligands Induce Meridional Metal Stereochemistry to Generate M8L12, M10L15, and M12L18 Prisms. Journal of the American Chemical Society, 2016, 138, 6813-6821 |
| 4130345 | CIF | C384 H264 Cl2 F132 Fe8 N48 O32 P14 | P 4/n n c :2 | 28.314; 28.314; 35.3911 90; 90; 90 | 28372 | Kieffer, Marion; Pilgrim, Ben S.; Ronson, Tanya K.; Roberts, Derrick A.; Aleksanyan, Mina; Nitschke, Jonathan R. Perfluorinated Ligands Induce Meridional Metal Stereochemistry to Generate M8L12, M10L15, and M12L18 Prisms. Journal of the American Chemical Society, 2016, 138, 6813-6821 |
| 4130346 | CIF | C384 H264 F144 Fe8 N48 O24 P16 | P 4 3 2 | 38.41; 38.41; 38.41 90; 90; 90 | 56667 | Kieffer, Marion; Pilgrim, Ben S.; Ronson, Tanya K.; Roberts, Derrick A.; Aleksanyan, Mina; Nitschke, Jonathan R. Perfluorinated Ligands Induce Meridional Metal Stereochemistry to Generate M8L12, M10L15, and M12L18 Prisms. Journal of the American Chemical Society, 2016, 138, 6813-6821 |
| 4130347 | CIF | C509 H321 F213 Fe10 N74 O2 P20 S | P -1 | 31.49; 32.933; 41.016 86.685; 80.468; 65.452 | 38154 | Kieffer, Marion; Pilgrim, Ben S.; Ronson, Tanya K.; Roberts, Derrick A.; Aleksanyan, Mina; Nitschke, Jonathan R. Perfluorinated Ligands Induce Meridional Metal Stereochemistry to Generate M8L12, M10L15, and M12L18 Prisms. Journal of the American Chemical Society, 2016, 138, 6813-6821 |
| 4130348 | CIF | C21 H30 B Cl3 O4 | P 1 | 9.8418; 11.238; 12.2846 101.925; 109.904; 94.519 | 1233.44 | Xi, Yumeng; Hartwig, John F. Diverse Asymmetric Hydrofunctionalization of Aliphatic Internal Alkenes through Catalytic Regioselective Hydroboration. Journal of the American Chemical Society, 2016, 138, 6703-6706 |
| 4130349 | CIF | C20 H16 Mn N4 O5 S | P 31 | 9.1358; 9.1358; 21.2002 90; 90; 120 | 1532.37 | Jeon, Ie-Rang; Sun, Lei; Negru, Bogdan; Van Duyne, Richard P.; Dincă, Mircea; Harris, T. David Solid-State Redox Switching of Magnetic Exchange and Electronic Conductivity in a Benzoquinoid-Bridged Mn(II) Chain Compound. Journal of the American Chemical Society, 2016, 138, 6583-6590 |
| 4130350 | CIF | C23 H16 O S | P -1 | 9.9347; 10.2489; 10.6994 63.651; 67.294; 70.262 | 882.14 | Sun, Fenggang; Li, Miao; He, Congfa; Wang, Bin; Li, Bin; Sui, Xianwei; Gu, Zhenhua Cleavage of the C(O)-S Bond of Thioesters by Palladium/Norbornene/Copper Cooperative Catalysis: An Efficient Synthesis of 2-(Arylthio)aryl Ketones. Journal of the American Chemical Society, 2016, 138, 7456-7459 |
| 4130351 | CIF | C22 H25 N O4 | P -1 | 6.8007; 10.8026; 14.4909 69.445; 88.471; 82.126 | 987.14 | Yu, Xuerong; Su, Fan; Liu, Chang; Yuan, Haosen; Zhao, Shan; Zhou, Zhiyao; Quan, Tianfei; Luo, Tuoping Enantioselective Total Syntheses of Various Amphilectane and Serrulatane Diterpenoids via Cope Rearrangements. Journal of the American Chemical Society, 2016, 138, 6261-6270 |
| 4130352 | CIF | C28 H28 Br Dy N4 O2 | C 2 2 21 | 8.7136; 17.3862; 17.083 90; 90; 90 | 2588 | Liu, Jiang; Chen, Yan-Cong; Liu, Jun-Liang; Vieru, Veacheslav; Ungur, Liviu; Jia, Jian-Hua; Chibotaru, Liviu F.; Lan, Yanhua; Wernsdorfer, Wolfgang; Gao, Song; Chen, Xiao-Ming; Tong, Ming-Liang A Stable Pentagonal Bipyramidal Dy(III) Single-Ion Magnet with a Record Magnetization Reversal Barrier over 1000 K. Journal of the American Chemical Society, 2016, 138, 5441-5450 |
| 4130353 | CIF | C28 H28 Cl Dy N4 O2 | C 2 2 21 | 8.7031; 17.1806; 16.9926 90; 90; 90 | 2540.8 | Liu, Jiang; Chen, Yan-Cong; Liu, Jun-Liang; Vieru, Veacheslav; Ungur, Liviu; Jia, Jian-Hua; Chibotaru, Liviu F.; Lan, Yanhua; Wernsdorfer, Wolfgang; Gao, Song; Chen, Xiao-Ming; Tong, Ming-Liang A Stable Pentagonal Bipyramidal Dy(III) Single-Ion Magnet with a Record Magnetization Reversal Barrier over 1000 K. Journal of the American Chemical Society, 2016, 138, 5441-5450 |
| 4130354 | CIF | C28 H28 Br N4 O2 Y | C 2 2 21 | 8.6882; 17.3517; 17.0584 90; 90; 90 | 2571.6 | Liu, Jiang; Chen, Yan-Cong; Liu, Jun-Liang; Vieru, Veacheslav; Ungur, Liviu; Jia, Jian-Hua; Chibotaru, Liviu F.; Lan, Yanhua; Wernsdorfer, Wolfgang; Gao, Song; Chen, Xiao-Ming; Tong, Ming-Liang A Stable Pentagonal Bipyramidal Dy(III) Single-Ion Magnet with a Record Magnetization Reversal Barrier over 1000 K. Journal of the American Chemical Society, 2016, 138, 5441-5450 |
| 4130355 | CIF | C28 H28 Cl N4 O2 Y | C 2 2 21 | 8.6871; 17.1521; 17.0046 90; 90; 90 | 2533.72 | Liu, Jiang; Chen, Yan-Cong; Liu, Jun-Liang; Vieru, Veacheslav; Ungur, Liviu; Jia, Jian-Hua; Chibotaru, Liviu F.; Lan, Yanhua; Wernsdorfer, Wolfgang; Gao, Song; Chen, Xiao-Ming; Tong, Ming-Liang A Stable Pentagonal Bipyramidal Dy(III) Single-Ion Magnet with a Record Magnetization Reversal Barrier over 1000 K. Journal of the American Chemical Society, 2016, 138, 5441-5450 |
| 4130356 | CIF | C20 H20 O7 | P 1 21/c 1 | 8.1289; 24.59; 8.7228 90; 99.753; 90 | 1718.4 | Dornan, Peter K.; Lee, Daniel; Grubbs, Robert H. Tandem Olefin Metathesis/Oxidative Cyclization: Synthesis of Tetrahydrofuran Diols from Simple Olefins. Journal of the American Chemical Society, 2016, 138, 6372-6375 |
| 4130357 | CIF | C11 H18 O7 | P 1 21/c 1 | 12.0771; 10.1622; 11.7693 90; 117.15; 90 | 1285.29 | Dornan, Peter K.; Lee, Daniel; Grubbs, Robert H. Tandem Olefin Metathesis/Oxidative Cyclization: Synthesis of Tetrahydrofuran Diols from Simple Olefins. Journal of the American Chemical Society, 2016, 138, 6372-6375 |
| 4130358 | CIF | C28 H30 F N3 O2 Pd S | P c a 21 | 16.2633; 9.9482; 15.9423 90; 90; 90 | 2579.3 | Pendleton, Ian M.; Pérez-Temprano, Mónica H; Sanford, Melanie S.; Zimmerman, Paul M. Experimental and Computational Assessment of Reactivity and Mechanism in C(sp(3))-N Bond-Forming Reductive Elimination from Palladium(IV). Journal of the American Chemical Society, 2016, 138, 6049-6060 |
| 4130359 | CIF | C21 H23 N3 O2 Pd S | P -1 | 7.6143; 8.1214; 16.8301 94.216; 91.512; 100.255 | 1020.53 | Pendleton, Ian M.; Pérez-Temprano, Mónica H; Sanford, Melanie S.; Zimmerman, Paul M. Experimental and Computational Assessment of Reactivity and Mechanism in C(sp(3))-N Bond-Forming Reductive Elimination from Palladium(IV). Journal of the American Chemical Society, 2016, 138, 6049-6060 |
| 4130360 | CIF | C21 H20 F3 N3 O2 Pd S | P 1 21/c 1 | 8.154; 8.234; 31.472 90; 97.248; 90 | 2096.1 | Pendleton, Ian M.; Pérez-Temprano, Mónica H; Sanford, Melanie S.; Zimmerman, Paul M. Experimental and Computational Assessment of Reactivity and Mechanism in C(sp(3))-N Bond-Forming Reductive Elimination from Palladium(IV). Journal of the American Chemical Society, 2016, 138, 6049-6060 |
| 4130361 | CIF | C37 H44 Cl2 N4 O5 Pd S2 | P -1 | 10.044; 12.345; 17.7048 90.013; 97.735; 113.481 | 1991.66 | Pendleton, Ian M.; Pérez-Temprano, Mónica H; Sanford, Melanie S.; Zimmerman, Paul M. Experimental and Computational Assessment of Reactivity and Mechanism in C(sp(3))-N Bond-Forming Reductive Elimination from Palladium(IV). Journal of the American Chemical Society, 2016, 138, 6049-6060 |
| 4130362 | CIF | C19 H17.5 N3.5 O4.25 Pd | C 1 2/c 1 | 25.733; 13.3912; 21.1443 90; 94.874; 90 | 7259.9 | Gurak, Jr, John A; Yang, Kin S.; Liu, Zhen; Engle, Keary M. Directed, Regiocontrolled Hydroamination of Unactivated Alkenes via Protodepalladation. Journal of the American Chemical Society, 2016, 138, 5805-5808 |
| 4130363 | CIF | C20 H21 N3 O3 | P 1 21/n 1 | 8.6307; 5.2843; 37.3565 90; 94.473; 90 | 1698.54 | Gurak, Jr, John A; Yang, Kin S.; Liu, Zhen; Engle, Keary M. Directed, Regiocontrolled Hydroamination of Unactivated Alkenes via Protodepalladation. Journal of the American Chemical Society, 2016, 138, 5805-5808 |
| 4130364 | CIF | C43 H56 Co O2 | P -1 | 8.5434; 11.3181; 19.657 106.087; 96.817; 97.583 | 1786.12 | Bellow, James A.; Stoian, Sebastian A.; van Tol, Johan; Ozarowski, Andrew; Lord, Richard L.; Groysman, Stanislav Synthesis and Characterization of a Stable High-Valent Cobalt Carbene Complex. Journal of the American Chemical Society, 2016, 138, 5531-5534 |
| 4130365 | CIF | C46.5 H39.5 Cl1.5 F6 Ir N6 O5 | C 1 2/c 1 | 42.9399; 12.8337; 18.6967 90; 95.8809; 90 | 10249.1 | Xu, Weici; Arieno, Marcus; Löw, Henrik; Huang, Kaifang; Xie, Xiulan; Cruchter, Thomas; Ma, Qiao; Xi, Jianwei; Huang, Biao; Wiest, Olaf; Gong, Lei; Meggers, Eric Metal-Templated Design: Enantioselective Hydrogen-Bond-Driven Catalysis Requiring Only Parts-per-Million Catalyst Loading. Journal of the American Chemical Society, 2016, 138, 8774-8780 |
| 4130366 | CIF | C36 H27 Cl5 Ir N5 O2 | P 1 21/n 1 | 10.3862; 21.7927; 15.7223 90; 104.915; 90 | 3438.74 | Xu, Weici; Arieno, Marcus; Löw, Henrik; Huang, Kaifang; Xie, Xiulan; Cruchter, Thomas; Ma, Qiao; Xi, Jianwei; Huang, Biao; Wiest, Olaf; Gong, Lei; Meggers, Eric Metal-Templated Design: Enantioselective Hydrogen-Bond-Driven Catalysis Requiring Only Parts-per-Million Catalyst Loading. Journal of the American Chemical Society, 2016, 138, 8774-8780 |
| 4130367 | CIF | C36 H27 Cl5 N5 O2 Rh | P 1 21/n 1 | 10.4226; 22.0201; 15.7757 90; 104.508; 90 | 3505.18 | Xu, Weici; Arieno, Marcus; Löw, Henrik; Huang, Kaifang; Xie, Xiulan; Cruchter, Thomas; Ma, Qiao; Xi, Jianwei; Huang, Biao; Wiest, Olaf; Gong, Lei; Meggers, Eric Metal-Templated Design: Enantioselective Hydrogen-Bond-Driven Catalysis Requiring Only Parts-per-Million Catalyst Loading. Journal of the American Chemical Society, 2016, 138, 8774-8780 |
| 4130368 | CIF | C39 H38 Si | I 1 2/a 1 | 19.6428; 9.1623; 33.756 90; 94.1615; 90 | 6059.2 | Lutters, Dennis; Severin, Claudia; Schmidtmann, Marc; Müller, Thomas Activation of 7-Silanorbornadienes by N-Heterocyclic Carbenes: A Selective Way to N-Heterocyclic-Carbene-Stabilized Silylenes. Journal of the American Chemical Society, 2016, 138, 6061-6067 |
| 4130369 | CIF | C31 H38 N2 Si | P 1 21/n 1 | 8.3788; 13.7166; 23.034 90; 97.494; 90 | 2624.7 | Lutters, Dennis; Severin, Claudia; Schmidtmann, Marc; Müller, Thomas Activation of 7-Silanorbornadienes by N-Heterocyclic Carbenes: A Selective Way to N-Heterocyclic-Carbene-Stabilized Silylenes. Journal of the American Chemical Society, 2016, 138, 6061-6067 |
| 4130370 | CIF | C49 H74 N2 Si | P -1 | 11.176; 14.3407; 15.4197 106.774; 103.054; 99.4585 | 2234.2 | Lutters, Dennis; Severin, Claudia; Schmidtmann, Marc; Müller, Thomas Activation of 7-Silanorbornadienes by N-Heterocyclic Carbenes: A Selective Way to N-Heterocyclic-Carbene-Stabilized Silylenes. Journal of the American Chemical Society, 2016, 138, 6061-6067 |
| 4130371 | CIF | C64.5 H82 Fe N2 O4 Si | P b c n | 22.2976; 21.8242; 23.9794 90; 90; 90 | 11669 | Lutters, Dennis; Severin, Claudia; Schmidtmann, Marc; Müller, Thomas Activation of 7-Silanorbornadienes by N-Heterocyclic Carbenes: A Selective Way to N-Heterocyclic-Carbene-Stabilized Silylenes. Journal of the American Chemical Society, 2016, 138, 6061-6067 |
| 4130372 | CIF | C19 H19 N O3 | P 1 21/c 1 | 10.358; 18.6766; 8.495 90; 109.125; 90 | 1552.67 | Hemric, Brett N.; Shen, Kun; Wang, Qiu Copper-Catalyzed Amino Lactonization and Amino Oxygenation of Alkenes Using O-Benzoylhydroxylamines. Journal of the American Chemical Society, 2016, 138, 5813-5816 |
| 4130373 | CIF | C25 H28 F10 I2 N2 O6 S | P -1 | 9.6266; 12.1164; 15.763 107.201; 99.0307; 95.8325 | 1713.1 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130374 | CIF | C25 H28 F10 I2 N2 O6 S | P -1 | 9.609; 11.7874; 15.6613 106.088; 99.072; 97.208 | 1656.12 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130375 | CIF | C26 H32 F8 I4 N4 O6 S2 | P -1 | 8.6068; 8.8928; 13.1636 81.3961; 81.8363; 81.3533 | 977.47 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130376 | CIF | C26 H32 F8 I4 N4 O6 S2 | P 1 21/c 1 | 11.9213; 18.4095; 8.7557 90; 98.516; 90 | 1900.39 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130377 | CIF | C26 H32 Br4 F8 N4 O6 S2 | P 1 21/c 1 | 11.5819; 18.0821; 8.6578 90; 98.464; 90 | 1793.41 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130378 | CIF | C17 H28 F8 I2 N2 O6 S | I b c a | 11.9443; 19.5839; 26.1625 90; 90; 90 | 6119.8 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130379 | CIF | C27.38 H30 F11.15 I2.22 N2 O6 S | P -1 | 12.599; 17.0505; 19.7734 69.408; 85.6061; 69.27 | 3713.32 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130380 | CIF | C27.35 H30 F11.12 I2.22 N2 O6 S | P -1 | 12.44152; 16.9891; 19.5792 68.9618; 85.8437; 69.8182 | 3619.2 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130381 | CIF | C26 H30 F8 I4 N2 O6 S | P -1 | 9.8179; 13.3362; 15.0376 73.839; 89.14; 83.3489 | 1878.09 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130382 | CIF | C28 H36 F8 I4 N4 O6 S2 | P -1 | 9.72; 10.7923; 11.3901 86.699; 63.843; 73.958 | 1027.85 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130383 | CIF | C28 H36 F8 I4 N4 O6 S2 | P -1 | 9.846; 10.4792; 11.3413 85.313; 64.871; 71.883 | 1005.18 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130384 | CIF | C28 H36 F8 I4 N4 O6 S2 | P 1 2/c 1 | 10.0188; 13.4363; 15.5834 90; 90.1191; 90 | 2097.76 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130385 | CIF | C28 H36 F8 I4 N4 O6 S2 | P 1 2/c 1 | 9.9852; 13.3367; 15.2415 90; 90.7746; 90 | 2029.52 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130386 | CIF | C26 H30 Br4 F8 N2 O6 S | P -1 | 9.8094; 12.7105; 15.1305 112.153; 91.9758; 97.0029 | 1727.56 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130387 | CIF | C18 H30 F8 I2 N2 O6 S | P -1 | 9.7881; 12.6817; 13.5747 94.8419; 105.916; 93.9121 | 1607.29 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130388 | CIF | C29 H28 F10 I2 N2 O6 S | P 1 21 1 | 10.37; 13.8862; 12.7542 90; 103.61; 90 | 1785.03 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130389 | CIF | C29 H28 F10 I2 N2 O6 S | P 1 | 8.9537; 9.519; 11.4872 80.3533; 75.0509; 70.2282 | 886.677 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130390 | CIF | C23 H28 F4 I2 N2 O6 S | P 1 21/n 1 | 9.1335; 12.3265; 26.0309 90; 99.35; 90 | 2891.73 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130391 | CIF | C21 H28 F8 I2 N2 O6 S | P b c a | 12.3528; 25.5555; 38.3682 90; 90; 90 | 12112.2 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130392 | CIF | C32 H36 F8 I4 N4 O6 S2 | P 1 2/c 1 | 9.7851; 13.5446; 16.3773 90; 96.9011; 90 | 2154.84 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130393 | CIF | C22 H30 F8 I2 N2 O6 S | P 1 21/c 1 | 12.5948; 25.0859; 19.8262 90; 96.447; 90 | 6224.5 | Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society, 2016, 138, 6610-6616 |
| 4130394 | CIF | C50 H46 P2 Pd | P 1 21 1 | 10.3194; 8.9387; 20.8179 90; 90.85; 90 | 1920.1 | Gutiérrez-Bonet, Álvaro; Juliá-Hernández, Francisco; de Luis, Beatriz; Martin, Ruben Pd-Catalyzed C(sp(3))-H Functionalization/Carbenoid Insertion: All-Carbon Quaternary Centers via Multiple C-C Bond Formation. Journal of the American Chemical Society, 2016, 138, 6384-6387 |
| 4130395 | CIF | C18 H18 O2 | P -1 | 8.2724; 8.3263; 12.4647 99.3703; 98.059; 119.556 | 712.13 | Gutiérrez-Bonet, Álvaro; Juliá-Hernández, Francisco; de Luis, Beatriz; Martin, Ruben Pd-Catalyzed C(sp(3))-H Functionalization/Carbenoid Insertion: All-Carbon Quaternary Centers via Multiple C-C Bond Formation. Journal of the American Chemical Society, 2016, 138, 6384-6387 |
| 4130396 | CIF | C46 H64 O P2 Pd | P -1 | 9.595; 9.6214; 21.763 86.505; 83.992; 87.351 | 1992.7 | Gutiérrez-Bonet, Álvaro; Juliá-Hernández, Francisco; de Luis, Beatriz; Martin, Ruben Pd-Catalyzed C(sp(3))-H Functionalization/Carbenoid Insertion: All-Carbon Quaternary Centers via Multiple C-C Bond Formation. Journal of the American Chemical Society, 2016, 138, 6384-6387 |
| 4130397 | CIF | C19 Cl15 | P -1 | 8.96; 13.051; 27.917 96.541; 90.943; 100.171 | 3190 | Souto, Manuel; Cui, HengBo; Peña-Álvarez, Miriam; Baonza, Valentín G; Jeschke, Harald O.; Tomic, Milan; Valentí, Roser; Blasi, Davide; Ratera, Imma; Rovira, Concepció; Veciana, Jaume Pressure-Induced Conductivity in a Neutral Nonplanar Spin-Localized Radical. Journal of the American Chemical Society, 2016, 138, 11517-11525 |
| 4130398 | CIF | C35 H10 Cl14 N S4 | P 1 21 1 | 17.411; 7.9517; 30.177 90; 103.588; 90 | 4061 | Souto, Manuel; Cui, HengBo; Peña-Álvarez, Miriam; Baonza, Valentín G; Jeschke, Harald O.; Tomic, Milan; Valentí, Roser; Blasi, Davide; Ratera, Imma; Rovira, Concepció; Veciana, Jaume Pressure-Induced Conductivity in a Neutral Nonplanar Spin-Localized Radical. Journal of the American Chemical Society, 2016, 138, 11517-11525 |
| 4130399 | CIF | C33.5 H36 Cl4 F6 N4 O3.5 P Ru | P -1 | 12.1017; 12.7507; 14.0794 71.154; 82.268; 71.918 | 1953.09 | Xie, Jianhui; Man, Wai-Lun; Wong, Chun-Yuen; Chang, Xiaoyong; Che, Chi-Ming; Lau, Tai-Chu Four-Electron Oxidation of Phenols to p-Benzoquinone Imines by a (Salen)ruthenium(VI) Nitrido Complex. Journal of the American Chemical Society, 2016, 138, 5817-5820 |
| 4130400 | CIF | C35.25 H33.75 Cl2 N4.75 O3.5 Ru | P b c a | 24.8814; 20.0338; 29.5126 90; 90; 90 | 14711.1 | Xie, Jianhui; Man, Wai-Lun; Wong, Chun-Yuen; Chang, Xiaoyong; Che, Chi-Ming; Lau, Tai-Chu Four-Electron Oxidation of Phenols to p-Benzoquinone Imines by a (Salen)ruthenium(VI) Nitrido Complex. Journal of the American Chemical Society, 2016, 138, 5817-5820 |
| 4130401 | CIF | C24 H19 Cl O4 | P 21 21 21 | 10.5376; 13.4923; 13.7084 90; 90; 90 | 1949 | Zhang, Guoxiang; Yang, Shuang; Zhang, Xiaoyan; Lin, Qiqiao; Das, Deb K.; Liu, Jian; Fang, Xinqiang Dynamic Kinetic Resolution Enabled by Intramolecular Benzoin Reaction: Synthetic Applications and Mechanistic Insights. Journal of the American Chemical Society, 2016, 138, 7932-7938 |
| 4130402 | CIF | C19 H17 Cl O4 | P 21 21 21 | 6.2378; 11.146; 23.681 90; 90; 90 | 1646.5 | Zhang, Guoxiang; Yang, Shuang; Zhang, Xiaoyan; Lin, Qiqiao; Das, Deb K.; Liu, Jian; Fang, Xinqiang Dynamic Kinetic Resolution Enabled by Intramolecular Benzoin Reaction: Synthetic Applications and Mechanistic Insights. Journal of the American Chemical Society, 2016, 138, 7932-7938 |
| 4130403 | CIF | C19 H17 Br O3 | P 21 21 21 | 6.0467; 9.9294; 27.622 90; 90; 90 | 1658.4 | Zhang, Guoxiang; Yang, Shuang; Zhang, Xiaoyan; Lin, Qiqiao; Das, Deb K.; Liu, Jian; Fang, Xinqiang Dynamic Kinetic Resolution Enabled by Intramolecular Benzoin Reaction: Synthetic Applications and Mechanistic Insights. Journal of the American Chemical Society, 2016, 138, 7932-7938 |
| 4130404 | CIF | C24 H19 Cl O4 | P 21 21 21 | 6.6769; 12.7034; 23.779 90; 90; 90 | 2016.9 | Zhang, Guoxiang; Yang, Shuang; Zhang, Xiaoyan; Lin, Qiqiao; Das, Deb K.; Liu, Jian; Fang, Xinqiang Dynamic Kinetic Resolution Enabled by Intramolecular Benzoin Reaction: Synthetic Applications and Mechanistic Insights. Journal of the American Chemical Society, 2016, 138, 7932-7938 |
| 4130405 | CIF | In4 O10 S32 Sn16 | I 41/a c d :2 | 23.1392; 23.1392; 41.5631 90; 90; 90 | 22253.8 | Zhang, Xian-Ming; Sarma, Debajit; Wu, Ya-Qin; Wang, Li; Ning, Zhi-Xue; Zhang, Fu-Qiang; Kanatzidis, Mercouri G. Open-Framework Oxysulfide Based on the Supertetrahedral [In4Sn16O10S34](12-) Cluster and Efficient Sequestration of Heavy Metals. Journal of the American Chemical Society, 2016, 138, 5543-5546 |
| 4130406 | CIF | C17 H17 D O2 | P -1 | 8.587; 11.651; 14.574 107.133; 97.316; 92.476 | 1377 | Nogi, Keisuke; Fujihara, Tetsuaki; Terao, Jun; Tsuji, Yasushi Carboxyzincation Employing Carbon Dioxide and Zinc Powder: Cobalt-Catalyzed Multicomponent Coupling Reactions with Alkynes. Journal of the American Chemical Society, 2016, 138, 5547-5550 |
| 4130407 | CIF | C66 H36 O12 | C 1 n 1 | 20.128; 43.359; 7.4073 90; 90.5085; 90 | 6464 | Hisaki, Ichiro; Nakagawa, Shoichi; Ikenaka, Nobuaki; Imamura, Yutaka; Katouda, Michio; Tashiro, Motomichi; Tsuchida, Hiromu; Ogoshi, Tomoki; Sato, Hiroyasu; Tohnai, Norimitsu; Miyata, Mikiji A Series of Layered Assemblies of Hydrogen-Bonded, Hexagonal Networks of C3-Symmetric π-Conjugated Molecules: A Potential Motif of Porous Organic Materials. Journal of the American Chemical Society, 2016, 138, 6617-6628 |
| 4130408 | CIF | C143 H87 N O27 | P -1 | 18.238; 21.7332; 21.6772 105.474; 103.115; 99.916 | 7812.88 | Hisaki, Ichiro; Nakagawa, Shoichi; Ikenaka, Nobuaki; Imamura, Yutaka; Katouda, Michio; Tashiro, Motomichi; Tsuchida, Hiromu; Ogoshi, Tomoki; Sato, Hiroyasu; Tohnai, Norimitsu; Miyata, Mikiji A Series of Layered Assemblies of Hydrogen-Bonded, Hexagonal Networks of C3-Symmetric π-Conjugated Molecules: A Potential Motif of Porous Organic Materials. Journal of the American Chemical Society, 2016, 138, 6617-6628 |
| 4130409 | CIF | C81 H60 Cl3 N3 O15 | P -1 | 14.2413; 16.8612; 20.8726 89.539; 88.175; 82.566 | 4967.35 | Hisaki, Ichiro; Nakagawa, Shoichi; Ikenaka, Nobuaki; Imamura, Yutaka; Katouda, Michio; Tashiro, Motomichi; Tsuchida, Hiromu; Ogoshi, Tomoki; Sato, Hiroyasu; Tohnai, Norimitsu; Miyata, Mikiji A Series of Layered Assemblies of Hydrogen-Bonded, Hexagonal Networks of C3-Symmetric π-Conjugated Molecules: A Potential Motif of Porous Organic Materials. Journal of the American Chemical Society, 2016, 138, 6617-6628 |
| 4130410 | CIF | C141 H73.5 Cl25.5 O12 | P -1 | 15.3971; 17.5779; 26.0548 88.62; 87.381; 65.012 | 6384.9 | Hisaki, Ichiro; Nakagawa, Shoichi; Ikenaka, Nobuaki; Imamura, Yutaka; Katouda, Michio; Tashiro, Motomichi; Tsuchida, Hiromu; Ogoshi, Tomoki; Sato, Hiroyasu; Tohnai, Norimitsu; Miyata, Mikiji A Series of Layered Assemblies of Hydrogen-Bonded, Hexagonal Networks of C3-Symmetric π-Conjugated Molecules: A Potential Motif of Porous Organic Materials. Journal of the American Chemical Society, 2016, 138, 6617-6628 |
| 4130411 | CIF | C138 H75 Cl3 O24 | P -1 | 15.3981; 21.2475; 23.5028 67.6497; 76.3614; 83.8777 | 6910.01 | Hisaki, Ichiro; Nakagawa, Shoichi; Ikenaka, Nobuaki; Imamura, Yutaka; Katouda, Michio; Tashiro, Motomichi; Tsuchida, Hiromu; Ogoshi, Tomoki; Sato, Hiroyasu; Tohnai, Norimitsu; Miyata, Mikiji A Series of Layered Assemblies of Hydrogen-Bonded, Hexagonal Networks of C3-Symmetric π-Conjugated Molecules: A Potential Motif of Porous Organic Materials. Journal of the American Chemical Society, 2016, 138, 6617-6628 |
| 4130412 | CIF | C34 H62 Cu4 K N13 O33 P4 | P -1 | 10.4003; 16.0666; 21.687 106.88; 91.828; 90.151 | 3465.7 | Du, Kang; Harris, T. David A Cu(II)2 Paramagnetic Chemical Exchange Saturation Transfer Contrast Agent Enabled by Magnetic Exchange Coupling. Journal of the American Chemical Society, 2016, 138, 7804-7807 |
| 4130413 | CIF | C24 H47 O3 P3 Pd S | C 1 2/c 1 | 18.133; 11.428; 29.728 90; 96.237; 90 | 6124 | Zhu, Yueyue; Chen, Tieqiao; Li, Shan; Shimada, Shigeru; Han, Li-Biao Efficient Pd-Catalyzed Dehydrogenative Coupling of P(O)H with RSH: A Precise Construction of P(O)-S Bonds. Journal of the American Chemical Society, 2016, 138, 5825-5828 |
| 4130414 | CIF | C16 H0.5 Cu I2 N8 | P 1 21/n 1 | 7.8238; 9.782; 14.414 90; 91.602; 90 | 1102.7 | Liebeskind, Lanny S.; Gangireddy, Pavankumar; Lindale, Matthew G. Benzoisothiazolone Organo/Copper-Cocatalyzed Redox Dehydrative Construction of Amides and Peptides from Carboxylic Acids using (EtO)3P as the Reductant and O2 in Air as the Terminal Oxidant. Journal of the American Chemical Society, 2016, 138, 6715-6718 |
| 4130415 | CIF | C39 H60 Fe O3 P2 | R -3 c :H | 15.835; 15.835; 27.47 90; 90; 120 | 5965.2 | Lang, Georgette M.; Shima, Takanori; Wang, Leyong; Cluff, Kyle J.; Skopek, Katrin; Hampel, Frank; Blümel, Janet; Gladysz, John A. Gyroscope-Like Complexes Based on Dibridgehead Diphosphine Cages That Are Accessed by Three-Fold Intramolecular Ring Closing Metatheses and Encase Fe(CO)3, Fe(CO)2(NO)(+), and Fe(CO)3(H)(+) Rotators. Journal of the American Chemical Society, 2016, 138, 7649-7663 |
| 4130416 | CIF | C51 H78 Fe O3 P2 | C 1 2/c 1 | 13.082; 23.0562; 17.1097 90; 106.467; 90 | 4949 | Lang, Georgette M.; Shima, Takanori; Wang, Leyong; Cluff, Kyle J.; Skopek, Katrin; Hampel, Frank; Blümel, Janet; Gladysz, John A. Gyroscope-Like Complexes Based on Dibridgehead Diphosphine Cages That Are Accessed by Three-Fold Intramolecular Ring Closing Metatheses and Encase Fe(CO)3, Fe(CO)2(NO)(+), and Fe(CO)3(H)(+) Rotators. Journal of the American Chemical Society, 2016, 138, 7649-7663 |
| 4130417 | CIF | C45 H84 Fe O3 P2 | C 1 2/c 1 | 21.5104; 13.9765; 18.3436 90; 122.839; 90 | 4633.5 | Lang, Georgette M.; Shima, Takanori; Wang, Leyong; Cluff, Kyle J.; Skopek, Katrin; Hampel, Frank; Blümel, Janet; Gladysz, John A. Gyroscope-Like Complexes Based on Dibridgehead Diphosphine Cages That Are Accessed by Three-Fold Intramolecular Ring Closing Metatheses and Encase Fe(CO)3, Fe(CO)2(NO)(+), and Fe(CO)3(H)(+) Rotators. Journal of the American Chemical Society, 2016, 138, 7649-7663 |
| 4130418 | CIF | C31 H47 Au Cl3 P | P 21 21 21 | 8.0463; 16.1268; 22.1134 90; 90; 90 | 2869.5 | Chen, Liye; Ren, Peng; Carrow, Brad P. Tri(1-adamantyl)phosphine: Expanding the Boundary of Electron-Releasing Character Available to Organophosphorus Compounds. Journal of the American Chemical Society, 2016, 138, 6392-6395 |
| 4130419 | CIF | C49 H68 N O5 P Pd S | P 1 n 1 | 10.7563; 11.5192; 17.1433 90; 91.448; 90 | 2123.4 | Chen, Liye; Ren, Peng; Carrow, Brad P. Tri(1-adamantyl)phosphine: Expanding the Boundary of Electron-Releasing Character Available to Organophosphorus Compounds. Journal of the American Chemical Society, 2016, 138, 6392-6395 |
| 4130420 | CIF | C37 H59 Ce N5 O3 Si2 | P 1 21/c 1 | 31.4376; 13.3371; 19.0763 90; 91.084; 90 | 7997 | Solola, Lukman A.; Zabula, Alexander V.; Dorfner, Walter L.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. An Alkali Metal-Capped Cerium(IV) Imido Complex. Journal of the American Chemical Society, 2016, 138, 6928-6931 |
| 4130421 | CIF | C45 H57 Ce F6 N5 O4 | P 1 21/n 1 | 11.9773; 17.8482; 20.9505 90; 97.343; 90 | 4441.93 | Solola, Lukman A.; Zabula, Alexander V.; Dorfner, Walter L.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. An Alkali Metal-Capped Cerium(IV) Imido Complex. Journal of the American Chemical Society, 2016, 138, 6928-6931 |
| 4130422 | CIF | C49 H68 Ce F6 K N5 O7 | P 1 21 1 | 11.8007; 17.3405; 14.0927 90; 91.239; 90 | 2883.1 | Solola, Lukman A.; Zabula, Alexander V.; Dorfner, Walter L.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. An Alkali Metal-Capped Cerium(IV) Imido Complex. Journal of the American Chemical Society, 2016, 138, 6928-6931 |
| 4130423 | CIF | C44 H57 Ce F6 N5 O3 Si | P -1 | 11.3019; 12.196; 18.6065 103.394; 93.797; 113.733 | 2247.02 | Solola, Lukman A.; Zabula, Alexander V.; Dorfner, Walter L.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. An Alkali Metal-Capped Cerium(IV) Imido Complex. Journal of the American Chemical Society, 2016, 138, 6928-6931 |
| 4130424 | CIF | C28 H52 Au N S8 | P 1 | 10.1007; 12.8982; 15.4354 81.816; 80.903; 70.138 | 1859 | Branzea, Diana G.; Pop, Flavia; Auban-Senzier, Pascale; Clérac, Rodolphe; Alemany, Pere; Canadell, Enric; Avarvari, Narcis Localization versus Delocalization in Chiral Single Component Conductors of Gold Bis(dithiolene) Complexes. Journal of the American Chemical Society, 2016, 138, 6838-6851 |
| 4130425 | CIF | C28 H52 N Ni S8 | P 1 | 9.9946; 12.8908; 15.4197 81.69; 80.294; 69.818 | 1830 | Branzea, Diana G.; Pop, Flavia; Auban-Senzier, Pascale; Clérac, Rodolphe; Alemany, Pere; Canadell, Enric; Avarvari, Narcis Localization versus Delocalization in Chiral Single Component Conductors of Gold Bis(dithiolene) Complexes. Journal of the American Chemical Society, 2016, 138, 6838-6851 |
| 4130426 | CIF | C12 H16 Au S8 | P 1 | 6.957; 7.938; 9.378 73.394; 74.625; 73.189 | 465.6 | Branzea, Diana G.; Pop, Flavia; Auban-Senzier, Pascale; Clérac, Rodolphe; Alemany, Pere; Canadell, Enric; Avarvari, Narcis Localization versus Delocalization in Chiral Single Component Conductors of Gold Bis(dithiolene) Complexes. Journal of the American Chemical Society, 2016, 138, 6838-6851 |
| 4130427 | CIF | C12 H16 Ni S8 | P 1 | 6.9784; 7.8994; 9.217 70.105; 75.451; 75.277 | 454.44 | Branzea, Diana G.; Pop, Flavia; Auban-Senzier, Pascale; Clérac, Rodolphe; Alemany, Pere; Canadell, Enric; Avarvari, Narcis Localization versus Delocalization in Chiral Single Component Conductors of Gold Bis(dithiolene) Complexes. Journal of the American Chemical Society, 2016, 138, 6838-6851 |
| 4130428 | CIF | C37 H28 B2 F12 Fe N6 O | P 1 21/c 1 | 11.7881; 16.3973; 19.778 90; 105.539; 90 | 3683.22 | Sahu, Sumit; Zhang, Bo; Pollock, Christopher J.; Dürr, Maximilian; Davies, Casey G.; Confer, Alex M.; Ivanović-Burmazović, Ivana; Siegler, Maxime A.; Jameson, Guy N. L.; Krebs, Carsten; Goldberg, David P. Aromatic C-F Hydroxylation by Nonheme Iron(IV)-Oxo Complexes: Structural, Spectroscopic, and Mechanistic Investigations. Journal of the American Chemical Society, 2016, 138, 12791-12802 |
| 4130429 | CIF | C35 H28 Cl F4 Fe N5 O6 | P 1 21 1 | 14.4312; 12.8954; 18.3009 90; 92.161; 90 | 3403.3 | Sahu, Sumit; Zhang, Bo; Pollock, Christopher J.; Dürr, Maximilian; Davies, Casey G.; Confer, Alex M.; Ivanović-Burmazović, Ivana; Siegler, Maxime A.; Jameson, Guy N. L.; Krebs, Carsten; Goldberg, David P. Aromatic C-F Hydroxylation by Nonheme Iron(IV)-Oxo Complexes: Structural, Spectroscopic, and Mechanistic Investigations. Journal of the American Chemical Society, 2016, 138, 12791-12802 |
| 4130430 | CIF | C76 H61 Cl4 F6 Fe2 N11 O22 | I 1 2/m 1 | 11.655; 26.4005; 28.4632 90; 91.2677; 90 | 8755.9 | Sahu, Sumit; Zhang, Bo; Pollock, Christopher J.; Dürr, Maximilian; Davies, Casey G.; Confer, Alex M.; Ivanović-Burmazović, Ivana; Siegler, Maxime A.; Jameson, Guy N. L.; Krebs, Carsten; Goldberg, David P. Aromatic C-F Hydroxylation by Nonheme Iron(IV)-Oxo Complexes: Structural, Spectroscopic, and Mechanistic Investigations. Journal of the American Chemical Society, 2016, 138, 12791-12802 |
| 4130431 | CIF | C39 H32 Cl2 F4 Fe N6 O10 | P 1 21/n 1 | 12.6196; 20.6085; 14.9361 90; 96.679; 90 | 3858.08 | Sahu, Sumit; Zhang, Bo; Pollock, Christopher J.; Dürr, Maximilian; Davies, Casey G.; Confer, Alex M.; Ivanović-Burmazović, Ivana; Siegler, Maxime A.; Jameson, Guy N. L.; Krebs, Carsten; Goldberg, David P. Aromatic C-F Hydroxylation by Nonheme Iron(IV)-Oxo Complexes: Structural, Spectroscopic, and Mechanistic Investigations. Journal of the American Chemical Society, 2016, 138, 12791-12802 |
| 4130432 | CIF | C24 H16 N2 O2 Ru | P 1 21/c 1 | 14.3561; 7.4881; 18.4363 90; 109.055; 90 | 1873.3 | Fan, Zhoulong; Ni, Jiabin; Zhang, Ao Meta-Selective CAr-H Nitration of Arenes through a Ru3(CO)12-Catalyzed Ortho-Metalation Strategy. Journal of the American Chemical Society, 2016, 138, 8470-8475 |
| 4130433 | CIF | C42 H30 B F5 S | P 1 21 1 | 11.1346; 10.5539; 28.386 90; 98.7877; 90 | 3296.58 | Süsse, Lars; Hermeke, Julia; Oestreich, Martin The Asymmetric Piers Hydrosilylation. Journal of the American Chemical Society, 2016, 138, 6940-6943 |
| 4130434 | CIF | C43 H39 As2 B2 Cl F14 N3 O Rh | C m c e | 26.977; 14.654; 23.39 90; 90; 90 | 9247 | Dube, Jonathan W.; Zheng, Yiying; Thiel, Walter; Alcarazo, Manuel α-Cationic Arsines: Synthesis, Structure, Reactivity, and Applications. Journal of the American Chemical Society, 2016, 138, 6869-6877 |
| 4130435 | CIF | C34 H34 Br2 N2 O3 | I 1 2 1 | 17.3093; 6.24868; 29.0192 90; 102.724; 90 | 3061.65 | Poulsen, Pernille H.; Vergura, Stefania; Monleón, Alicia; Jørgensen, Danny Kaare Bech; Jørgensen, Karl Anker Controlling Asymmetric Remote and Cascade 1,3-Dipolar Cycloaddition Reactions by Organocatalysis. Journal of the American Chemical Society, 2016, 138, 6412-6415 |
| 4130436 | CIF | C67 H14 B F35 Ge N4 | P 1 21/n 1 | 24.836; 10.6607; 29.1236 90; 102.166; 90 | 7537.8 | Fang, Huayi; Jing, Huize; Zhang, Aixi; Ge, Haonan; Yao, Zhengmin; Brothers, Penelope J.; Fu, Xuefeng Synthesis, Electronic Structure, and Reactivity Studies of a 4-Coordinate Square Planar Germanium(IV) Cation. Journal of the American Chemical Society, 2016, 138, 7705-7710 |
| 4130437 | CIF | C45 H17 F15 Ge N4 | P 1 21/c 1 | 8.499; 35.608; 26.043 90; 97.695; 90 | 7810 | Fang, Huayi; Jing, Huize; Zhang, Aixi; Ge, Haonan; Yao, Zhengmin; Brothers, Penelope J.; Fu, Xuefeng Synthesis, Electronic Structure, and Reactivity Studies of a 4-Coordinate Square Planar Germanium(IV) Cation. Journal of the American Chemical Society, 2016, 138, 7705-7710 |
| 4130438 | CIF | C69 H24 B F35 Ge N4 O2 | P -1 | 13.1675; 15.2199; 19.0967 94.292; 95.582; 98.626 | 3750.3 | Fang, Huayi; Jing, Huize; Zhang, Aixi; Ge, Haonan; Yao, Zhengmin; Brothers, Penelope J.; Fu, Xuefeng Synthesis, Electronic Structure, and Reactivity Studies of a 4-Coordinate Square Planar Germanium(IV) Cation. Journal of the American Chemical Society, 2016, 138, 7705-7710 |
| 4130439 | CIF | C43 H13 F15 Ge N4 | C 1 2/c 1 | 21.5561; 19.0714; 17.2328 90; 93.376; 90 | 7072.2 | Fang, Huayi; Jing, Huize; Zhang, Aixi; Ge, Haonan; Yao, Zhengmin; Brothers, Penelope J.; Fu, Xuefeng Synthesis, Electronic Structure, and Reactivity Studies of a 4-Coordinate Square Planar Germanium(IV) Cation. Journal of the American Chemical Society, 2016, 138, 7705-7710 |
| 4130440 | CIF | C46 H19 F15 Ge N4 | P 1 21/n 1 | 15.204; 10.0045; 24.937 90; 91.887; 90 | 3791.1 | Fang, Huayi; Jing, Huize; Zhang, Aixi; Ge, Haonan; Yao, Zhengmin; Brothers, Penelope J.; Fu, Xuefeng Synthesis, Electronic Structure, and Reactivity Studies of a 4-Coordinate Square Planar Germanium(IV) Cation. Journal of the American Chemical Society, 2016, 138, 7705-7710 |
| 4130441 | CIF | C64 H35 F16 Ge N4 | P -1 | 12.331; 14.8171; 15.2967 75.578; 88.007; 79.011 | 2656.9 | Fang, Huayi; Jing, Huize; Zhang, Aixi; Ge, Haonan; Yao, Zhengmin; Brothers, Penelope J.; Fu, Xuefeng Synthesis, Electronic Structure, and Reactivity Studies of a 4-Coordinate Square Planar Germanium(IV) Cation. Journal of the American Chemical Society, 2016, 138, 7705-7710 |
| 4130442 | CIF | C85.82 H25.82 B12 Cl5.46 F60 O12.99 | R -3 :H | 14.7965; 14.7965; 38.3211 90; 90; 120 | 7265.9 | Messina, Marco S.; Axtell, Jonathan C.; Wang, Yiqun; Chong, Paul; Wixtrom, Alex I.; Kirlikovali, Kent O.; Upton, Brianna M.; Hunter, Bryan M.; Shafaat, Oliver S.; Khan, Saeed I.; Winkler, Jay R.; Gray, Harry B.; Alexandrova, Anastassia N.; Maynard, Heather D.; Spokoyny, Alexander M. Visible-Light-Induced Olefin Activation Using 3D Aromatic Boron-Rich Cluster Photooxidants. Journal of the American Chemical Society, 2016, 138, 6952-6955 |
| 4130443 | CIF | C2 H5 N3 O4 P Zn0.5 | P b c n | 8.4676; 9.549; 15.57 90; 90; 90 | 1258.9 | Inukai, Munehiro; Horike, Satoshi; Itakura, Tomoya; Shinozaki, Ryota; Ogiwara, Naoki; Umeyama, Daiki; Nagarkar, Sanjog S.; Nishiyama, Yusuke; Malon, Michal; Hayashi, Akari; Ohhara, Takashi; Kiyanagi, Ryoji; Kitagawa, Susumu Encapsulating Mobile Proton Carriers into Structural Defects in Coordination Polymer Crystals: High Anhydrous Proton Conduction and Fuel Cell Application. Journal of the American Chemical Society, 2016, 138, 8505-8511 |
| 4130444 | CIF | C2 H5 N3 O4 P Zn0.5 | P b c n | 8.4676; 9.549; 15.57 90; 90; 90 | 1258.9 | Inukai, Munehiro; Horike, Satoshi; Itakura, Tomoya; Shinozaki, Ryota; Ogiwara, Naoki; Umeyama, Daiki; Nagarkar, Sanjog S.; Nishiyama, Yusuke; Malon, Michal; Hayashi, Akari; Ohhara, Takashi; Kiyanagi, Ryoji; Kitagawa, Susumu Encapsulating Mobile Proton Carriers into Structural Defects in Coordination Polymer Crystals: High Anhydrous Proton Conduction and Fuel Cell Application. Journal of the American Chemical Society, 2016, 138, 8505-8511 |
| 4130445 | CIF | C31 H57 B2 Ir O6 P2 | P c c n | 15.982; 16.075; 28.684 90; 90; 90 | 7369 | Press, Loren P.; Kosanovich, Alex J.; McCulloch, Billy J.; Ozerov, Oleg V. High-Turnover Aromatic C-H Borylation Catalyzed by POCOP-Type Pincer Complexes of Iridium. Journal of the American Chemical Society, 2016, 138, 9487-9497 |
| 4130446 | CIF | C57 H108 Cl2 Ir2 O4 P4 | P 1 21/c 1 | 8.512; 20.125; 18.462 90; 98.697; 90 | 3126.3 | Press, Loren P.; Kosanovich, Alex J.; McCulloch, Billy J.; Ozerov, Oleg V. High-Turnover Aromatic C-H Borylation Catalyzed by POCOP-Type Pincer Complexes of Iridium. Journal of the American Chemical Society, 2016, 138, 9487-9497 |
| 4130447 | CIF | C32 H60 B Ir O4 P2 | P 1 21/c 1 | 19.124; 7.909; 24.508 90; 104.134; 90 | 3594.7 | Press, Loren P.; Kosanovich, Alex J.; McCulloch, Billy J.; Ozerov, Oleg V. High-Turnover Aromatic C-H Borylation Catalyzed by POCOP-Type Pincer Complexes of Iridium. Journal of the American Chemical Society, 2016, 138, 9487-9497 |
| 4130448 | CIF | C140 H140 Cl3 Co14.4 N76 O14.4 | P m -3 m | 18.8345; 18.8345; 18.8345 90; 90; 90 | 6681.3 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130449 | CIF | C100 H76 Cl3 Co13.5 N80 O12 | P m -3 m | 18.7059; 18.7059; 18.7059 90; 90; 90 | 6545.4 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130450 | CIF | C109.02 H71.02 Cl3 Co13.44 N63.98 O5.04 | P m -3 m | 18.6522; 18.6522; 18.6522 90; 90; 90 | 6489.2 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130451 | CIF | C87.98 H39.98 Cl3 Co13.5 N80.02 O23.62 | P m -3 m | 18.6011; 18.6011; 18.6011 90; 90; 90 | 6436 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130452 | CIF | C264 H264 Cl6 Co24 N168 O24 | F m -3 c | 37.4139; 37.4139; 37.4139 90; 90; 90 | 52372 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130453 | CIF | C264 H264 Cl6 Co24 N168 O24 | F m -3 c | 37.7048; 37.7048; 37.7048 90; 90; 90 | 53603 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130454 | CIF | C108 H84 Cl3 Co13.5 N72 O12 | P m -3 m | 18.794; 18.794; 18.794 90; 90; 90 | 6638.3 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130455 | CIF | C201 H123 Cl6 Co27.26 N144 O9 | F m -3 c | 37.0668; 37.0668; 37.0668 90; 90; 90 | 50928 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 4130456 | CIF | C192 H96 Cl6 Co27 N144 O48 | F m -3 c | 37.0728; 37.0728; 37.0728 90; 90; 90 | 50953 | Xiao, Dianne J.; Gonzalez, Miguel I.; Darago, Lucy E.; Vogiatzis, Konstantinos D.; Haldoupis, Emmanuel; Gagliardi, Laura; Long, Jeffrey R. Selective, Tunable O2 Binding in Cobalt(II)-Triazolate/Pyrazolate Metal-Organic Frameworks. Journal of the American Chemical Society, 2016, 138, 7161-7170 |
| 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 |
| 4130458 | CIF | C30 H44 N2 | P 1 21/n 1 | 8.0747; 16.5382; 10.1107 90; 102.931; 90 | 1315.95 | Sasaki, Shunsuke; Suzuki, Satoshi; Sameera, W. M. C.; Igawa, Kazunobu; Morokuma, Keiji; Konishi, Gen-Ichi Highly Twisted N,N-Dialkylamines as a Design Strategy to Tune Simple Aromatic Hydrocarbons as Steric Environment-Sensitive Fluorophores. Journal of the American Chemical Society, 2016, 138, 8194-8206 |
| 4130459 | CIF | C18 H20 N2 | P 1 21/n 1 | 9.165; 8.39; 10.289 90; 114.241; 90 | 721.4 | Sasaki, Shunsuke; Suzuki, Satoshi; Sameera, W. M. C.; Igawa, Kazunobu; Morokuma, Keiji; Konishi, Gen-Ichi Highly Twisted N,N-Dialkylamines as a Design Strategy to Tune Simple Aromatic Hydrocarbons as Steric Environment-Sensitive Fluorophores. Journal of the American Chemical Society, 2016, 138, 8194-8206 |
| 4130460 | CIF | C26 H36 N2 | P 1 21/c 1 | 10.6665; 8.8035; 11.6426 90; 98.268; 90 | 1081.91 | Sasaki, Shunsuke; Suzuki, Satoshi; Sameera, W. M. C.; Igawa, Kazunobu; Morokuma, Keiji; Konishi, Gen-Ichi Highly Twisted N,N-Dialkylamines as a Design Strategy to Tune Simple Aromatic Hydrocarbons as Steric Environment-Sensitive Fluorophores. Journal of the American Chemical Society, 2016, 138, 8194-8206 |
| 4130461 | CIF | C24 H28 N2 | P -1 | 7.388; 7.625; 9.047 101.595; 103.106; 99.662 | 473.9 | Sasaki, Shunsuke; Suzuki, Satoshi; Sameera, W. M. C.; Igawa, Kazunobu; Morokuma, Keiji; Konishi, Gen-Ichi Highly Twisted N,N-Dialkylamines as a Design Strategy to Tune Simple Aromatic Hydrocarbons as Steric Environment-Sensitive Fluorophores. Journal of the American Chemical Society, 2016, 138, 8194-8206 |
| 4130462 | CIF | C26 H32 N2 | P -1 | 7.5541; 7.9377; 9.1231 102.214; 102.818; 96.828 | 513.38 | Sasaki, Shunsuke; Suzuki, Satoshi; Sameera, W. M. C.; Igawa, Kazunobu; Morokuma, Keiji; Konishi, Gen-Ichi Highly Twisted N,N-Dialkylamines as a Design Strategy to Tune Simple Aromatic Hydrocarbons as Steric Environment-Sensitive Fluorophores. Journal of the American Chemical Society, 2016, 138, 8194-8206 |
| 4130463 | CIF | C52 H116 Br0.25 Cl1.75 Fe8 Mg1.5 O10 | P 21 21 2 | 38.445; 13.0221; 13.658 90; 90; 90 | 6837.7 | Muñoz Iii, Salvador B; Daifuku, Stephanie L.; Brennessel, William W.; Neidig, Michael L. Isolation, Characterization, and Reactivity of Fe8Me12(-): Kochi's S = 1/2 Species in Iron-Catalyzed Cross-Couplings with MeMgBr and Ferric Salts. Journal of the American Chemical Society, 2016, 138, 7492-7495 |
| 4130464 | CIF | C41.26 H55.51 Cl8.51 N4 P Ru | P -1 | 10.1461; 13.3816; 18.3452 95.62; 94.475; 104.537 | 2385.8 | Lee, Juneyoung; Grandner, Jessica M.; Engle, Keary M.; Houk, K. N.; Grubbs, Robert H. In Situ Catalyst Modification in Atom Transfer Radical Reactions with Ruthenium Benzylidene Complexes. Journal of the American Chemical Society, 2016, 138, 7171-7177 |
| 4130465 | CIF | C4 H7 N9 O8 | P -1 | 9.7563; 12.9792; 17.373 87.744; 73.849; 81.576 | 2090.3 | Zhang, Jiaheng; Dharavath, Srinivas; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M. Energetic Salts Based on 3,5-Bis(dinitromethyl)-1,2,4-triazole Monoanion and Dianion: Controllable Preparation, Characterization, and High Performance. Journal of the American Chemical Society, 2016, 138, 7500-7503 |
| 4130466 | CIF | C4 H11 N9 O9 | P c a 21 | 19.255; 8.1379; 7.8604 90; 90; 90 | 1231.7 | Zhang, Jiaheng; Dharavath, Srinivas; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M. Energetic Salts Based on 3,5-Bis(dinitromethyl)-1,2,4-triazole Monoanion and Dianion: Controllable Preparation, Characterization, and High Performance. Journal of the American Chemical Society, 2016, 138, 7500-7503 |
| 4130467 | CIF | C4 H6 N8 O8 | P 1 21/c 1 | 4.7794; 16.946; 12.51 90; 99.82; 90 | 998.4 | Zhang, Jiaheng; Dharavath, Srinivas; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M. Energetic Salts Based on 3,5-Bis(dinitromethyl)-1,2,4-triazole Monoanion and Dianion: Controllable Preparation, Characterization, and High Performance. Journal of the American Chemical Society, 2016, 138, 7500-7503 |
| 4130468 | CIF | C133 H98 Au6 Cl6 P6 S | P 1 21 1 | 16.0535; 23.8893; 17.5951 90; 103.224; 90 | 6568.9 | Yao, Liao-Yuan; Lee, Terence Kwok-Ming; Yam, Vivian Wing-Wah Thermodynamic-Driven Self-Assembly: Heterochiral Self-Sorting and Structural Reconfiguration in Gold(I)-Sulfido Cluster System. Journal of the American Chemical Society, 2016, 138, 7260-7263 |
| 4130469 | CIF | C176 H128 Au10 Cl2 P8 S4 | P -4 21 c | 23.5737; 23.5737; 29.204 90; 90; 90 | 16229.2 | Yao, Liao-Yuan; Lee, Terence Kwok-Ming; Yam, Vivian Wing-Wah Thermodynamic-Driven Self-Assembly: Heterochiral Self-Sorting and Structural Reconfiguration in Gold(I)-Sulfido Cluster System. Journal of the American Chemical Society, 2016, 138, 7260-7263 |
| 4130470 | CIF | C177 H130 Au10 Cl4 P8 S4 | P 1 21 1 | 16.599; 21.904; 24.856 90; 96.827; 90 | 8973 | Yao, Liao-Yuan; Lee, Terence Kwok-Ming; Yam, Vivian Wing-Wah Thermodynamic-Driven Self-Assembly: Heterochiral Self-Sorting and Structural Reconfiguration in Gold(I)-Sulfido Cluster System. Journal of the American Chemical Society, 2016, 138, 7260-7263 |
| 4130471 | CIF | C134 H102 Au6 Cl6 O P6 S | P 1 21 1 | 16.0034; 23.9493; 17.4176 90; 103.649; 90 | 6487.1 | Yao, Liao-Yuan; Lee, Terence Kwok-Ming; Yam, Vivian Wing-Wah Thermodynamic-Driven Self-Assembly: Heterochiral Self-Sorting and Structural Reconfiguration in Gold(I)-Sulfido Cluster System. Journal of the American Chemical Society, 2016, 138, 7260-7263 |
| 4130472 | CIF | C177 H130 Au10 Cl4 P8 S4 | P 1 21 1 | 16.694; 21.993; 24.942 90; 96.59; 90 | 9097 | Yao, Liao-Yuan; Lee, Terence Kwok-Ming; Yam, Vivian Wing-Wah Thermodynamic-Driven Self-Assembly: Heterochiral Self-Sorting and Structural Reconfiguration in Gold(I)-Sulfido Cluster System. Journal of the American Chemical Society, 2016, 138, 7260-7263 |
| 4130473 | CIF | C328 H234 F48 Mo12 N48 O105 S16 Zn8 | F 4 3 2 | 40.9008; 40.9008; 40.9008 90; 90; 90 | 68422 | Ramsay, William J.; Rizzuto, Felix J.; Ronson, Tanya K.; Caprice, Kenji; Nitschke, Jonathan R. Subtle Ligand Modification Inverts Guest Binding Hierarchy in M(II)8L6 Supramolecular Cubes. Journal of the American Chemical Society, 2016, 138, 7264-7267 |
| 4130474 | CIF | C384 H286 F72 Fe8 Mo12 N75 O100.5 S32 | P -1 | 28.1822; 28.6098; 38.033 72.136; 72.82; 66.502 | 26235 | Ramsay, William J.; Rizzuto, Felix J.; Ronson, Tanya K.; Caprice, Kenji; Nitschke, Jonathan R. Subtle Ligand Modification Inverts Guest Binding Hierarchy in M(II)8L6 Supramolecular Cubes. Journal of the American Chemical Society, 2016, 138, 7264-7267 |
| 4130475 | CIF | C19 H30 O2 | P 21 21 21 | 5.1684; 17.27; 36.9053 90; 90; 90 | 3294.1 | Lu, Hai-Hua; Pronin, Sergey V.; Antonova-Koch, Yevgeniya; Meister, Stephan; Winzeler, Elizabeth A.; Shenvi, Ryan A. Synthesis of (+)-7,20-Diisocyanoadociane and Liver-Stage Antiplasmodial Activity of the Isocyanoterpene Class. Journal of the American Chemical Society, 2016, 138, 7268-7271 |
| 4130476 | CIF | C24 H28 N2 O4 S | P 32 | 13.7509; 13.7509; 10.8608 90; 90; 120 | 1778.5 | Liu, Yong Ethan; Lu, Zhaole; Li, Bo; Tian, Jiaxin; Liu, Feng; Zhao, Junyu; Hou, Chengkang; Li, Yingkun; Niu, Lili; Zhao, Baoguo Enzyme-Inspired Axially Chiral Pyridoxamines Armed with a Cooperative Lateral Amine Chain for Enantioselective Biomimetic Transamination. Journal of the American Chemical Society, 2016, 138, 10730-10733 |
| 4130477 | CIF | C107 La2 S6 | P 1 21/n 1 | 12.3918; 23.9814; 18.4258 90; 95.529; 90 | 5450.2 | Cai, Wenting; Li, Fang-Fang; Bao, Lipiao; Xie, Yunpeng; Lu, Xing Isolation and Crystallographic Characterization of La2C2@Cs(574)-C102 and La2C2@C2(816)-C104: Evidence for the Top-Down Formation Mechanism of Fullerenes. Journal of the American Chemical Society, 2016, 138, 6670-6675 |
| 4130478 | CIF | C109 H0 La2 N0 Ni0 S6 | P n m a | 24.2162; 18.0709; 12.735 90; 90; 90 | 5572.9 | Cai, Wenting; Li, Fang-Fang; Bao, Lipiao; Xie, Yunpeng; Lu, Xing Isolation and Crystallographic Characterization of La2C2@Cs(574)-C102 and La2C2@C2(816)-C104: Evidence for the Top-Down Formation Mechanism of Fullerenes. Journal of the American Chemical Society, 2016, 138, 6670-6675 |
| 4130479 | CIF | C44 H35 B N5 O2 P Ru | C 1 2/c 1 | 40.5861; 9.6009; 18.7564 90; 100.373; 90 | 7189.2 | Tseng, Kuei-Nin T; Kampf, Jeff W.; Szymczak, Nathaniel K. Modular Attachment of Appended Boron Lewis Acids to a Ruthenium Pincer Catalyst: Metal-Ligand Cooperativity Enables Selective Alkyne Hydrogenation. Journal of the American Chemical Society, 2016, 138, 10378-10381 |
| 4130480 | CIF | C59 H61 B2 N5 O4 P Ru | P c a 21 | 20.8335; 12.5143; 39.2291 90; 90; 90 | 10227.7 | Tseng, Kuei-Nin T; Kampf, Jeff W.; Szymczak, Nathaniel K. Modular Attachment of Appended Boron Lewis Acids to a Ruthenium Pincer Catalyst: Metal-Ligand Cooperativity Enables Selective Alkyne Hydrogenation. Journal of the American Chemical Society, 2016, 138, 10378-10381 |
| 4130481 | CIF | C49 H46 B N5 P Ru | P 1 2/c 1 | 18.234; 12.0654; 18.1135 90; 90.69; 90 | 3984.7 | Tseng, Kuei-Nin T; Kampf, Jeff W.; Szymczak, Nathaniel K. Modular Attachment of Appended Boron Lewis Acids to a Ruthenium Pincer Catalyst: Metal-Ligand Cooperativity Enables Selective Alkyne Hydrogenation. Journal of the American Chemical Society, 2016, 138, 10378-10381 |
| 4130482 | CIF | C47 H45 B N5 O P Ru | P 1 21/n 1 | 11.564; 12.7724; 27.0595 90; 101.252; 90 | 3919.9 | Tseng, Kuei-Nin T; Kampf, Jeff W.; Szymczak, Nathaniel K. Modular Attachment of Appended Boron Lewis Acids to a Ruthenium Pincer Catalyst: Metal-Ligand Cooperativity Enables Selective Alkyne Hydrogenation. Journal of the American Chemical Society, 2016, 138, 10378-10381 |
| 4130483 | CIF | C32 H38 O2 Si2 | C 1 2/c 1 | 26.3946; 11.3169; 21.4863 90; 115.327; 90 | 5801.2 | Hua, Yuanda; Asgari, Parham; Avullala, Thirupataiah; Jeon, Junha Catalytic Reductive ortho-C-H Silylation of Phenols with Traceless, Versatile Acetal Directing Groups and Synthetic Applications of Dioxasilines. Journal of the American Chemical Society, 2016, 138, 7982-7991 |
| 4130484 | CIF | C92 H11 Ce S2 | P n m a | 20.9653; 15.2285; 14.6886 90; 90; 90 | 4689.6 | Takano, Yuta; Tashita, Ryo; Suzuki, Mitsuaki; Nagase, Shigeru; Imahori, Hiroshi; Akasaka, Takeshi Molecular Location Sensing Approach by Anisotropic Magnetism of an Endohedral Metallofullerene. Journal of the American Chemical Society, 2016, 138, 8000-8006 |
| 4130485 | CIF | C38 H52 B Co N5 O3 | P 1 21/c 1 | 14.9929; 9.6072; 24.7958 90; 98.369; 90 | 3533.55 | Kumar, Pankaj; Lee, Yong-Min; Hu, Lianrui; Chen, Jianwei; Park, Young Jun; Yao, Jiannian; Chen, Hui; Karlin, Kenneth D.; Nam, Wonwoo Factors That Control the Reactivity of Cobalt(III)-Nitrosyl Complexes in Nitric Oxide Transfer and Dioxygenation Reactions: A Combined Experimental and Theoretical Investigation. Journal of the American Chemical Society, 2016, 138, 7753-7762 |
| 4130486 | CIF | C39 H34 B F10 O2 P | P 1 21/c 1 | 11.4134; 20.663; 15.422 90; 102.95; 90 | 3544.5 | Chen, Guo-Qiang; Kehr, Gerald; Mück-Lichtenfeld, Christian; Daniliuc, Constantin G.; Erker, Gerhard Phospha-Claisen Type Reactions at Frustrated Lewis Pair Frameworks. Journal of the American Chemical Society, 2016, 138, 8554-8559 |
| 4130487 | CIF | C41 H36 B F10 O4 P | P -1 | 11.365; 14.8236; 16.1305 65.606; 70.053; 77.352 | 2316.74 | Chen, Guo-Qiang; Kehr, Gerald; Mück-Lichtenfeld, Christian; Daniliuc, Constantin G.; Erker, Gerhard Phospha-Claisen Type Reactions at Frustrated Lewis Pair Frameworks. Journal of the American Chemical Society, 2016, 138, 8554-8559 |
| 4130488 | CIF | C31 H34 B F10 O P | P -1 | 9.1467; 14.6625; 14.7129 90.266; 102.873; 107.489 | 1829.24 | Chen, Guo-Qiang; Kehr, Gerald; Mück-Lichtenfeld, Christian; Daniliuc, Constantin G.; Erker, Gerhard Phospha-Claisen Type Reactions at Frustrated Lewis Pair Frameworks. Journal of the American Chemical Society, 2016, 138, 8554-8559 |
| 4130489 | CIF | C31 H32 B F10 O4 P | P 1 21/c 1 | 12.1821; 18.7258; 14.2778 90; 105.022; 90 | 3145.74 | Chen, Guo-Qiang; Kehr, Gerald; Mück-Lichtenfeld, Christian; Daniliuc, Constantin G.; Erker, Gerhard Phospha-Claisen Type Reactions at Frustrated Lewis Pair Frameworks. Journal of the American Chemical Society, 2016, 138, 8554-8559 |
| 4130490 | CIF | C35 H26 B F10 O P | P -1 | 10.3933; 11.7676; 14.8634 104.124; 101.199; 111.497 | 1557.12 | Chen, Guo-Qiang; Kehr, Gerald; Mück-Lichtenfeld, Christian; Daniliuc, Constantin G.; Erker, Gerhard Phospha-Claisen Type Reactions at Frustrated Lewis Pair Frameworks. Journal of the American Chemical Society, 2016, 138, 8554-8559 |
| 4130491 | CIF | C24 H72 Pd4 Sb8 | C m c 21 | 18.4966; 13.0377; 19.9791 90; 90; 90 | 4818.02 | Benjamin, Sophie L.; Krämer, Tobias; Levason, William; Light, Mark E.; Macgregor, Stuart A.; Reid, Gillian [Pd4(μ3-SbMe3)4(SbMe3)4]: A Pd(0) Tetrahedron with μ3-Bridging Trimethylantimony Ligands. Journal of the American Chemical Society, 2016, 138, 6964-6967 |
| 4130492 | CIF | C8 H24 Cl8 Pd2 Sb4 | P 1 21/c 1 | 9.6504; 10.0441; 13.2924 90; 103.761; 90 | 1251.44 | Benjamin, Sophie L.; Krämer, Tobias; Levason, William; Light, Mark E.; Macgregor, Stuart A.; Reid, Gillian [Pd4(μ3-SbMe3)4(SbMe3)4]: A Pd(0) Tetrahedron with μ3-Bridging Trimethylantimony Ligands. Journal of the American Chemical Society, 2016, 138, 6964-6967 |
| 4130493 | CIF | C21 H35 I N2 O | P 1 21/n 1 | 5.5248; 15.134; 26.429 90; 95.927; 90 | 2198 | Tona, Veronica; de la Torre, Aurélien; Padmanaban, Mohan; Ruider, Stefan; González, Leticia; Maulide, Nuno Chemo- and Stereoselective Transition-Metal-Free Amination of Amides with Azides. Journal of the American Chemical Society, 2016, 138, 8348-8351 |
| 4130494 | CIF | C20.5 H28 Cl F3 N2 O5 S | P -1 | 12.3584; 13.1989; 16.1664 67.422; 72.456; 78.457 | 2311 | Tona, Veronica; de la Torre, Aurélien; Padmanaban, Mohan; Ruider, Stefan; González, Leticia; Maulide, Nuno Chemo- and Stereoselective Transition-Metal-Free Amination of Amides with Azides. Journal of the American Chemical Society, 2016, 138, 8348-8351 |
| 4130495 | CIF | C23 H33 Cl10 N3 O2 S | P 21 21 21 | 12.4064; 13.3489; 20.4516 90; 90; 90 | 3387 | Lathrop, Stephen P.; Pompeo, Matthew; Chang, Wen-Tau T; Movassaghi, Mohammad Convergent and Biomimetic Enantioselective Total Synthesis of (-)-Communesin F. Journal of the American Chemical Society, 2016, 138, 7763-7769 |
| 4130496 | CIF | C21 H22 Br F3 N2 O | P 21 21 21 | 14.5823; 16.3674; 17.4983 90; 90; 90 | 4176.4 | Lin, Jin-Shun; Dong, Xiao-Yang; Li, Tao-Tao; Jiang, Na-Chuan; Tan, Bin; Liu, Xin-Yuan A Dual-Catalytic Strategy To Direct Asymmetric Radical Aminotrifluoromethylation of Alkenes. Journal of the American Chemical Society, 2016, 138, 9357-9360 |
| 4130497 | CIF | C119 H152 P4 | P 1 21/n 1 | 13.84; 26.967; 14.534 90; 95.3; 90 | 5401.2 | Tan, Gengwen; Li, Shuyu; Chen, Sheng; Sui, Yunxia; Zhao, Yue; Wang, Xinping Isolable Diphosphorus-Centered Radical Anion and Diradical Dianion. Journal of the American Chemical Society, 2016, 138, 6735-6738 |
| 4130498 | CIF | C56 H68 P2 | C 1 2/c 1 | 30.27; 9.006; 17.97 90; 102.24; 90 | 4787.5 | Tan, Gengwen; Li, Shuyu; Chen, Sheng; Sui, Yunxia; Zhao, Yue; Wang, Xinping Isolable Diphosphorus-Centered Radical Anion and Diradical Dianion. Journal of the American Chemical Society, 2016, 138, 6735-6738 |
| 4130499 | CIF | C76 H108 K O8 P2 | P 1 21/n 1 | 13.392; 17.887; 15.88 90; 107.74; 90 | 3623.1 | Tan, Gengwen; Li, Shuyu; Chen, Sheng; Sui, Yunxia; Zhao, Yue; Wang, Xinping Isolable Diphosphorus-Centered Radical Anion and Diradical Dianion. Journal of the American Chemical Society, 2016, 138, 6735-6738 |
| 4130500 | CIF | C112 H180 K2 O20 P2 | P -1 | 13.4139; 13.5562; 17.2567 102.92; 104.846; 96.8203 | 2904.4 | Tan, Gengwen; Li, Shuyu; Chen, Sheng; Sui, Yunxia; Zhao, Yue; Wang, Xinping Isolable Diphosphorus-Centered Radical Anion and Diradical Dianion. Journal of the American Chemical Society, 2016, 138, 6735-6738 |
| 4130501 | CIF | C11 H20 O2 | P 21 21 21 | 7.5167; 11.505; 26.098 90; 90; 90 | 2256.9 | Börjesson, Marino; Moragas, Toni; Martin, Ruben Ni-Catalyzed Carboxylation of Unactivated Alkyl Chlorides with CO2. Journal of the American Chemical Society, 2016, 138, 7504-7507 |
| 4130502 | CIF | C44 H56 N4 Ni | P -1 | 10.9724; 13.0726; 13.9127 86.6707; 70.5014; 82.1667 | 1863.44 | Börjesson, Marino; Moragas, Toni; Martin, Ruben Ni-Catalyzed Carboxylation of Unactivated Alkyl Chlorides with CO2. Journal of the American Chemical Society, 2016, 138, 7504-7507 |
| 4130503 | CIF | C45 H56 F3 N4 Ni O3 S | P -1 | 11.6943; 12.7969; 15.8831 94.849; 98.732; 113.293 | 2130.3 | Börjesson, Marino; Moragas, Toni; Martin, Ruben Ni-Catalyzed Carboxylation of Unactivated Alkyl Chlorides with CO2. Journal of the American Chemical Society, 2016, 138, 7504-7507 |
| 4130504 | CIF | C25 H45 B Cl N P Rh | P 1 21/c 1 | 11.91; 17.013; 14.078 90; 109.423; 90 | 2690.2 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130505 | CIF | C18 H26 B N | P -1 | 5.863; 14.7829; 19.258 104.809; 94.491; 90.355 | 1608.1 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130506 | CIF | C22 H30 B Fe N | P -1 | 9.8819; 10.5352; 10.9353 99.896; 111.336; 107.565 | 958.78 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130507 | CIF | C32 H39 B N2 O2 | P -1 | 10.05; 11.146; 12.973 89.147; 76.019; 88.928 | 1409.8 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130508 | CIF | C52 H90 B0 Cl2 N2 P2 Rh2 | P 1 21/n 1 | 12.243; 16.865; 14.294 90; 111.702; 90 | 2742.2 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130509 | CIF | C30 H46 B2 N2 | C 1 2/c 1 | 26.975; 9.754; 11.28 90; 114.33; 90 | 2704 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130510 | CIF | C42 H66 B3 N3 O0.15 | R 3 :H | 15.57; 15.57; 14.579 90; 90; 120 | 3061 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
| 4130511 | CIF | C21 H24 Al P | P 3 1 c | 12.0529; 12.0529; 7.4996 90; 90; 120 | 943.52 | Knaus, Maximilian G. M.; Giuman, Marco M.; Pöthig, Alexander; Rieger, Bernhard End of Frustration: Catalytic Precision Polymerization with Highly Interacting Lewis Pairs. Journal of the American Chemical Society, 2016, 138, 7776-7781 |
| 4130512 | CIF | C20 H4 F24 Na O8 Y | C 1 2/c 1 | 21.734; 12.093; 14.1309 90; 125.562; 90 | 3021.3 | Barry, Matthew C.; Wei, Zheng; He, Tianyu; Filatov, Alexander S.; Dikarev, Evgeny V. Volatile Single-Source Precursors for the Low-Temperature Preparation of Sodium-Rare Earth Metal Fluorides. Journal of the American Chemical Society, 2016, 138, 8883-8887 |
| 4130513 | CIF | C20 H4 Eu F24 Na O8 | C 1 2/c 1 | 21.5879; 12.1464; 14.2653 90; 125.086; 90 | 3060.9 | Barry, Matthew C.; Wei, Zheng; He, Tianyu; Filatov, Alexander S.; Dikarev, Evgeny V. Volatile Single-Source Precursors for the Low-Temperature Preparation of Sodium-Rare Earth Metal Fluorides. Journal of the American Chemical Society, 2016, 138, 8883-8887 |
| 4130514 | CIF | C20 H4 Er F24 Na O8 | C 1 2/c 1 | 21.789; 12.0958; 14.096 90; 125.614; 90 | 3020.2 | Barry, Matthew C.; Wei, Zheng; He, Tianyu; Filatov, Alexander S.; Dikarev, Evgeny V. Volatile Single-Source Precursors for the Low-Temperature Preparation of Sodium-Rare Earth Metal Fluorides. Journal of the American Chemical Society, 2016, 138, 8883-8887 |
| 4130515 | CIF | C25 H22 O2 | P 21 21 21 | 5.8337; 14.6798; 20.8894 90; 90; 90 | 1788.9 | Clarke, Christopher; Incerti-Pradillos, Celia A; Lam, Hon Wai Enantioselective Nickel-Catalyzed anti-Carbometallative Cyclizations of Alkynyl Electrophiles Enabled by Reversible Alkenylnickel E/Z Isomerization. Journal of the American Chemical Society, 2016, 138, 8068-8071 |
| 4130516 | CIF | C21 H19 Cl O2 | P 21 21 21 | 6.0546; 15.0183; 18.7832 90; 90; 90 | 1708 | Clarke, Christopher; Incerti-Pradillos, Celia A; Lam, Hon Wai Enantioselective Nickel-Catalyzed anti-Carbometallative Cyclizations of Alkynyl Electrophiles Enabled by Reversible Alkenylnickel E/Z Isomerization. Journal of the American Chemical Society, 2016, 138, 8068-8071 |
| 4130517 | CIF | C22 H20 O2 | I 1 2 1 | 9.4271; 6.00798; 29.03 90; 93.1504; 90 | 1641.71 | Clarke, Christopher; Incerti-Pradillos, Celia A; Lam, Hon Wai Enantioselective Nickel-Catalyzed anti-Carbometallative Cyclizations of Alkynyl Electrophiles Enabled by Reversible Alkenylnickel E/Z Isomerization. Journal of the American Chemical Society, 2016, 138, 8068-8071 |
| 4130518 | CIF | C17 H16 O | R 3 :H | 24.0701; 24.0701; 12.2447 90; 90; 120 | 6143.8 | Clarke, Christopher; Incerti-Pradillos, Celia A; Lam, Hon Wai Enantioselective Nickel-Catalyzed anti-Carbometallative Cyclizations of Alkynyl Electrophiles Enabled by Reversible Alkenylnickel E/Z Isomerization. Journal of the American Chemical Society, 2016, 138, 8068-8071 |
| 4130519 | CIF | C12 H18 F12 Mg N6 P2 | R -3 :H | 11.1793; 11.1793; 16.6946 90; 90; 120 | 1806.91 | Keyzer, Evan N.; Glass, Hugh F. J.; Liu, Zigeng; Bayley, Paul M.; Dutton, Siân E; Grey, Clare P.; Wright, Dominic S. Mg(PF6)2-Based Electrolyte Systems: Understanding Electrolyte-Electrode Interactions for the Development of Mg-Ion Batteries. Journal of the American Chemical Society, 2016, 138, 8682-8685 |
| 4130520 | CIF | C64 H61 F18 N7 P3 | C 1 2/m 1 | 27.8633; 19.6876; 14.3635 90; 121.019; 90 | 6752.5 | Cheng, Chuyang; Cheng, Tao; Xiao, Hai; Krzyaniak, Matthew D.; Wang, Yuping; McGonigal, Paul R.; Frasconi, Marco; Barnes, Jonathan C.; Fahrenbach, Albert C.; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 2016, 138, 8288-8300 |
| 4130521 | CIF | C59 H62 F24 N7 P4 | P -1 | 16.64; 16.71; 17.16 75.037; 70.814; 62.956 | 3980 | Cheng, Chuyang; Cheng, Tao; Xiao, Hai; Krzyaniak, Matthew D.; Wang, Yuping; McGonigal, Paul R.; Frasconi, Marco; Barnes, Jonathan C.; Fahrenbach, Albert C.; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 2016, 138, 8288-8300 |
| 4130522 | CIF | C70 H72 F18 N8 P3 | P -1 | 9.938; 13.616; 14.482 113.563; 99.933; 101.953 | 1684.6 | Cheng, Chuyang; Cheng, Tao; Xiao, Hai; Krzyaniak, Matthew D.; Wang, Yuping; McGonigal, Paul R.; Frasconi, Marco; Barnes, Jonathan C.; Fahrenbach, Albert C.; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 2016, 138, 8288-8300 |
| 4130523 | CIF | C146 H151 F42 N21 P7 | P 1 21/n 1 | 16.6492; 19.7296; 22.6647 90; 95.147; 90 | 7414.9 | Cheng, Chuyang; Cheng, Tao; Xiao, Hai; Krzyaniak, Matthew D.; Wang, Yuping; McGonigal, Paul R.; Frasconi, Marco; Barnes, Jonathan C.; Fahrenbach, Albert C.; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 2016, 138, 8288-8300 |
| 4130524 | CIF | C61 H64.5 F24 N8.5 P4 | P -1 | 13.8924; 19.3041; 28.5592 87.962; 83.733; 75.084 | 7356.5 | Cheng, Chuyang; Cheng, Tao; Xiao, Hai; Krzyaniak, Matthew D.; Wang, Yuping; McGonigal, Paul R.; Frasconi, Marco; Barnes, Jonathan C.; Fahrenbach, Albert C.; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 2016, 138, 8288-8300 |
| 4130525 | CIF | C72 H78 F30 N12 P5 | P -1 | 13.9238; 18.0258; 19.2008 87.542; 74.7; 83.934 | 4621.8 | Cheng, Chuyang; Cheng, Tao; Xiao, Hai; Krzyaniak, Matthew D.; Wang, Yuping; McGonigal, Paul R.; Frasconi, Marco; Barnes, Jonathan C.; Fahrenbach, Albert C.; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 2016, 138, 8288-8300 |
| 4130526 | CIF | C68 H124 Bi7.68 K3 N6 O18 Pb5.98 U | P 1 21/n 1 | 15.1698; 23.0713; 30.3293 90; 96.032; 90 | 10556.1 | Lichtenberger, Niels; Wilson, Robert J.; Eulenstein, Armin R.; Massa, Werner; Clérac, Rodolphe; Weigend, Florian; Dehnen, Stefanie Main Group Metal-Actinide Magnetic Coupling and Structural Response Upon U(4+) Inclusion Into Bi, Tl/Bi, or Pb/Bi Cages. Journal of the American Chemical Society, 2016, 138, 9033-9036 |
| 4130527 | CIF | C64 H84 Bi12 K3 N9 O18 U | P b a 2 | 31.7268; 39.3976; 16.698 90; 90; 90 | 20871.8 | Lichtenberger, Niels; Wilson, Robert J.; Eulenstein, Armin R.; Massa, Werner; Clérac, Rodolphe; Weigend, Florian; Dehnen, Stefanie Main Group Metal-Actinide Magnetic Coupling and Structural Response Upon U(4+) Inclusion Into Bi, Tl/Bi, or Pb/Bi Cages. Journal of the American Chemical Society, 2016, 138, 9033-9036 |
| 4130528 | CIF | C63 H124 Bi11 K3 N8 O18 Tl2 U | P 1 21/m 1 | 14.6092; 21.8659; 16.3877 90; 106.917; 90 | 5008.4 | Lichtenberger, Niels; Wilson, Robert J.; Eulenstein, Armin R.; Massa, Werner; Clérac, Rodolphe; Weigend, Florian; Dehnen, Stefanie Main Group Metal-Actinide Magnetic Coupling and Structural Response Upon U(4+) Inclusion Into Bi, Tl/Bi, or Pb/Bi Cages. Journal of the American Chemical Society, 2016, 138, 9033-9036 |
| 4130529 | CIF | C25 H23 N O3 S | P 21 21 21 | 9.7547; 12.6902; 17.196 90; 90; 90 | 2128.68 | Guo, Chang; Fleige, Mirco; Janssen-Müller, Daniel; Daniliuc, Constantin G.; Glorius, Frank Cooperative N-Heterocyclic Carbene/Palladium-Catalyzed Enantioselective Umpolung Annulations. Journal of the American Chemical Society, 2016, 138, 7840-7843 |
| 4130530 | CIF | C102 H30 F42 N6 O12 | C 1 2/c 1 | 29.2365; 33.0466; 32.1833 90; 91.677; 90 | 31081 | Meng, Dong; Fu, Huiting; Xiao, Chengyi; Meng, Xiangyi; Winands, Thorsten; Ma, Wei; Wei, Wei; Fan, Bingbing; Huo, Lijun; Doltsinis, Nikos L.; Li, Yan; Sun, Yanming; Wang, Zhaohui Three-Bladed Rylene Propellers with Three-Dimensional Network Assembly for Organic Electronics. Journal of the American Chemical Society, 2016, 138, 10184-10190 |
| 4130531 | CIF | C144 H150 N6 O12 Se3 | C 1 2/c 1 | 24.871; 40.663; 31.272 90; 102.71; 90 | 30851 | Meng, Dong; Fu, Huiting; Xiao, Chengyi; Meng, Xiangyi; Winands, Thorsten; Ma, Wei; Wei, Wei; Fan, Bingbing; Huo, Lijun; Doltsinis, Nikos L.; Li, Yan; Sun, Yanming; Wang, Zhaohui Three-Bladed Rylene Propellers with Three-Dimensional Network Assembly for Organic Electronics. Journal of the American Chemical Society, 2016, 138, 10184-10190 |
| 4130532 | CIF | C92.4 H105.6 F15.6 N2 O33.2 P8 | P 1 | 13.386; 13.874; 17.401 91.797; 109.34; 109.77 | 2831.9 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130533 | CIF | C92 H108.9 Cl2 F18.9 N2 O33.8 P8 | P 1 | 13.174; 14.676; 16.965 67.422; 71.903; 82.706 | 2878.7 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130534 | CIF | C94 H112 F18 N2 O36 P8 | P 1 | 12.132; 14.541; 15.468 90.106; 81.165; 84.626 | 2684.1 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130535 | CIF | C170.8 H192.9 F22.55 N3.8 O70.5 P16 | P 1 21 1 | 22.28; 18.09; 24.96 90; 106.28; 90 | 9657 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130536 | CIF | C46 H54 F9 N O18 P4 | P 1 21 1 | 11.93; 17.817; 12.515 90; 95.225; 90 | 2649.1 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130537 | CIF | C96.2 H111.3 F21.3 N2 O37.1 P8 | P 1 | 12.78; 14.37; 18.31 70.09; 69.92; 69.68 | 2867 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130538 | CIF | C192 H228 F48 N4 O72.4 P16 | P 1 | 12.65; 18.35; 26.59 81.38; 84.56; 70.12 | 5732 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130539 | CIF | C79 H84 Cl N6 O25.8 P4 | C 1 2/c 1 | 17.315; 34.061; 17.316 90; 90.201; 90 | 10212 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130540 | CIF | C47.5 H58.25 Cl F8.25 N O17.75 P4 | P -1 | 12.99; 15.33; 16.81 115.32; 99.27; 100.53 | 2865 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130541 | CIF | C95.2 H117.8 Cl2 F13.8 N2 O33.15 P8 | P 1 21 1 | 12.859; 26.902; 17.078 90; 109.58; 90 | 5566.2 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130542 | CIF | C98 H108 Cl2 F12 N2 O34.15 P8 | P 1 | 12.37; 13.26; 17.96 69.97; 78.83; 82.15 | 2707 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130543 | CIF | C95.2 H113.8 Cl2 F25.8 N2 O36.6 P8 | P 1 | 12.779; 17.178; 17.193 65.681; 70.396; 73.262 | 3190.2 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130544 | CIF | C88 H101 F15 N2 O33 P8 S2 | P 1 | 11.99; 12.82; 17.65 87.99; 87.73; 83.4 | 2692 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130545 | CIF | C98.9 H122.35 Cl2 F22.35 N2 O37.45 P8 | P 1 | 12.59; 15.96; 16.97 93.69; 107.73; 105.58 | 3089 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130546 | CIF | C82.5 H92.75 F6.75 N2 O32.25 P8 | P 1 | 13.19; 13.77; 17.91 95.67; 110.4; 109 | 2799 | Pinalli, Roberta; Brancatelli, Giovanna; Pedrini, Alessandro; Menozzi, Daniela; Hernández, Daniel; Ballester, Pablo; Geremia, Silvano; Dalcanale, Enrico The Origin of Selectivity in the Complexation of N-Methyl Amino Acids by Tetraphosphonate Cavitands. Journal of the American Chemical Society, 2016, 138, 8569-8580 |
| 4130547 | CIF | C24 H18 Br N O3 S | P 65 | 9.4218; 9.4218; 41.184 90; 90; 120 | 3166.1 | Wang, Qiang; Li, Tian-Ren; Lu, Liang-Qiu; Li, Miao-Miao; Zhang, Kai; Xiao, Wen-Jing Catalytic Asymmetric [4 + 1] Annulation of Sulfur Ylides with Copper-Allenylidene Intermediates. Journal of the American Chemical Society, 2016, 138, 8360-8363 |
| 4130548 | CIF | C37 H32 N2 O4 S2 | P 1 21/c 1 | 11.638; 9.695; 28.574 90; 96.741; 90 | 3202 | Wang, Qiang; Li, Tian-Ren; Lu, Liang-Qiu; Li, Miao-Miao; Zhang, Kai; Xiao, Wen-Jing Catalytic Asymmetric [4 + 1] Annulation of Sulfur Ylides with Copper-Allenylidene Intermediates. Journal of the American Chemical Society, 2016, 138, 8360-8363 |
| 4130549 | CIF | C54 H38 | P 1 21/c 1 | 21.7706; 10.2389; 17.6237 90; 112.03; 90 | 3641.62 | Liu, Junzhi; Osella, Silvio; Ma, Ji; Berger, Reinhard; Beljonne, David; Schollmeyer, Dieter; Feng, Xinliang; Müllen, Klaus Fused Dibenzo[a,m]rubicene: A New Bowl-Shaped Subunit of C70 Containing Two Pentagons. Journal of the American Chemical Society, 2016, 138, 8364-8367 |
| 4130550 | CIF | C54 H40 Cl2 | P -1 | 11.7932; 18.2962; 20.0268 107.388; 93.328; 96.709 | 4075.7 | Liu, Junzhi; Osella, Silvio; Ma, Ji; Berger, Reinhard; Beljonne, David; Schollmeyer, Dieter; Feng, Xinliang; Müllen, Klaus Fused Dibenzo[a,m]rubicene: A New Bowl-Shaped Subunit of C70 Containing Two Pentagons. Journal of the American Chemical Society, 2016, 138, 8364-8367 |
| 4130551 | CIF | C32 H55 N7 O9 | P 21 21 21 | 9.0142; 10.94112; 38.4416 90; 90; 90 | 3791.32 | Mazzier, Daniela; Crisma, Marco; De Poli, Matteo; Marafon, Giulia; Peggion, Cristina; Clayden, Jonathan; Moretto, Alessandro Helical Foldamers Incorporating Photoswitchable Residues for Light-Mediated Modulation of Conformational Preference. Journal of the American Chemical Society, 2016, 138, 8007-8018 |
| 4130552 | CIF | C19 H32 N2 O6 | P 21 21 21 | 12.78876; 21.3074; 42.2055 90; 90; 90 | 11500.8 | Mazzier, Daniela; Crisma, Marco; De Poli, Matteo; Marafon, Giulia; Peggion, Cristina; Clayden, Jonathan; Moretto, Alessandro Helical Foldamers Incorporating Photoswitchable Residues for Light-Mediated Modulation of Conformational Preference. Journal of the American Chemical Society, 2016, 138, 8007-8018 |
| 4130553 | CIF | C336 H210 Ag30 Au80 Cl15 | P -3 1 c | 30.5957; 30.5957; 30.7966 90; 90; 120 | 24966.3 | Zeng, Jiu-Lian; Guan, Zong-Jie; Du, Yang; Nan, Zi-Ang; Lin, Yu-Mei; Wang, Quan-Ming Chloride-Promoted Formation of a Bimetallic Nanocluster Au80Ag30 and the Total Structure Determination. Journal of the American Chemical Society, 2016, 138, 7848-7851 |
| 4130554 | CIF | C68 H60 N4 O4 | P 1 21/n 1 | 24.0438; 11.127; 26.6039 90; 92.549; 90 | 7110.4 | Das, Soumyajit; Herng, Tun Seng; Zafra, José L; Burrezo, Paula Mayorga; Kitano, Masaaki; Ishida, Masatoshi; Gopalakrishna, Tullimilli Y.; Hu, Pan; Osuka, Atsuhiro; Casado, Juan; Ding, Jun; Casanova, David; Wu, Jishan Fully Fused Quinoidal/Aromatic Carbazole Macrocycles with Poly-radical Characters. Journal of the American Chemical Society, 2016, 138, 7782-7790 |
| 4130555 | CIF | C123 H114 N6 O6 | P 4/n :2 | 38.523; 38.523; 14.3978 90; 90; 90 | 21366.6 | Das, Soumyajit; Herng, Tun Seng; Zafra, José L; Burrezo, Paula Mayorga; Kitano, Masaaki; Ishida, Masatoshi; Gopalakrishna, Tullimilli Y.; Hu, Pan; Osuka, Atsuhiro; Casado, Juan; Ding, Jun; Casanova, David; Wu, Jishan Fully Fused Quinoidal/Aromatic Carbazole Macrocycles with Poly-radical Characters. Journal of the American Chemical Society, 2016, 138, 7782-7790 |
| 4130556 | CIF | C13 H14 N2 O | P 1 21 1 | 5.7473; 25.7792; 15.3715 90; 90.0512; 90 | 2277.45 | Friis, Stig D.; Pirnot, Michael T.; Buchwald, Stephen L. Asymmetric Hydroarylation of Vinylarenes Using a Synergistic Combination of CuH and Pd Catalysis. Journal of the American Chemical Society, 2016, 138, 8372-8375 |
| 4130557 | CIF | C23 H21 Cl N2 O | P b c a | 9.4441; 9.3924; 44.328 90; 90; 90 | 3932 | Gerry, Christopher J.; Hua, Bruce K.; Wawer, Mathias J.; Knowles, Jonathan P.; Nelson, Jr, Shawn D; Verho, Oscar; Dandapani, Sivaraman; Wagner, Bridget K.; Clemons, Paul A.; Booker-Milburn, Kevin I; Boskovic, Zarko V.; Schreiber, Stuart L. Real-Time Biological Annotation of Synthetic Compounds. Journal of the American Chemical Society, 2016, 138, 8920-8927 |
| 4130558 | CIF | C33 H30 O5 P2 | P 1 21 1 | 8.57; 10.21; 16.63 90; 98.84; 90 | 1438 | Huang, Zhijian; Huang, Xuan; Li, Baosheng; Mou, Chengli; Yang, Song; Song, Bao-An; Chi, Yonggui Robin Access to P-Stereogenic Phosphinates via N-Heterocyclic Carbene-Catalyzed Desymmetrization of Bisphenols. Journal of the American Chemical Society, 2016, 138, 7524-7527 |
| 4130559 | CIF | C26 H21 Br2 O6 P | C 1 2 1 | 14.7211; 7.1449; 23.5913 90; 90.528; 90 | 2481.2 | Huang, Zhijian; Huang, Xuan; Li, Baosheng; Mou, Chengli; Yang, Song; Song, Bao-An; Chi, Yonggui Robin Access to P-Stereogenic Phosphinates via N-Heterocyclic Carbene-Catalyzed Desymmetrization of Bisphenols. Journal of the American Chemical Society, 2016, 138, 7524-7527 |
| 4130560 | CIF | C36 H70 Au3 Ca Cl9 Cu6 N6 O30 S6 | P 63 | 17.85; 17.85; 13.064 90; 90; 120 | 3604.8 | Mon, Marta; Ferrando-Soria, Jesús; Grancha, Thais; Fortea-Pérez, Francisco R; Gascon, Jorge; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio Selective Gold Recovery and Catalysis in a Highly Flexible Methionine-Decorated Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 7864-7867 |
| 4130561 | CIF | C36 H84 Ca Cu6 N6 O37 S6 | P 63 | 17.7992; 17.7992; 12.7145 90; 90; 120 | 3488.4 | Mon, Marta; Ferrando-Soria, Jesús; Grancha, Thais; Fortea-Pérez, Francisco R; Gascon, Jorge; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio Selective Gold Recovery and Catalysis in a Highly Flexible Methionine-Decorated Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 7864-7867 |
| 4130562 | CIF | C39 H70 Au2 Ca Cl2 Cu6 N6 O27 S6 | P 63 | 17.7487; 17.7487; 12.695 90; 90; 120 | 3463.4 | Mon, Marta; Ferrando-Soria, Jesús; Grancha, Thais; Fortea-Pérez, Francisco R; Gascon, Jorge; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio Selective Gold Recovery and Catalysis in a Highly Flexible Methionine-Decorated Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 7864-7867 |
| 4130563 | CIF | C50 H66 Cl2 Fe2 N4 | P 1 21/n 1 | 13.2003; 12.3054; 15.2936 90; 109.297; 90 | 2344.65 | Bellows, Sarina M.; Arnet, Nicholas A.; Gurubasavaraj, Prabhuodeyara M.; Brennessel, William W.; Bill, Eckhard; Cundari, Thomas R.; Holland, Patrick L. The Mechanism of N-N Double Bond Cleavage by an Iron(II) Hydride Complex. Journal of the American Chemical Society, 2016, 138, 12112-12123 |
| 4130564 | CIF | C29 H41 Cl Fe N2 O | P 1 21/n 1 | 8.2811; 16.2945; 20.4576 90; 96.811; 90 | 2741 | Bellows, Sarina M.; Arnet, Nicholas A.; Gurubasavaraj, Prabhuodeyara M.; Brennessel, William W.; Bill, Eckhard; Cundari, Thomas R.; Holland, Patrick L. The Mechanism of N-N Double Bond Cleavage by an Iron(II) Hydride Complex. Journal of the American Chemical Society, 2016, 138, 12112-12123 |
| 4130565 | CIF | C50 H68 Fe2 N4 | P 1 21/n 1 | 13.2514; 11.7781; 15.3265 90; 110.665; 90 | 2238.2 | Bellows, Sarina M.; Arnet, Nicholas A.; Gurubasavaraj, Prabhuodeyara M.; Brennessel, William W.; Bill, Eckhard; Cundari, Thomas R.; Holland, Patrick L. The Mechanism of N-N Double Bond Cleavage by an Iron(II) Hydride Complex. Journal of the American Chemical Society, 2016, 138, 12112-12123 |
| 4130566 | CIF | C50 H66 Fe2 N4 | P -1 | 8.3664; 10.6963; 23.4901 89.191; 88.782; 82.439 | 2083.2 | Bellows, Sarina M.; Arnet, Nicholas A.; Gurubasavaraj, Prabhuodeyara M.; Brennessel, William W.; Bill, Eckhard; Cundari, Thomas R.; Holland, Patrick L. The Mechanism of N-N Double Bond Cleavage by an Iron(II) Hydride Complex. Journal of the American Chemical Society, 2016, 138, 12112-12123 |
| 4130567 | CIF | C62 H76 Fe2 N6 | P 1 21/n 1 | 12.1883; 14.4703; 14.9963 90; 91.732; 90 | 2643.7 | Bellows, Sarina M.; Arnet, Nicholas A.; Gurubasavaraj, Prabhuodeyara M.; Brennessel, William W.; Bill, Eckhard; Cundari, Thomas R.; Holland, Patrick L. The Mechanism of N-N Double Bond Cleavage by an Iron(II) Hydride Complex. Journal of the American Chemical Society, 2016, 138, 12112-12123 |
| 4130568 | CIF | C79 H94 Fe2 N8 | P 1 21/c 1 | 17.139; 19.714; 20.122 90; 96.11; 90 | 6760.2 | Bellows, Sarina M.; Arnet, Nicholas A.; Gurubasavaraj, Prabhuodeyara M.; Brennessel, William W.; Bill, Eckhard; Cundari, Thomas R.; Holland, Patrick L. The Mechanism of N-N Double Bond Cleavage by an Iron(II) Hydride Complex. Journal of the American Chemical Society, 2016, 138, 12112-12123 |
| 4130569 | CIF | C23 H22 N2 O6 S | P 1 | 6.2719; 9.7785; 10.0673 115.426; 93.829; 100.896 | 539.9 | Xiao, Kai-Jiong; Chu, Ling; Chen, Gang; Yu, Jin-Quan Kinetic Resolution of Benzylamines via Palladium(II)-Catalyzed C-H Cross-Coupling. Journal of the American Chemical Society, 2016, 138, 7796-7800 |
| 4130570 | CIF | C54 H64 Cl F14 N7 O2 S2 | P 1 21 1 | 10.1941; 26.676; 12.0718 90; 113.107; 90 | 3019.4 | Ford, David D.; Lehnherr, Dan; Kennedy, C. Rose; Jacobsen, Eric N. On- and Off-Cycle Catalyst Cooperativity in Anion-Binding Catalysis. Journal of the American Chemical Society, 2016, 138, 7860-7863 |
| 4130571 | CIF | C56 H66 F14 N6 O2 S2 | P 1 | 11.5955; 11.8094; 13.3744 112.922; 92.39; 117.085 | 1447.26 | Ford, David D.; Lehnherr, Dan; Kennedy, C. Rose; Jacobsen, Eric N. On- and Off-Cycle Catalyst Cooperativity in Anion-Binding Catalysis. Journal of the American Chemical Society, 2016, 138, 7860-7863 |
| 4130572 | CIF | C100 H104 F28 N12 O4 S4 | P -1 | 13.1841; 20.3186; 20.8594 104.092; 101.305; 100.497 | 5156.93 | Ford, David D.; Lehnherr, Dan; Kennedy, C. Rose; Jacobsen, Eric N. On- and Off-Cycle Catalyst Cooperativity in Anion-Binding Catalysis. Journal of the American Chemical Society, 2016, 138, 7860-7863 |
| 4130573 | CIF | C75 H78 F21 N9 O3 S3 | C 1 2 1 | 22.6193; 12.2384; 29.5286 90; 92.679; 90 | 8165.3 | Ford, David D.; Lehnherr, Dan; Kennedy, C. Rose; Jacobsen, Eric N. On- and Off-Cycle Catalyst Cooperativity in Anion-Binding Catalysis. Journal of the American Chemical Society, 2016, 138, 7860-7863 |
| 4130574 | CIF | C54 H64 Cl F14 N7 O4 | C 1 2 1 | 21.9073; 10.2539; 15.4936 90; 119.671; 90 | 3024.1 | Ford, David D.; Lehnherr, Dan; Kennedy, C. Rose; Jacobsen, Eric N. On- and Off-Cycle Catalyst Cooperativity in Anion-Binding Catalysis. Journal of the American Chemical Society, 2016, 138, 7860-7863 |
| 4130575 | CIF | C16 H23 Br O3 | P 21 21 21 | 7.9663; 12.2238; 16.0261 90; 90; 90 | 1560.6 | Martinez, Luisruben P.; Umemiya, Shigenobu; Wengryniuk, Sarah E.; Baran, Phil S. 11-Step Total Synthesis of Pallambins C and D. Journal of the American Chemical Society, 2016, 138, 7536-7539 |
| 4130576 | CIF | C15 H20 O3 | P 1 21/n 1 | 7.8751; 13.4021; 13.2598 90; 106.144; 90 | 1344.29 | Martinez, Luisruben P.; Umemiya, Shigenobu; Wengryniuk, Sarah E.; Baran, Phil S. 11-Step Total Synthesis of Pallambins C and D. Journal of the American Chemical Society, 2016, 138, 7536-7539 |
| 4130577 | CIF | C15 H20 O3 | P 1 21/c 1 | 14.421; 7.5148; 12.931 90; 103.204; 90 | 1364.3 | Martinez, Luisruben P.; Umemiya, Shigenobu; Wengryniuk, Sarah E.; Baran, Phil S. 11-Step Total Synthesis of Pallambins C and D. Journal of the American Chemical Society, 2016, 138, 7536-7539 |
| 4130578 | CIF | C440 H572 Au92 S44 | C 1 2/c 1 | 45.3; 28.6539; 88.045 90; 90.94; 90 | 114269 | Zeng, Chenjie; Liu, Chong; Chen, Yuxiang; Rosi, Nathaniel L.; Jin, Rongchao Atomic Structure of Self-Assembled Monolayer of Thiolates on a Tetragonal Au92 Nanocrystal. Journal of the American Chemical Society, 2016, 138, 8710-8713 |
| 4130579 | CIF | C24 H22 N2 Si | P -1 | 9.0894; 11.2642; 20.8038 95.61; 92.724; 107.775 | 2011.86 | Chen, Qing-An; Klare, Hendrik F. T.; Oestreich, Martin Brønsted Acid-Promoted Formation of Stabilized Silylium Ions for Catalytic Friedel-Crafts C-H Silylation. Journal of the American Chemical Society, 2016, 138, 7868-7871 |
| 4130580 | CIF | C73 H22 O | P 1 21/n 1 | 9.9746; 23.085; 16.7399 90; 90.299; 90 | 3854.5 | Wu, Xin-Zhou; Yao, Yang-Rong; Chen, Miao-Miao; Tian, Han-Rui; Xiao, Jun; Xu, Yun-Yan; Lin, Min-Song; Abella, Laura; Tian, Cheng-Bo; Gao, Cong-Li; Zhang, Qianyan; Xie, Su-Yuan; Huang, Rong-Bin; Zheng, Lan-Sun Formation of Curvature Subunit of Carbon in Combustion. Journal of the American Chemical Society, 2016, 138, 9629-9633 |
| 4130581 | CIF | C2 H6 I2 O2 Pb S | P n a m | 17.796; 11.1352; 4.5144 90; 90; 90 | 894.6 | Cao, Jing; Jing, Xiaojing; Yan, Juanzhu; Hu, Chengyi; Chen, Ruihao; Yin, Jun; Li, Jing; Zheng, Nanfeng Identifying the Molecular Structures of Intermediates for Optimizing the Fabrication of High-Quality Perovskite Films. Journal of the American Chemical Society, 2016, 138, 9919-9926 |
| 4130582 | CIF | C5 H25 I5 N3 O Pb S | C 1 2/c 1 | 20.641; 12.4157; 19.0841 90; 113.122; 90 | 4497.9 | Cao, Jing; Jing, Xiaojing; Yan, Juanzhu; Hu, Chengyi; Chen, Ruihao; Yin, Jun; Li, Jing; Zheng, Nanfeng Identifying the Molecular Structures of Intermediates for Optimizing the Fabrication of High-Quality Perovskite Films. Journal of the American Chemical Society, 2016, 138, 9919-9926 |
| 4130583 | CIF | C6 H26 I8 N2 O2 Pb3 S2 | P b c 21 | 4.6212; 27.219; 26.841 90; 90; 90 | 3376.2 | Cao, Jing; Jing, Xiaojing; Yan, Juanzhu; Hu, Chengyi; Chen, Ruihao; Yin, Jun; Li, Jing; Zheng, Nanfeng Identifying the Molecular Structures of Intermediates for Optimizing the Fabrication of High-Quality Perovskite Films. Journal of the American Chemical Society, 2016, 138, 9919-9926 |
| 4130584 | CIF | C3 H7 I2 N O Pb | P 1 21/n 1 | 4.53212; 18.2385; 11.5566 90; 92.661; 90 | 954.23 | Cao, Jing; Jing, Xiaojing; Yan, Juanzhu; Hu, Chengyi; Chen, Ruihao; Yin, Jun; Li, Jing; Zheng, Nanfeng Identifying the Molecular Structures of Intermediates for Optimizing the Fabrication of High-Quality Perovskite Films. Journal of the American Chemical Society, 2016, 138, 9919-9926 |
| 4130585 | CIF | C4 H12 I2 O2 Pb S2 | P c c n | 13.6978; 10.8575; 8.7607 90; 90; 90 | 1302.93 | Cao, Jing; Jing, Xiaojing; Yan, Juanzhu; Hu, Chengyi; Chen, Ruihao; Yin, Jun; Li, Jing; Zheng, Nanfeng Identifying the Molecular Structures of Intermediates for Optimizing the Fabrication of High-Quality Perovskite Films. Journal of the American Chemical Society, 2016, 138, 9919-9926 |
| 4130586 | CIF | C21 H17 N O3 | P 21 21 21 | 8.572; 11.0335; 17.8845 90; 90; 90 | 1691.5 | Ni, Chunjie; Tong, Xiaofeng Amine-Catalyzed Asymmetric (3 + 3) Annulations of β'-Acetoxy Allenoates: Enantioselective Synthesis of 4H-Pyrans. Journal of the American Chemical Society, 2016, 138, 7872-7875 |
| 4130587 | CIF | C22 H19 Br N2 O3 | C 1 2 1 | 14.7436; 20.14; 27.3915 90; 104.347; 90 | 7879.9 | Ni, Chunjie; Tong, Xiaofeng Amine-Catalyzed Asymmetric (3 + 3) Annulations of β'-Acetoxy Allenoates: Enantioselective Synthesis of 4H-Pyrans. Journal of the American Chemical Society, 2016, 138, 7872-7875 |
| 4130588 | CIF | C220 H230 N10 | P -1 | 13.8029; 24.1019; 24.1387 114.836; 97.8836; 103.484 | 6830.69 | Okujima, Tetsuo; Ando, Chie; Agrawal, Saurabh; Matsumoto, Hiroki; Mori, Shigeki; Ohara, Keishi; Hisaki, Ichiro; Nakae, Takahiro; Takase, Masayoshi; Uno, Hidemitsu; Kobayashi, Nagao Template Synthesis of Decaphyrin without Meso-Bridges: Cyclo[10]pyrrole. Journal of the American Chemical Society, 2016, 138, 7540-7543 |
| 4130589 | CIF | C225 H230 N10 O5 | P -1 | 13.6161; 23.9402; 24.0353 113.847; 105.411; 96.269 | 6696.56 | Okujima, Tetsuo; Ando, Chie; Agrawal, Saurabh; Matsumoto, Hiroki; Mori, Shigeki; Ohara, Keishi; Hisaki, Ichiro; Nakae, Takahiro; Takase, Masayoshi; Uno, Hidemitsu; Kobayashi, Nagao Template Synthesis of Decaphyrin without Meso-Bridges: Cyclo[10]pyrrole. Journal of the American Chemical Society, 2016, 138, 7540-7543 |
| 4130590 | CIF | C150 H177 F36 N19 O20 P6 | P 1 21/n 1 | 19.1189; 19.7795; 45.0588 90; 93.421; 90 | 17009.2 | Fernando, Isurika R.; Frasconi, Marco; Wu, Yilei; Liu, Wei-Guang; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Sliding-Ring Catenanes. Journal of the American Chemical Society, 2016, 138, 10214-10225 |
| 4130591 | CIF | C298 H338 N16 O41 | P -1 | 20.1201; 26.1627; 26.488 87.674; 69.262; 78.983 | 12793.9 | Fernando, Isurika R.; Frasconi, Marco; Wu, Yilei; Liu, Wei-Guang; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Sliding-Ring Catenanes. Journal of the American Chemical Society, 2016, 138, 10214-10225 |
| 4130592 | CIF | C76 H82 F18 N6 O10 P3 | C 1 2/c 1 | 21.9335; 13.4484; 27.6224 90; 113.137; 90 | 7492.5 | Fernando, Isurika R.; Frasconi, Marco; Wu, Yilei; Liu, Wei-Guang; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Sliding-Ring Catenanes. Journal of the American Chemical Society, 2016, 138, 10214-10225 |
| 4130593 | CIF | C76 H82 N6 O10 | P 1 21/c 1 | 13.9493; 48.567; 10.9451 90; 112.934; 90 | 6828.9 | Fernando, Isurika R.; Frasconi, Marco; Wu, Yilei; Liu, Wei-Guang; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser Sliding-Ring Catenanes. Journal of the American Chemical Society, 2016, 138, 10214-10225 |
| 4130594 | CIF | C6 Br4 Cl2 Ga N2 S4 | P 3 | 13.6489; 13.6489; 7.9023 90; 90; 120 | 1274.91 | Postulka, Lars; Winter, Stephen M.; Mihailov, Adam G.; Mailman, Aaron; Assoud, Abdeljalil; Robertson, Craig M.; Wolf, Bernd; Lang, Michael; Oakley, Richard T. Spin Frustration in an Organic Radical Ion Salt Based on a Kagome-Coupled Chain Structure. Journal of the American Chemical Society, 2016, 138, 10738-10741 |
| 4130595 | CIF | C30 H33 N5 O2 | P -1 | 7.2513; 9.3654; 20.598 95.768; 98.328; 104.441 | 1326.7 | Gallagher, Nolan M.; Bauer, Jackson J.; Pink, Maren; Rajca, Suchada; Rajca, Andrzej High-Spin Organic Diradical with Robust Stability. Journal of the American Chemical Society, 2016, 138, 9377-9380 |
| 4130596 | CIF | C7 H5 Br O2 | C 1 2/c 1 | 14.855; 4.084; 22.985 90; 96.594; 90 | 1385.2 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130597 | CIF | C7 H4 Cl2 O2 | P 1 21/c 1 | 3.7527; 6.2589; 30.957 90; 90.871; 90 | 727 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130598 | CIF | C7 H4 Cl2 O2 | C 1 2/c 1 | 14.781; 3.8619; 27.042 90; 101.453; 90 | 1512.9 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130599 | CIF | C7 H5 Cl O2 | C 1 2/c 1 | 14.706; 3.8955; 23.968 90; 101.413; 90 | 1345.9 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130600 | CIF | C7 H5 Cl2 N O | P 1 21/c 1 | 5.3117; 4.9506; 28.881 90; 92.615; 90 | 758.7 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130601 | CIF | C36 H28 N2 O4 | P -1 | 7.143; 9.196; 21.941 90.307; 99.162; 91.812 | 1422.1 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130602 | CIF | C16 H10 N2 O4 | P 1 21/c 1 | 4.6215; 8.019; 17.024 90; 93.99; 90 | 629.4 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130603 | CIF | C16 H17 N O2 | P 1 21/n 1 | 13.605; 7.147; 28.422 90; 94.298; 90 | 2755.8 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130604 | CIF | C20 H18 N2 O4 | P b c a | 6.9622; 17.2426; 27.5809 90; 90; 90 | 3311 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130605 | CIF | C28 H18 N2 O4 | P 1 21/c 1 | 8.04; 4.3235; 29.008 90; 92.363; 90 | 1007.5 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130606 | CIF | C11 H15 N O | P 1 21/c 1 | 12.9943; 9.4749; 8.0539 90; 93.777; 90 | 989.4 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130607 | CIF | C18 H21 N O2 | P n 21 a | 19.4469; 9.7388; 16.3359 90; 90; 90 | 3093.85 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130608 | CIF | C15 H15 N O3 | P -1 | 4.8497; 12.3971; 22.147 77.914; 87.481; 85.096 | 1296.8 | Krishna, Gamidi Rama; Devarapalli, Ramesh; Lal, Garima; Reddy, C. Malla Mechanically Flexible Organic Crystals Achieved by Introducing Weak Interactions in Structure: Supramolecular Shape Synthons. Journal of the American Chemical Society, 2016, 138, 13561-13567 |
| 4130609 | CIF | C24 H44 N O2 P2 Rh | P 1 21/n 1 | 10.3758; 13.2372; 19.6596 90; 101.896; 90 | 2642.19 | Anaby, Aviel; Feller, Moran; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Bottom-Up Construction of a CO2-Based Cycle for the Photocarbonylation of Benzene, Promoted by a Rhodium(I) Pincer Complex. Journal of the American Chemical Society, 2016, 138, 9941-9950 |
| 4130610 | CIF | C24 H42 N O P2 Rh | P c a 21 | 11.417; 29.009; 15.317 90; 90; 90 | 5072.9 | Anaby, Aviel; Feller, Moran; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Bottom-Up Construction of a CO2-Based Cycle for the Photocarbonylation of Benzene, Promoted by a Rhodium(I) Pincer Complex. Journal of the American Chemical Society, 2016, 138, 9941-9950 |
| 4130611 | CIF | C30 H48 N O P2 Rh | P -1 | 10.532; 17.22; 17.597 93.68; 106.38; 91.7 | 3051.8 | Anaby, Aviel; Feller, Moran; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Bottom-Up Construction of a CO2-Based Cycle for the Photocarbonylation of Benzene, Promoted by a Rhodium(I) Pincer Complex. Journal of the American Chemical Society, 2016, 138, 9941-9950 |
| 4130612 | CIF | C30 H50 N O3 P2 Rh S | P 1 21/c 1 | 16.7779; 16.331; 27.0224 90; 117.771; 90 | 6551.3 | Anaby, Aviel; Feller, Moran; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Bottom-Up Construction of a CO2-Based Cycle for the Photocarbonylation of Benzene, Promoted by a Rhodium(I) Pincer Complex. Journal of the American Chemical Society, 2016, 138, 9941-9950 |
| 4130613 | CIF | C60 H56 B F24 Ir N O3 P | P -1 | 14.0248; 19.7867; 24.657 110.651; 95.629; 97.244 | 6276.3 | Drover, Marcus W.; Love, Jennifer A.; Schafer, Laurel L. Toward anti-Markovnikov 1-Alkyne O-Phosphoramidation: Exploiting Metal-Ligand Cooperativity in a 1,3-N,O-Chelated Cp*Ir(III) Complex. Journal of the American Chemical Society, 2016, 138, 8396-8399 |
| 4130614 | CIF | C55 H48 B Cl2 F24 N O3 P Rh | P n a 21 | 23.0081; 20.1658; 12.8557 90; 90; 90 | 5964.7 | Drover, Marcus W.; Love, Jennifer A.; Schafer, Laurel L. Toward anti-Markovnikov 1-Alkyne O-Phosphoramidation: Exploiting Metal-Ligand Cooperativity in a 1,3-N,O-Chelated Cp*Ir(III) Complex. Journal of the American Chemical Society, 2016, 138, 8396-8399 |
| 4130615 | CIF | C66 H60 B F24 Ir N O3 P | P 1 21/n 1 | 17.1931; 20.3353; 19.7277 90; 99.808; 90 | 6796.5 | Drover, Marcus W.; Love, Jennifer A.; Schafer, Laurel L. Toward anti-Markovnikov 1-Alkyne O-Phosphoramidation: Exploiting Metal-Ligand Cooperativity in a 1,3-N,O-Chelated Cp*Ir(III) Complex. Journal of the American Chemical Society, 2016, 138, 8396-8399 |
| 4130616 | CIF | C18 H22 N O3 P | P 1 21/c 1 | 9.898; 19.451; 9.138 90; 99.47; 90 | 1735.3 | Drover, Marcus W.; Love, Jennifer A.; Schafer, Laurel L. Toward anti-Markovnikov 1-Alkyne O-Phosphoramidation: Exploiting Metal-Ligand Cooperativity in a 1,3-N,O-Chelated Cp*Ir(III) Complex. Journal of the American Chemical Society, 2016, 138, 8396-8399 |
| 4130617 | CIF | C17 H14 Br N O | P 1 21 1 | 7.8217; 6.0909; 14.503 90; 91.2816; 90 | 690.77 | Zhao, Chenfei; Chen, Shawn B.; Seidel, Daniel Direct Formation of Oxocarbenium Ions under Weakly Acidic Conditions: Catalytic Enantioselective Oxa-Pictet-Spengler Reactions. Journal of the American Chemical Society, 2016, 138, 9053-9056 |
| 4130618 | CIF | C89 H89 B F24 N4 O Ru Zn | P 1 n 1 | 12.5594; 17.4038; 20.1905 90; 102.08; 90 | 4315.5 | Riddlestone, Ian M.; Rajabi, Nasir A.; Lowe, John P.; Mahon, Mary F.; Macgregor, Stuart A.; Whittlesey, Michael K. Activation of H2 over the Ru-Zn Bond in the Transition Metal-Lewis Acid Heterobimetallic Species [Ru(IPr)2(CO)ZnEt](.). Journal of the American Chemical Society, 2016, 138, 11081-11084 |
| 4130619 | CIF | C89 H93 B F24 N4 O Ru Zn | P 1 21/n 1 | 17.00002; 25.77166; 20.59225 90; 100.064; 90 | 8883.02 | Riddlestone, Ian M.; Rajabi, Nasir A.; Lowe, John P.; Mahon, Mary F.; Macgregor, Stuart A.; Whittlesey, Michael K. Activation of H2 over the Ru-Zn Bond in the Transition Metal-Lewis Acid Heterobimetallic Species [Ru(IPr)2(CO)ZnEt](.). Journal of the American Chemical Society, 2016, 138, 11081-11084 |
| 4130620 | CIF | C89 H91 B F24 N4 O Ru Zn | P 1 21/n 1 | 16.96745; 25.70693; 20.56727 90; 98.9877; 90 | 8860.91 | Riddlestone, Ian M.; Rajabi, Nasir A.; Lowe, John P.; Mahon, Mary F.; Macgregor, Stuart A.; Whittlesey, Michael K. Activation of H2 over the Ru-Zn Bond in the Transition Metal-Lewis Acid Heterobimetallic Species [Ru(IPr)2(CO)ZnEt](.). Journal of the American Chemical Society, 2016, 138, 11081-11084 |
| 4130621 | CIF | C89 H92 B F24 N5 O Ru Zn | P 1 21/c 1 | 21.04374; 20.82587; 22.77178 90; 116.888; 90 | 8900.96 | Riddlestone, Ian M.; Rajabi, Nasir A.; Lowe, John P.; Mahon, Mary F.; Macgregor, Stuart A.; Whittlesey, Michael K. Activation of H2 over the Ru-Zn Bond in the Transition Metal-Lewis Acid Heterobimetallic Species [Ru(IPr)2(CO)ZnEt](.). Journal of the American Chemical Society, 2016, 138, 11081-11084 |
| 4130622 | CIF | C30 H18 N0 O13 Zn4 | P a -3 | 21.2832; 21.2832; 21.2832 90; 90; 90 | 9640.7 | Jiang, Juncong; Furukawa, Hiroyasu; Zhang, Yue-Biao; Yaghi, Omar M. High Methane Storage Working Capacity in Metal-Organic Frameworks with Acrylate Links. Journal of the American Chemical Society, 2016, 138, 10244-10251 |
| 4130623 | CIF | C16 H16 Cl3 N | P 1 21 1 | 9.5249; 5.8864; 14.3094 90; 100.719; 90 | 788.29 | Liu, Jie; Cao, Chao-Guo; Sun, Hong-Bao; Zhang, Xia; Niu, Dawen Catalytic Asymmetric Umpolung Allylation of Imines. Journal of the American Chemical Society, 2016, 138, 13103-13106 |
| 4130624 | CIF | C8.84 H8 F5 N4 Nb Ni O2.68 | I 4/m c m | 9.903; 9.903; 15.72 90; 90; 90 | 1541.7 | Bhatt, Prashant M.; Belmabkhout, Youssef; Cadiau, Amandine; Adil, Karim; Shekhah, Osama; Shkurenko, Aleksander; Barbour, Leonard J.; Eddaoudi, Mohamed A Fine-Tuned Fluorinated MOF Addresses the Needs for Trace CO2 Removal and Air Capture Using Physisorption. Journal of the American Chemical Society, 2016, 138, 9301-9307 |
| 4130625 | CIF | C8 H12 F5 N4 Nb Ni O3 | I 4/m c m | 9.943; 9.943; 15.764 90; 90; 90 | 1558.5 | Bhatt, Prashant M.; Belmabkhout, Youssef; Cadiau, Amandine; Adil, Karim; Shekhah, Osama; Shkurenko, Aleksander; Barbour, Leonard J.; Eddaoudi, Mohamed A Fine-Tuned Fluorinated MOF Addresses the Needs for Trace CO2 Removal and Air Capture Using Physisorption. Journal of the American Chemical Society, 2016, 138, 9301-9307 |
| 4130626 | CIF | C91 H98 Cu F3 O5 P6 S | P 1 21/c 1 | 13.7385; 19.5301; 29.6719 90; 96.687; 90 | 7907.2 | Zall, Christopher M.; Linehan, John C.; Appel, Aaron M. Triphosphine-Ligated Copper Hydrides for CO2 Hydrogenation: Structure, Reactivity, and Thermodynamic Studies. Journal of the American Chemical Society, 2016, 138, 9968-9977 |
| 4130627 | CIF | C82 H79 Cu2 P6 | P 3 1 2 | 21.6406; 21.6406; 16.2448 90; 90; 120 | 6588.5 | Zall, Christopher M.; Linehan, John C.; Appel, Aaron M. Triphosphine-Ligated Copper Hydrides for CO2 Hydrogenation: Structure, Reactivity, and Thermodynamic Studies. Journal of the American Chemical Society, 2016, 138, 9968-9977 |
| 4130628 | CIF | C86 H86 Cu2 N2 P6 | P 1 21/n 1 | 14.0768; 19.6513; 15.0068 90; 115.83; 90 | 3736.5 | Zall, Christopher M.; Linehan, John C.; Appel, Aaron M. Triphosphine-Ligated Copper Hydrides for CO2 Hydrogenation: Structure, Reactivity, and Thermodynamic Studies. Journal of the American Chemical Society, 2016, 138, 9968-9977 |
| 4130629 | CIF | C92 H76 B6 Co2 F24 N19 O0.5 | P -1 | 15.00712; 16.8669; 20.439 73.1727; 68.6423; 80.3164 | 4600.53 | Burke, Michael J.; Nichol, Gary S.; Lusby, Paul J. Orthogonal Selection and Fixing of Coordination Self-Assembly Pathways for Robust Metallo-organic Ensemble Construction. Journal of the American Chemical Society, 2016, 138, 9308-9315 |
| 4130630 | CIF | C96 H84 B6 Co2 F24 N18 | R -3 c :H | 17.3577; 17.3577; 104.263 90; 90; 120 | 27204.8 | Burke, Michael J.; Nichol, Gary S.; Lusby, Paul J. Orthogonal Selection and Fixing of Coordination Self-Assembly Pathways for Robust Metallo-organic Ensemble Construction. Journal of the American Chemical Society, 2016, 138, 9308-9315 |
| 4130631 | CIF | C168 H132 Co4 F72 N24 P12 | R -3 c :H | 20.5996; 20.5996; 195.2193 90; 90; 120 | 71741.6 | Burke, Michael J.; Nichol, Gary S.; Lusby, Paul J. Orthogonal Selection and Fixing of Coordination Self-Assembly Pathways for Robust Metallo-organic Ensemble Construction. Journal of the American Chemical Society, 2016, 138, 9308-9315 |
| 4130632 | CIF | C250 H231 Co4 F72 N65 P12 | P 1 21/c 1 | 18.6723; 38.7772; 38.7947 90; 92.084; 90 | 28071.1 | Burke, Michael J.; Nichol, Gary S.; Lusby, Paul J. Orthogonal Selection and Fixing of Coordination Self-Assembly Pathways for Robust Metallo-organic Ensemble Construction. Journal of the American Chemical Society, 2016, 138, 9308-9315 |
| 4130633 | CIF | C39 H48 Mn12 O50 | P -1 | 13.79; 14.11; 18.58 92.46; 97.97; 86.84 | 3572.6 | Espín, Jordi; Zarzuela, Ricardo; Statuto, Nahuel; Juanhuix, Jordi; Maspoch, Daniel; Imaz, Inhar; Chudnovsky, Eugene; Tejada, Javier Narrowing the Zero-Field Tunneling Resonance by Decreasing the Crystal Symmetry of Mn12 Acetate. Journal of the American Chemical Society, 2016, 138, 9065-9068 |
| 4130634 | CIF | C29 H41 N O2 P2 Ru | I -4 | 26.389; 26.389; 8.1302 90; 90; 90 | 5661.7 | Xie, Yinjun; Ben-David, Yehoshoa; Shimon, Linda J. W.; Milstein, David Highly Efficient Process for Production of Biofuel from Ethanol Catalyzed by Ruthenium Pincer Complexes. Journal of the American Chemical Society, 2016, 138, 9077-9080 |
| 4130635 | CIF | C19 H27 B2 N O4 | P n a 21 | 9.9178; 23.191; 8.899 90; 90; 90 | 2046.8 | Mfuh, Adelphe M.; Nguyen, Vu T.; Chhetri, Bhuwan; Burch, Jessica E.; Doyle, John D.; Nesterov, Vladimir N.; Arman, Hadi D.; Larionov, Oleg V. Additive- and Metal-Free, Predictably 1,2- and 1,3-Regioselective, Photoinduced Dual C-H/C-X Borylation of Haloarenes. Journal of the American Chemical Society, 2016, 138, 8408-8411 |
| 4130636 | CIF | C19 H27 B2 F3 O4 | P 1 21/c 1 | 10.9964; 14.6674; 12.8154 90; 92.279; 90 | 2065.34 | Mfuh, Adelphe M.; Nguyen, Vu T.; Chhetri, Bhuwan; Burch, Jessica E.; Doyle, John D.; Nesterov, Vladimir N.; Arman, Hadi D.; Larionov, Oleg V. Additive- and Metal-Free, Predictably 1,2- and 1,3-Regioselective, Photoinduced Dual C-H/C-X Borylation of Haloarenes. Journal of the American Chemical Society, 2016, 138, 8408-8411 |
| 4130637 | CIF | C19 H27 B2 F3 O5 | P -1 | 13.1779; 13.6565; 14.0817 104.079; 98.934; 114.197 | 2146.96 | Mfuh, Adelphe M.; Nguyen, Vu T.; Chhetri, Bhuwan; Burch, Jessica E.; Doyle, John D.; Nesterov, Vladimir N.; Arman, Hadi D.; Larionov, Oleg V. Additive- and Metal-Free, Predictably 1,2- and 1,3-Regioselective, Photoinduced Dual C-H/C-X Borylation of Haloarenes. Journal of the American Chemical Society, 2016, 138, 8408-8411 |
| 4130638 | CIF | C8 H24 I2 P2 Pt | P 21 21 21 | 12.4162; 14.0091; 19.4439 90; 90; 90 | 3382.1 | Levin, Mark D.; Kaphan, David M.; Hong, Cynthia M.; Bergman, Robert G.; Raymond, Kenneth N.; Toste, F. Dean Scope and Mechanism of Cooperativity at the Intersection of Organometallic and Supramolecular Catalysis. Journal of the American Chemical Society, 2016, 138, 9682-9693 |
| 4130639 | CIF | C152 H140 Au Ga4 K8 N12 O52 P2 | P 1 21/c 1 | 19.9478; 60.836; 19.5518 90; 118.988; 90 | 20754.5 | Levin, Mark D.; Kaphan, David M.; Hong, Cynthia M.; Bergman, Robert G.; Raymond, Kenneth N.; Toste, F. Dean Scope and Mechanism of Cooperativity at the Intersection of Organometallic and Supramolecular Catalysis. Journal of the American Chemical Society, 2016, 138, 9682-9693 |
| 4130640 | CIF | C93 H128 Cl2 Cu4 K N8 O7 S | P 1 21 1 | 15.17028; 22.32611; 29.9089 90; 102.991; 90 | 9870.67 | Johnson, Brittany J.; Antholine, William E.; Lindeman, Sergey V.; Graham, Michael J.; Mankad, Neal P. A One-Hole Cu<sub>4</sub>S Cluster with N<sub>2</sub>O Reductase Activity: A Structural and Functional Model for Cu<sub>Z</sub>. Journal of the American Chemical Society, 2016, 138, 13107-13110 |
| 4130641 | CIF | C38 H46 Cu N4 S2 | I 41/a :2 | 22.9942; 22.9942; 15.5128 90; 90; 90 | 8202.1 | Johnson, Brittany J.; Antholine, William E.; Lindeman, Sergey V.; Graham, Michael J.; Mankad, Neal P. A One-Hole Cu<sub>4</sub>S Cluster with N<sub>2</sub>O Reductase Activity: A Structural and Functional Model for Cu<sub>Z</sub>. Journal of the American Chemical Society, 2016, 138, 13107-13110 |
| 4130642 | CIF | C24 H20 O4 | P m c 21 | 13.5285; 8.4191; 15.857 90; 90; 90 | 1806.1 | Leung, Franco King-Chi; Ishiwari, Fumitaka; Kajitani, Takashi; Shoji, Yoshiaki; Hikima, Takaaki; Takata, Masaki; Saeki, Akinori; Seki, Shu; Yamada, Yoichi M. A.; Fukushima, Takanori Supramolecular Scaffold for Tailoring the Two-Dimensional Assembly of Functional Molecular Units into Organic Thin Films. Journal of the American Chemical Society, 2016, 138, 11727-11733 |
| 4130643 | CIF | C57 H40 P2 S15 V | P 1 21/c 1 | 24.5669; 13.815; 18.1309 90; 111.014; 90 | 5744.23 | Atzori, Matteo; Morra, Elena; Tesi, Lorenzo; Albino, Andrea; Chiesa, Mario; Sorace, Lorenzo; Sessoli, Roberta Quantum Coherence Times Enhancement in Vanadium(IV)-based Potential Molecular Qubits: the Key Role of the Vanadyl Moiety. Journal of the American Chemical Society, 2016, 138, 11234-11244 |
| 4130644 | CIF | C54 H40 O P2 S10 V | C 1 2/c 1 | 20.4747; 12.7283; 20.6032 90; 95.297; 90 | 5346.4 | Atzori, Matteo; Morra, Elena; Tesi, Lorenzo; Albino, Andrea; Chiesa, Mario; Sorace, Lorenzo; Sessoli, Roberta Quantum Coherence Times Enhancement in Vanadium(IV)-based Potential Molecular Qubits: the Key Role of the Vanadyl Moiety. Journal of the American Chemical Society, 2016, 138, 11234-11244 |
| 4130645 | CIF | C54 H40 Mo O P2 S10 | C 1 2/c 1 | 19.9651; 12.5335; 20.8994 90; 94.26; 90 | 5215.26 | Atzori, Matteo; Morra, Elena; Tesi, Lorenzo; Albino, Andrea; Chiesa, Mario; Sorace, Lorenzo; Sessoli, Roberta Quantum Coherence Times Enhancement in Vanadium(IV)-based Potential Molecular Qubits: the Key Role of the Vanadyl Moiety. Journal of the American Chemical Society, 2016, 138, 11234-11244 |
| 4130646 | CIF | C33 H20 P S15 V | P -1 | 12.7155; 13.1946; 14.1206 115.945; 97.484; 106.847 | 1945.83 | Atzori, Matteo; Morra, Elena; Tesi, Lorenzo; Albino, Andrea; Chiesa, Mario; Sorace, Lorenzo; Sessoli, Roberta Quantum Coherence Times Enhancement in Vanadium(IV)-based Potential Molecular Qubits: the Key Role of the Vanadyl Moiety. Journal of the American Chemical Society, 2016, 138, 11234-11244 |
| 4130647 | CIF | C64 H58 N6 O6 | P 1 21/c 1 | 12.6258; 23.1782; 20.3231 90; 99.749; 90 | 5861.5 | Martinez-Cuezva, Alberto; Lopez-Leonardo, Carmen; Bautista, Delia; Alajarin, Mateo; Berna, Jose Stereocontrolled Synthesis of β-Lactams within [2]Rotaxanes: Showcasing the Chemical Consequences of the Mechanical Bond. Journal of the American Chemical Society, 2016, 138, 8726-8729 |
| 4130648 | CIF | C100 H52 In2 Mn N4 O17 | P n n m | 23.4939; 23.4954; 31.9724 90; 90; 90 | 17648.7 | Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 10293-10298 |
| 4130649 | CIF | C100 H52 Fe In2 N4 O17 | P n n m | 23.4897; 23.4895; 31.9645 90; 90; 90 | 17636.8 | Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 10293-10298 |
| 4130650 | CIF | C23 H19 Cl F3 N O2 S | P 1 21/c 1 | 15.6602; 18.7951; 7.4123 90; 99.029; 90 | 2154.7 | Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 10293-10298 |
| 4130651 | CIF | C100 H52 Cl In2 Mn N4 O16 | P n n m | 23.767; 23.767; 29.459 90; 90; 90 | 16641 | Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 10293-10298 |
| 4130652 | CIF | C23 H22 Cl N O2 S | P 1 21/c 1 | 14.1702; 15.5119; 9.5178 90; 105.328; 90 | 2017.66 | Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 10293-10298 |
| 4130653 | CIF | C100 H52 Cl Fe In2 N4 O16 | P n n m | 23.412; 23.428; 32.108 90; 90; 90 | 17611 | Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 10293-10298 |
| 4130654 | CIF | C16 H12 N2 O2 S2 | P 1 21/c 1 | 11.2356; 12.9918; 11.3681 90; 154.939; 90 | 702.9 | Mauck, Catherine M.; Hartnett, Patrick E.; Margulies, Eric A.; Ma, Lin; Miller, Claire E.; Schatz, George C.; Marks, Tobin J.; Wasielewski, Michael R. Singlet Fission via an Excimer-Like Intermediate in 3,6-Bis(thiophen-2-yl)diketopyrrolopyrrole Derivatives. Journal of the American Chemical Society, 2016, 138, 11749-11761 |
| 4130655 | CIF | C93 H123 N3 O15 | P -1 | 16.653; 22.759; 24.195 76.33; 78.45; 82.76 | 8700 | Li, Xuesong; Markandeya, Nagula; Jonusauskas, Gediminas; McClenaghan, Nathan D.; Maurizot, Victor; Denisov, Sergey A.; Huc, Ivan Photoinduced Electron Transfer and Hole Migration in Nanosized Helical Aromatic Oligoamide Foldamers. Journal of the American Chemical Society, 2016, 138, 13568-13578 |
| 4130656 | CIF | C188 H97.5 In9 N1.5 O46.5 | P -6 2 c | 31.718; 31.718; 17.1352 90; 90; 120 | 14929 | Reinares-Fisac, Daniel; Aguirre-Díaz, Lina María; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Gándara, Felipe A Mesoporous Indium Metal-Organic Framework: Remarkable Advances in Catalytic Activity for Strecker Reaction of Ketones. Journal of the American Chemical Society, 2016, 138, 9089-9092 |
| 4130657 | CIF | C168 H90 In9 O48 | P -6 2 c | 31.8903; 31.8903; 17.1915 90; 90; 120 | 15141.2 | Reinares-Fisac, Daniel; Aguirre-Díaz, Lina María; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Gándara, Felipe A Mesoporous Indium Metal-Organic Framework: Remarkable Advances in Catalytic Activity for Strecker Reaction of Ketones. Journal of the American Chemical Society, 2016, 138, 9089-9092 |
| 4130658 | CIF | C30 H18 In N O10.5 | P b c n | 17.5574; 20.8944; 16.8168 90; 90; 90 | 6169.3 | Reinares-Fisac, Daniel; Aguirre-Díaz, Lina María; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Gándara, Felipe A Mesoporous Indium Metal-Organic Framework: Remarkable Advances in Catalytic Activity for Strecker Reaction of Ketones. Journal of the American Chemical Society, 2016, 138, 9089-9092 |
| 4130659 | CIF | C56 H82 O3 S8 Si8 | C 1 2/c 1 | 55.402; 18.757; 14.45 90; 102.502; 90 | 14660 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130660 | CIF | C28 H36 I4 S4 Si4 | P -1 | 10.775; 11.514; 18.195 87.775; 86.31; 67.205 | 2076.5 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130661 | CIF | C28 H40 S4 Si4 | P -1 | 10.918; 12.793; 14.3 91.596; 104.851; 113.229 | 1755.3 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130662 | CIF | C86 H114 Cl8 S12 Si12 | P -1 | 10.434; 15.47; 20.322 89.347; 83.228; 75.451 | 3152 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130663 | CIF | C28 H42 I2 O2 S4 Si4 | P -1 | 10.2081; 14.0993; 14.1207 84.199; 71.431; 80.423 | 1897.18 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130664 | CIF | C42 H58 S6 Si6 | P 1 21/c 1 | 12.2794; 19.0648; 23.574 90; 100.784; 90 | 5421.3 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130665 | CIF | C84 H112 S12 Si12 | P -1 | 15.795; 16.151; 23.422 79.086; 82.483; 66.948 | 5388 | Zhang, Sheng; Liu, Xinming; Li, Chunli; Li, Lu; Song, Jinsheng; Shi, Jianwu; Morton, Martha; Rajca, Suchada; Rajca, Andrzej; Wang, Hua Thiophene-Based Double Helices: Syntheses, X-ray Structures, and Chiroptical Properties. Journal of the American Chemical Society, 2016, 138, 10002-10010 |
| 4130666 | CIF | C16 H40 Ce Cl6 N2 | P 1 21/c 1 | 13.9954; 14.7458; 12.9012 90; 90.001; 90 | 2662.5 | Yin, Haolin; Jin, Yi; Hertzog, Jerald E.; Mullane, Kimberly C.; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. The Hexachlorocerate(III) Anion: A Potent, Benchtop Stable, and Readily Available Ultraviolet A Photosensitizer for Aryl Chlorides. Journal of the American Chemical Society, 2016, 138, 16266-16273 |
| 4130667 | CIF | C32 H72 Ce Cl6 N7 | I 1 2/a 1 | 18.102; 12.1714; 20.8315 90; 91.349; 90 | 4588.5 | Yin, Haolin; Jin, Yi; Hertzog, Jerald E.; Mullane, Kimberly C.; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. The Hexachlorocerate(III) Anion: A Potent, Benchtop Stable, and Readily Available Ultraviolet A Photosensitizer for Aryl Chlorides. Journal of the American Chemical Society, 2016, 138, 16266-16273 |
| 4130668 | CIF | C24 H60 Br6 Ce N3 | P 1 21/c 1 | 11.7573; 17.709; 12.2838 90; 110.678; 90 | 2392.8 | Yin, Haolin; Jin, Yi; Hertzog, Jerald E.; Mullane, Kimberly C.; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. The Hexachlorocerate(III) Anion: A Potent, Benchtop Stable, and Readily Available Ultraviolet A Photosensitizer for Aryl Chlorides. Journal of the American Chemical Society, 2016, 138, 16266-16273 |
| 4130669 | CIF | C56 H65 Br Li N11 O4 | P -1 | 13.8555; 13.8676; 14.7764 83.16; 86.479; 69.655 | 2642.5 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130670 | CIF | C54 H69 Cl Li N9 O7 | P -1 | 10.85; 13.688; 18.213 85.376; 88.134; 89.723 | 2695 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130671 | CIF | C56 H65 Li N12 O6 | P -1 | 13.835; 13.911; 14.7899 86.6932; 83.3607; 69.639 | 2650.23 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130672 | CIF | C53.5 H58.75 N10.25 O3 | P -1 | 13.9316; 18.999; 20.79 113.997; 97.902; 97.286 | 4876.9 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130673 | CIF | C54 H69 Cl Li N9 O7 | P -1 | 10.8528; 13.6605; 18.1919 85.4609; 88.1007; 89.6809 | 2687.09 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130674 | CIF | C51 H60 Li N9 O8 | P 1 21/c 1 | 14.7928; 12.3477; 27.0073 90; 98.997; 90 | 4872.4 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130675 | CIF | C50 H60 N8 O6 | P -1 | 9.7; 12.142; 20.293 93.671; 101.175; 102.189 | 2278.1 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130676 | CIF | C56 H65 I Li N11 O4 | P -1 | 13.8691; 13.9169; 14.7837 87.019; 83.805; 69.563 | 2657.9 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130677 | CIF | C52.5 H68 N8 O7.5 | P -1 | 11.3956; 20.1626; 23.5767 110.412; 99.661; 90.596 | 4991 | He, Qing; Zhang, Zhan; Brewster, James T.; Lynch, Vincent M.; Kim, Sung Kuk; Sessler, Jonathan L. Hemispherand-Strapped Calix[4]pyrrole: An Ion-pair Receptor for the Recognition and Extraction of Lithium Nitrite. Journal of the American Chemical Society, 2016, 138, 9779-9782 |
| 4130678 | CIF | C4.5 H1.5 Cl0.75 Mn0.75 N2.25 O2.4 | R -3 m :H | 38.659; 38.659; 8.5638 90; 90; 120 | 11084 | Rieth, Adam J.; Tulchinsky, Yuri; Dincă, Mircea High and Reversible Ammonia Uptake in Mesoporous Azolate Metal-Organic Frameworks with Open Mn, Co, and Ni Sites. Journal of the American Chemical Society, 2016, 138, 9401-9404 |
| 4130679 | CIF | C69 H66 B N P3 Ru Si | P 1 21/n 1 | 14.281; 13.986; 29.181 90; 94.55; 90 | 5810 | Lipke, Mark C.; Liberman-Martin, Allegra L; Tilley, T. Don Significant Cooperativity Between Ruthenium and Silicon in Catalytic Transformations of an Isocyanide. Journal of the American Chemical Society, 2016, 138, 9704-9713 |
| 4130680 | CIF | C31 H27 Cl2 F2 N O5 S | C 1 2 1 | 31.304; 7.83; 12.515 90; 110.626; 90 | 2871 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130681 | CIF | C29 H26 Cl2 N2 O7 S2 | P 21 21 21 | 7.0524; 15.8433; 25.4267 90; 90; 90 | 2841 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130682 | CIF | C20 H13 Cl N2 O6 | P 21 21 21 | 7.2097; 15.714; 15.938 90; 90; 90 | 1805.7 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130683 | CIF | C32 H27 Cl2 F4 N O5 S | C 1 2 1 | 24.814; 7.7307; 19.58 90; 126.078; 90 | 3035.7 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130684 | CIF | C20 H13 Cl2 N O4 | P 1 21 1 | 5.9025; 12.201; 12.309 90; 101.322; 90 | 869.2 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130685 | CIF | C34 H35 Cl2 N O5 S | P 21 21 21 | 10.5269; 11.2332; 26.231 90; 90; 90 | 3101.8 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130686 | CIF | C20 H13 Cl N2 O6 | P 1 21 1 | 13.373; 7.84; 18.371 90; 109.497; 90 | 1815.7 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130687 | CIF | C31 H26 Cl2 F3 N O5 S | P 1 21 1 | 7.5905; 33.801; 12.053 90; 107.278; 90 | 2952.9 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130688 | CIF | C31 H27 Cl2 F2 N O5 S | C 1 2 1 | 33.429; 7.7463; 12.033 90; 110.194; 90 | 2924.4 | Touge, Taichiro; Nara, Hideki; Fujiwhara, Mitsuhiko; Kayaki, Yoshihito; Ikariya, Takao Efficient Access to Chiral Benzhydrols via Asymmetric Transfer Hydrogenation of Unsymmetrical Benzophenones with Bifunctional Oxo-Tethered Ruthenium Catalysts. Journal of the American Chemical Society, 2016, 138, 10084-10087 |
| 4130689 | CIF | C19 H23 N O3 | P -1 | 9.7686; 10.9965; 17.577 74.913; 75.946; 75.948 | 1735.7 | Chelli, Saloua; Troshin, Konstantin; Mayer, Peter; Lakhdar, Sami; Ofial, Armin R.; Mayr, Herbert Nucleophilicity Parameters of Stabilized Iodonium Ylides for Characterizing Their Synthetic Potential. Journal of the American Chemical Society, 2016, 138, 10304-10313 |
| 4130690 | CIF | C35 H42 N2 O4 | P 1 21/n 1 | 10.4286; 17.5922; 17.2786 90; 103.094; 90 | 3087.5 | Chelli, Saloua; Troshin, Konstantin; Mayer, Peter; Lakhdar, Sami; Ofial, Armin R.; Mayr, Herbert Nucleophilicity Parameters of Stabilized Iodonium Ylides for Characterizing Their Synthetic Potential. Journal of the American Chemical Society, 2016, 138, 10304-10313 |
| 4130691 | CIF | C23 H25 Cl O4 | P 1 21/n 1 | 10.8984; 11.283; 16.594 90; 93.39; 90 | 2036.9 | Chelli, Saloua; Troshin, Konstantin; Mayer, Peter; Lakhdar, Sami; Ofial, Armin R.; Mayr, Herbert Nucleophilicity Parameters of Stabilized Iodonium Ylides for Characterizing Their Synthetic Potential. Journal of the American Chemical Society, 2016, 138, 10304-10313 |
| 4130692 | CIF | C30 H36 N2 O3 | P 21 21 21 | 8.2713; 17.2458; 18.0598 90; 90; 90 | 2576.14 | Liu, Zhao-Jing; Lu, Xi; Wang, Guan; Li, Lei; Jiang, Wei-Tao; Wang, Yu-Dong; Xiao, Bin; Fu, Yao Directing Group in Decarboxylative Cross-Coupling: Copper-Catalyzed Site-Selective C-N Bond Formation from Nonactivated Aliphatic Carboxylic Acids. Journal of the American Chemical Society, 2016, 138, 9714-9719 |
| 4130693 | CIF | C14 H17 Cl N2 O3 | P b c a | 7.5991; 18.8542; 20.2166 90; 90; 90 | 2896.5 | Liu, Zhao-Jing; Lu, Xi; Wang, Guan; Li, Lei; Jiang, Wei-Tao; Wang, Yu-Dong; Xiao, Bin; Fu, Yao Directing Group in Decarboxylative Cross-Coupling: Copper-Catalyzed Site-Selective C-N Bond Formation from Nonactivated Aliphatic Carboxylic Acids. Journal of the American Chemical Society, 2016, 138, 9714-9719 |
| 4130694 | CIF | C15 H20 N2 O | P 1 21/c 1 | 8.7063; 17.9769; 8.8307 90; 103.621; 90 | 1343.24 | Liu, Zhao-Jing; Lu, Xi; Wang, Guan; Li, Lei; Jiang, Wei-Tao; Wang, Yu-Dong; Xiao, Bin; Fu, Yao Directing Group in Decarboxylative Cross-Coupling: Copper-Catalyzed Site-Selective C-N Bond Formation from Nonactivated Aliphatic Carboxylic Acids. Journal of the American Chemical Society, 2016, 138, 9714-9719 |
| 4130695 | CIF | C65.71 H62.97 I6.03 N12 O4.1 Zn3 | C 1 2/c 1 | 35.0615; 14.9665; 30.3099 90; 101.487; 90 | 15586.5 | Yoshioka, Shota; Inokuma, Yasuhide; Duplan, Vincent; Dubey, Ritesh; Fujita, Makoto X-ray Structure Analysis of Ozonides by the Crystalline Sponge Method. Journal of the American Chemical Society, 2016, 138, 10140-10142 |
| 4130696 | CIF | C52.6 H59.36 I6.02 N12 O2.55 Zn3 | C 1 2/c 1 | 34.44; 14.9178; 29.894 90; 99.307; 90 | 15156.4 | Yoshioka, Shota; Inokuma, Yasuhide; Duplan, Vincent; Dubey, Ritesh; Fujita, Makoto X-ray Structure Analysis of Ozonides by the Crystalline Sponge Method. Journal of the American Chemical Society, 2016, 138, 10140-10142 |
| 4130697 | CIF | C60.08 H52.04 I6 N12 O4.47 Zn3 | C 1 2/c 1 | 34.8492; 14.8584; 31.0351 90; 101.858; 90 | 15727.1 | Yoshioka, Shota; Inokuma, Yasuhide; Duplan, Vincent; Dubey, Ritesh; Fujita, Makoto X-ray Structure Analysis of Ozonides by the Crystalline Sponge Method. Journal of the American Chemical Society, 2016, 138, 10140-10142 |
| 4130698 | CIF | C65.34 H67.68 I6 N12 O4.82 Zn3 | C 1 2/c 1 | 35.5334; 14.9227; 30.6034 90; 102.176; 90 | 15862.5 | Yoshioka, Shota; Inokuma, Yasuhide; Duplan, Vincent; Dubey, Ritesh; Fujita, Makoto X-ray Structure Analysis of Ozonides by the Crystalline Sponge Method. Journal of the American Chemical Society, 2016, 138, 10140-10142 |
| 4130699 | CIF | C72 H68 Al2 Cl4 F48 N2 O12 | P 1 21/c 1 | 10.2354; 22.4215; 20.0452 90; 92.5728; 90 | 4595.6 | Li, Tao; Tan, Gengwen; Shao, Dong; Li, Jing; Zhang, Zaichao; Song, You; Sui, Yunxia; Chen, Sheng; Fang, Yong; Wang, Xinping Magnetic Bistability in a Discrete Organic Radical. Journal of the American Chemical Society, 2016, 138, 10092-10095 |
| 4130700 | CIF | C72 H68 Al2 Cl4 F48 N2 O12 | P 1 21/c 1 | 10.0924; 22.1142; 20.0895 90; 92.8778; 90 | 4478 | Li, Tao; Tan, Gengwen; Shao, Dong; Li, Jing; Zhang, Zaichao; Song, You; Sui, Yunxia; Chen, Sheng; Fang, Yong; Wang, Xinping Magnetic Bistability in a Discrete Organic Radical. Journal of the American Chemical Society, 2016, 138, 10092-10095 |
| 4130701 | CIF | C16 H12 Co N5 O | P -1 | 8.7573; 9.2971; 17.9518 96.322; 96.085; 98.476 | 1425.7 | Walter, Melody R.; Dzul, Stephen P.; Rodrigues, Andria V.; Stemmler, Timothy L.; Telser, Joshua; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C. Synthesis of Co(II)-NO(-) Complexes and Their Reactivity as a Source of Nitroxyl. Journal of the American Chemical Society, 2016, 138, 12459-12471 |
| 4130702 | CIF | C189.74 H179.72 Cl20.22 F4 N33 O33.99 | P -1 | 21.947; 31.682; 32.585 68.47; 71.98; 87.32 | 19985 | Lautrette, Guillaume; Wicher, Barbara; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Iterative Evolution of an Abiotic Foldamer Sequence for the Recognition of Guest Molecules with Atomic Precision. Journal of the American Chemical Society, 2016, 138, 10314-10322 |
| 4130703 | CIF | C172.93 H161.93 Cl11.79 F3 N31 O31 | C 1 2/c 1 | 49.748; 20.6649; 44.655 90; 120.124; 90 | 39707 | Lautrette, Guillaume; Wicher, Barbara; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Iterative Evolution of an Abiotic Foldamer Sequence for the Recognition of Guest Molecules with Atomic Precision. Journal of the American Chemical Society, 2016, 138, 10314-10322 |
| 4130704 | CIF | C176.69 H170.65 Cl26.07 F2 N32 O34.03 | C 1 2/c 1 | 50.2; 20.65; 44.5 90; 119.95; 90 | 39970 | Lautrette, Guillaume; Wicher, Barbara; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Iterative Evolution of an Abiotic Foldamer Sequence for the Recognition of Guest Molecules with Atomic Precision. Journal of the American Chemical Society, 2016, 138, 10314-10322 |
| 4130705 | CIF | C175.19 H167.07 Cl18.58 F3 N31 O33.45 | C 1 2/c 1 | 49.435; 20.803; 44.896 90; 120.02; 90 | 39977 | Lautrette, Guillaume; Wicher, Barbara; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Iterative Evolution of an Abiotic Foldamer Sequence for the Recognition of Guest Molecules with Atomic Precision. Journal of the American Chemical Society, 2016, 138, 10314-10322 |
| 4130706 | CIF | C195.18 H194.65 Cl18.55 F4 N33 O35.73 | P -1 | 21.071; 24.247; 25.223 73.88; 76.97; 69.57 | 11482 | Lautrette, Guillaume; Wicher, Barbara; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Iterative Evolution of an Abiotic Foldamer Sequence for the Recognition of Guest Molecules with Atomic Precision. Journal of the American Chemical Society, 2016, 138, 10314-10322 |
| 4130707 | CIF | C141.74 H140.4 Cl5.22 N28 O31.34 | P 1 2/n 1 | 19.64; 22.54; 39.4 90; 101.49; 90 | 17092 | Lautrette, Guillaume; Wicher, Barbara; Kauffmann, Brice; Ferrand, Yann; Huc, Ivan Iterative Evolution of an Abiotic Foldamer Sequence for the Recognition of Guest Molecules with Atomic Precision. Journal of the American Chemical Society, 2016, 138, 10314-10322 |
| 4130708 | CIF | C62 H58 N6 O2 Ti | C 1 2/c 1 | 26.125; 13.1556; 15.3654 90; 108.347; 90 | 5012.5 | Zhang, Yu; Petersen, Jeffrey L.; Milsmann, Carsten A Luminescent Zirconium(IV) Complex as a Molecular Photosensitizer for Visible Light Photoredox Catalysis. Journal of the American Chemical Society, 2016, 138, 13115-13118 |
| 4130709 | CIF | C58.5 H52 Cl4 N6 Zr | P -1 | 13.9916; 14.6671; 15.0683 67.0258; 64.2263; 80.3251 | 2563.8 | Zhang, Yu; Petersen, Jeffrey L.; Milsmann, Carsten A Luminescent Zirconium(IV) Complex as a Molecular Photosensitizer for Visible Light Photoredox Catalysis. Journal of the American Chemical Society, 2016, 138, 13115-13118 |
| 4130710 | CIF | C80.5 H86 Li N6 O4 Ti | P -1 | 14.033; 15.4827; 18.3458 66.7781; 68.3245; 78.74 | 3398.3 | Zhang, Yu; Petersen, Jeffrey L.; Milsmann, Carsten A Luminescent Zirconium(IV) Complex as a Molecular Photosensitizer for Visible Light Photoredox Catalysis. Journal of the American Chemical Society, 2016, 138, 13115-13118 |
| 4130711 | CIF | C28 H25 Cl2 N3 | C 1 2/c 1 | 15.2333; 21.899; 15.621 90; 113.682; 90 | 4772.2 | Zhang, Yu; Petersen, Jeffrey L.; Milsmann, Carsten A Luminescent Zirconium(IV) Complex as a Molecular Photosensitizer for Visible Light Photoredox Catalysis. Journal of the American Chemical Society, 2016, 138, 13115-13118 |
| 4130712 | CIF | C25 H21 Br O2 | P 1 21 1 | 7.087; 9.4712; 14.736 90; 95.033; 90 | 985.3 | Yang, Zhenyu; He, Ying; Toste, F. Dean Biomimetic Approach to the Catalytic Enantioselective Synthesis of Flavonoids. Journal of the American Chemical Society, 2016, 138, 9775-9778 |
| 4130713 | CIF | C22 H16 Cl8 N5 O7 Ru2 | P 1 21/c 1 | 17.2028; 15.4349; 11.5463 90; 90.05; 90 | 3065.8 | Corcos, Amanda R.; Pap, József S; Yang, Tzuhsiung; Berry, John F. A Synthetic Oxygen Atom Transfer Photocycle from a Diruthenium Oxyanion Complex. Journal of the American Chemical Society, 2016, 138, 10032-10040 |
| 4130714 | CIF | C22 H16 Cl9 N4 O8 Ru2 | P 1 21/n 1 | 11.5392; 16.7038; 16.6387 90; 93.965; 90 | 3199.4 | Corcos, Amanda R.; Pap, József S; Yang, Tzuhsiung; Berry, John F. A Synthetic Oxygen Atom Transfer Photocycle from a Diruthenium Oxyanion Complex. Journal of the American Chemical Society, 2016, 138, 10032-10040 |
| 4130715 | CIF | C23 H23 N O S | P 1 21/c 1 | 10.0156; 8.0639; 22.8556 90; 97.721; 90 | 1829.19 | Wiedbrauk, Sandra; Maerz, Benjamin; Samoylova, Elena; Reiner, Anne; Trommer, Florian; Mayer, Peter; Zinth, Wolfgang; Dube, Henry Twisted Hemithioindigo Photoswitches: Solvent Polarity Determines the Type of Light-Induced Rotations. Journal of the American Chemical Society, 2016, 138, 12219-12227 |
| 4130716 | CIF | C17 H15 N O S | P -1 | 9.3079; 12.1781; 13.2465 106.732; 92.499; 108.633 | 1347.3 | Wiedbrauk, Sandra; Maerz, Benjamin; Samoylova, Elena; Reiner, Anne; Trommer, Florian; Mayer, Peter; Zinth, Wolfgang; Dube, Henry Twisted Hemithioindigo Photoswitches: Solvent Polarity Determines the Type of Light-Induced Rotations. Journal of the American Chemical Society, 2016, 138, 12219-12227 |
| 4130717 | CIF | C19 H19 N O S | P -1 | 8.331; 9.1106; 11.7677 78.4434; 88.9037; 63.9928 | 784.06 | Wiedbrauk, Sandra; Maerz, Benjamin; Samoylova, Elena; Reiner, Anne; Trommer, Florian; Mayer, Peter; Zinth, Wolfgang; Dube, Henry Twisted Hemithioindigo Photoswitches: Solvent Polarity Determines the Type of Light-Induced Rotations. Journal of the American Chemical Society, 2016, 138, 12219-12227 |
| 4130718 | CIF | C19 H19 N O S | P 1 21/c 1 | 9.7376; 18.717; 8.9622 90; 97.579; 90 | 1619.17 | Wiedbrauk, Sandra; Maerz, Benjamin; Samoylova, Elena; Reiner, Anne; Trommer, Florian; Mayer, Peter; Zinth, Wolfgang; Dube, Henry Twisted Hemithioindigo Photoswitches: Solvent Polarity Determines the Type of Light-Induced Rotations. Journal of the American Chemical Society, 2016, 138, 12219-12227 |
| 4130719 | CIF | C53.92 H70.81 Cl5.04 N O3 P Pd | P 1 21/c 1 | 10.6412; 21.109; 24.0776 90; 98.404; 90 | 5350.4 | Arrechea, Pedro Luis; Buchwald, Stephen L. Biaryl Phosphine Based Pd(II) Amido Complexes: The Effect of Ligand Structure on Reductive Elimination. Journal of the American Chemical Society, 2016, 138, 12486-12493 |
| 4130720 | CIF | C61.55 H82.84 N O5 P Pd | P -1 | 17.8561; 18.1897; 19.0033 72.848; 79.98; 77.541 | 5718.4 | Arrechea, Pedro Luis; Buchwald, Stephen L. Biaryl Phosphine Based Pd(II) Amido Complexes: The Effect of Ligand Structure on Reductive Elimination. Journal of the American Chemical Society, 2016, 138, 12486-12493 |
| 4130721 | CIF | C150 H225 Au21 S15 | P -1 | 16.647; 20.8853; 31.0722 72.542; 76.013; 70.335 | 9584.6 | Chen, Shuang; Xiong, Lin; Wang, Shuxin; Ma, Zhongyun; Jin, Shan; Sheng, Hongting; Pei, Yong; Zhu, Manzhou Total Structure Determination of Au21(S-Adm)15 and Geometrical/Electronic Structure Evolution of Thiolated Gold Nanoclusters. Journal of the American Chemical Society, 2016, 138, 10754-10757 |
| 4130722 | CIF | C26 H47 B Co N O3 P2 | P 1 21/n 1 | 9.168; 18.831; 16.883 90; 101.02; 90 | 2861 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130723 | CIF | C29 H56 B Co N2 O2 P2 | P 1 21/n 1 | 10.759; 15.982; 19.173 90; 93.152; 90 | 3291.8 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130724 | CIF | C29 H54 B Co N4 O2 P2 | P 1 21/c 1 | 9.9557; 16.117; 20.4822 90; 98.647; 90 | 3249.1 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130725 | CIF | C33 H63 B Cl Ir N2 O3 P2 | P -1 | 11.6915; 12.0608; 13.9689 73.388; 82.644; 85.856 | 1870.67 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130726 | CIF | C29 H56 B Ir N2 O2 P2 | P 1 21 1 | 9.5; 17.9686; 10.8015 90; 114.926; 90 | 1672.09 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130727 | CIF | C25 H46 B Cl Co N O2 P2 | P -1 | 10.9273; 13.5197; 21.0752 76.249; 79.975; 83.708 | 2970.52 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130728 | CIF | C31 H60 B2 Co N O4 P2 | P 1 21/c 1 | 11.1743; 22.1777; 14.5277 90; 90.804; 90 | 3599.9 | Obligacion, Jennifer V.; Semproni, Scott P.; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed C(sp(2))-H Borylation: Mechanistic Insights Inspire Catalyst Design. Journal of the American Chemical Society, 2016, 138, 10645-10653 |
| 4130729 | CIF | C17 H15 N O4 | P 1 | 6.4718; 7.7276; 7.9956 68.426; 85.638; 87.899 | 370.76 | Huo, Xiaohong; He, Rui; Zhang, Xiao; Zhang, Wanbin An Ir/Zn Dual Catalysis for Enantio- and Diastereodivergent α-Allylation of α-Hydroxyketones. Journal of the American Chemical Society, 2016, 138, 11093-11096 |
| 4130730 | CIF | C27 H25 N O5 | P 1 21 1 | 5.7846; 10.081; 20.654 90; 95.51; 90 | 1198.9 | Huo, Xiaohong; He, Rui; Zhang, Xiao; Zhang, Wanbin An Ir/Zn Dual Catalysis for Enantio- and Diastereodivergent α-Allylation of α-Hydroxyketones. Journal of the American Chemical Society, 2016, 138, 11093-11096 |
| 4130731 | CIF | C17 H18 N0 O2 | P 21 21 2 | 14.8428; 18.9967; 10.3327 90; 90; 90 | 2913.45 | Huo, Xiaohong; He, Rui; Zhang, Xiao; Zhang, Wanbin An Ir/Zn Dual Catalysis for Enantio- and Diastereodivergent α-Allylation of α-Hydroxyketones. Journal of the American Chemical Society, 2016, 138, 11093-11096 |
| 4130732 | CIF | C16 H18 O5 | P 21 21 21 | 6.6302; 7.9041; 26.5947 90; 90; 90 | 1393.72 | Wu, Xuesong; Chen, Zhiwei; Bai, Yu-Bin; Dong, Vy M. Diastereodivergent Construction of Bicyclic γ-Lactones via Enantioselective Ketone Hydroacylation. Journal of the American Chemical Society, 2016, 138, 12013-12016 |
| 4130733 | CIF | C17 H20 O3 | P 1 21 1 | 10.7939; 6.1019; 11.603 90; 109.966; 90 | 718.28 | Wu, Xuesong; Chen, Zhiwei; Bai, Yu-Bin; Dong, Vy M. Diastereodivergent Construction of Bicyclic γ-Lactones via Enantioselective Ketone Hydroacylation. Journal of the American Chemical Society, 2016, 138, 12013-12016 |
| 4130734 | CIF | C17 H20 O3 | P 21 21 21 | 5.8192; 8.5684; 29.2539 90; 90; 90 | 1458.64 | Wu, Xuesong; Chen, Zhiwei; Bai, Yu-Bin; Dong, Vy M. Diastereodivergent Construction of Bicyclic γ-Lactones via Enantioselective Ketone Hydroacylation. Journal of the American Chemical Society, 2016, 138, 12013-12016 |
| 4130735 | CIF | C2.48 H1.71 Cl0.05 O0.45 P0.05 Rh0.05 Zr0.08 | P -1 | 18.126; 20.015; 21.79 109.155; 103.794; 99.7 | 6985 | Sawano, Takahiro; Lin, Zekai; Boures, Dean; An, Bing; Wang, Cheng; Lin, Wenbin Metal-Organic Frameworks Stabilize Mono(phosphine)-Metal Complexes for Broad-Scope Catalytic Reactions. Journal of the American Chemical Society, 2016, 138, 9783-9786 |
| 4130736 | CIF | C2.61 Ir0.07 O0.61 P0.07 Zr0.1 | P -1 | 19.783; 21.51; 23.023 117.806; 111.824; 90.022 | 7862 | Sawano, Takahiro; Lin, Zekai; Boures, Dean; An, Bing; Wang, Cheng; Lin, Wenbin Metal-Organic Frameworks Stabilize Mono(phosphine)-Metal Complexes for Broad-Scope Catalytic Reactions. Journal of the American Chemical Society, 2016, 138, 9783-9786 |
| 4130737 | CIF | C36 H32 F3 O4 P S | P 1 21/n 1 | 9.9287; 23.4031; 13.6432 90; 97.655; 90 | 3141.91 | Byrne, Peter A.; Karaghiosoff, Konstantin; Mayr, Herbert Ambident Reactivity of Acetyl- and Formyl-Stabilized Phosphonium Ylides. Journal of the American Chemical Society, 2016, 138, 11272-11281 |
| 4130738 | CIF | C37 H34 F3 O4 P S | P b c a | 14.8092; 18.0751; 25.1097 90; 90; 90 | 6721.3 | Byrne, Peter A.; Karaghiosoff, Konstantin; Mayr, Herbert Ambident Reactivity of Acetyl- and Formyl-Stabilized Phosphonium Ylides. Journal of the American Chemical Society, 2016, 138, 11272-11281 |
| 4130739 | CIF | C47 H37 N5 | P -1 | 13.6438; 18.702; 23.756 78.05; 76.92; 72.03 | 5554.5 | Li, Zhong'an; Zhu, Zonglong; Chueh, Chu-Chen; Jo, Sae Byeok; Luo, Jingdong; Jang, Sei-Hum; Jen, Alex K.-Y. Rational Design of Dipolar Chromophore as an Efficient Dopant-Free Hole-Transporting Material for Perovskite Solar Cells. Journal of the American Chemical Society, 2016, 138, 11833-11839 |
| 4130740 | CIF | C25 H29 N O S | P 1 21 1 | 5.5631; 17.6908; 21.5907 90; 90.0191; 90 | 2124.9 | Yang, Yang; Perry, Ian B.; Buchwald, Stephen L. Copper-Catalyzed Enantioselective Addition of Styrene-Derived Nucleophiles to Imines Enabled by Ligand-Controlled Chemoselective Hydrocupration. Journal of the American Chemical Society, 2016, 138, 9787-9790 |
| 4130741 | CIF | C27 H25 Br N O P | P 1 21 1 | 12.3219; 9.9416; 20.196 90; 107.031; 90 | 2365.5 | Yang, Yang; Perry, Ian B.; Buchwald, Stephen L. Copper-Catalyzed Enantioselective Addition of Styrene-Derived Nucleophiles to Imines Enabled by Ligand-Controlled Chemoselective Hydrocupration. Journal of the American Chemical Society, 2016, 138, 9787-9790 |
| 4130742 | CIF | C19 H36 Cl N9 O9 | P 1 21/c 1 | 10.7037; 28.6071; 9.3466 90; 104.826; 90 | 2766.66 | Maity, Arunava; Gangopadhyay, Monalisa; Basu, Arghya; Aute, Sunil; Babu, Sukumaran Santhosh; Das, Amitava Counteranion Driven Homochiral Assembly of a Cationic C3-Symmetric Gelator through Ion-Pair Assisted Hydrogen Bond. Journal of the American Chemical Society, 2016, 138, 11113-11116 |
| 4130743 | CIF | C30 H40 N9 O5 S | P 1 21/n 1 | 18.376; 7.384; 26.915 90; 104.57; 90 | 3534.6 | Maity, Arunava; Gangopadhyay, Monalisa; Basu, Arghya; Aute, Sunil; Babu, Sukumaran Santhosh; Das, Amitava Counteranion Driven Homochiral Assembly of a Cationic C3-Symmetric Gelator through Ion-Pair Assisted Hydrogen Bond. Journal of the American Chemical Society, 2016, 138, 11113-11116 |
| 4130744 | CIF | C30 H40 N9 O5 S | P 1 21/n 1 | 18.411; 7.3949; 26.935 90; 104.741; 90 | 3546.4 | Maity, Arunava; Gangopadhyay, Monalisa; Basu, Arghya; Aute, Sunil; Babu, Sukumaran Santhosh; Das, Amitava Counteranion Driven Homochiral Assembly of a Cationic C3-Symmetric Gelator through Ion-Pair Assisted Hydrogen Bond. Journal of the American Chemical Society, 2016, 138, 11113-11116 |
| 4130745 | CIF | C108 H82 B Cl F24 N2 P2 Pd S2 | P 1 21/c 1 | 14.621; 18.621; 35.518 90; 94.254; 90 | 9643 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130746 | CIF | C71 H50 B Cl3 F24 N2 S2 | P -1 | 12.15; 17.777; 17.946 116.317; 90.327; 102.374 | 3371.2 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130747 | CIF | C114 H94 B Cl F24 N2 P2 Pd | P -1 | 15.027; 20.486; 20.641 60.504; 86.726; 89.857 | 5519.2 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130748 | CIF | C82.25 H82.25 B Cl1.75 F4 N2 P2 Pd | P -1 | 12.19; 16.932; 19.639 71.035; 77.323; 72.711 | 3626 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130749 | CIF | C42 H42.5 Cl4 N4 O | P -1 | 15.619; 15.985; 19.52 90.505; 106.024; 111.977 | 4309.3 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130750 | CIF | C77 H71 Cl N4 O P2 Pd | P -1 | 11.827; 18.13; 19.269 62.886; 86.197; 82.33 | 3644.7 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130751 | CIF | C76.375 H71.875 Br N2 O4 P2 Pd | P -1 | 17.769; 19.107; 20.541 70.719; 82.106; 89.436 | 6516 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130752 | CIF | C112 H100 Br2 N2 O4 P4 Pd2 | P -1 | 11.9738; 13.7936; 15.406 77.809; 85.517; 71.342 | 2356.2 | Davydenko, Iryna; Barlow, Stephen; Sharma, Rajesh; Benis, Sepehr; Simon, Janos; Allen, Taylor G.; Cooper, Matthew W.; Khrustalev, Victor; Jucov, Evgheni V.; Castañeda, Raúl; Ordonez, Carlos; Li, Zhong'an; Chi, San-Hui; Jang, Sei-Hum; Parker, Timothy C.; Timofeeva, Tatiana V.; Perry, Joseph W.; Jen, Alex K.-Y.; Hagan, David J.; Van Stryland, Eric W.; Marder, Seth R. Facile Incorporation of Pd(PPh3)2Hal Substituents into Polymethines, Merocyanines, and Perylene Diimides as a Means of Suppressing Intermolecular Interactions. Journal of the American Chemical Society, 2016, 138, 10112-10115 |
| 4130753 | CIF | C27 H28 N2 O7 | P 1 21/n 1 | 9.3355; 24.913; 10.7218 90; 90.679; 90 | 2493.5 | Chen, Wenxin; Liu, Zheng; Tian, Jiaqi; Li, Jin; Ma, Jing; Cheng, Xu; Li, Guigen Building Congested Ketone: Substituted Hantzsch Ester and Nitrile as Alkylation Reagents in Photoredox Catalysis. Journal of the American Chemical Society, 2016, 138, 12312-12315 |
| 4130754 | CIF | C17 H25 B Cl2 F4 Fe N2 Ni O2 S2 | P 1 21/n 1 | 8.3624; 20.4468; 14.1835 90; 94.472; 90 | 2417.8 | Ding, Shengda; Ghosh, Pokhraj; Lunsford, Allen M.; Wang, Ning; Bhuvanesh, Nattamai; Hall, Michael B.; Darensbourg, Marcetta Y. Hemilabile Bridging Thiolates as Proton Shuttles in Bioinspired H<sub>2</sub> Production Electrocatalysts. Journal of the American Chemical Society, 2016, 138, 12920-12927 |
| 4130755 | CIF | C15.4 H23.8 B Cl0.8 F4 Fe2 N3 O2 S2 | F d d 2 | 23.578; 30.074; 12.5159 90; 90; 90 | 8875 | Ding, Shengda; Ghosh, Pokhraj; Lunsford, Allen M.; Wang, Ning; Bhuvanesh, Nattamai; Hall, Michael B.; Darensbourg, Marcetta Y. Hemilabile Bridging Thiolates as Proton Shuttles in Bioinspired H<sub>2</sub> Production Electrocatalysts. Journal of the American Chemical Society, 2016, 138, 12920-12927 |
| 4130756 | CIF | C15 H23 B F4 Fe N2 Ni O S2 | C 1 2/c 1 | 25.518; 7.333; 22.821 90; 116.382; 90 | 3826 | Ding, Shengda; Ghosh, Pokhraj; Lunsford, Allen M.; Wang, Ning; Bhuvanesh, Nattamai; Hall, Michael B.; Darensbourg, Marcetta Y. Hemilabile Bridging Thiolates as Proton Shuttles in Bioinspired H<sub>2</sub> Production Electrocatalysts. Journal of the American Chemical Society, 2016, 138, 12920-12927 |
| 4130757 | CIF | C42 H46 S4 | P -1 | 5.8732; 9.5089; 16.609 81.082; 86.233; 81.513 | 905.5 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130758 | CIF | C46 H44 S2 | P -1 | 7.6703; 21.0804; 22.2882 70.261; 80.257; 89.482 | 3338.7 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130759 | CIF | C26 H22 S | I 1 2 1 | 18.49; 6.052; 19.25 90; 118.64; 90 | 1891 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130760 | CIF | C22 H19 Br S | P 21 21 21 | 4.0008; 17.707; 24.219 90; 90; 90 | 1715.7 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130761 | CIF | C66 H54 S3 | P 1 21/c 1 | 10.6685; 31.183; 15.5232 90; 106.984; 90 | 4939 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130762 | CIF | C211 H228 S10 | P 1 21/c 1 | 19.9874; 27.2493; 37.9721 90; 103.491; 90 | 20110.6 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130763 | CIF | C34 H32 S2 | P 1 21/n 1 | 19.7473; 5.675; 23.7866 90; 103.491; 90 | 2592.1 | Meng, Lingkui; Fujikawa, Takao; Kuwayama, Motonobu; Segawa, Yasutomo; Itami, Kenichiro Thiophene-Fused π-Systems from Diarylacetylenes and Elemental Sulfur. Journal of the American Chemical Society, 2016, 138, 10351-10355 |
| 4130764 | CIF | C119 H195 Cu Ge18 N P3 Pd3 Sn7 | P -1 | 14.669; 22.4404; 23.8287 79.329; 75.196; 80.078 | 7387.6 | Perla, Luis G.; Sevov, Slavi C. A Stannyl-Decorated Zintl Ion [Ge18Pd3(Sn(i)Pr3)6](2-): Twinned Icosahedron with a Common Pd3-Face or 18-Vertex Hypho-Deltahedron with a Pd3-Triangle Inside. Journal of the American Chemical Society, 2016, 138, 9795-9798 |
| 4130765 | CIF | C96 H212 Ge18 K2 N4 O13 Pd3 Sn6 | P 1 21/n 1 | 17.3152; 31.1602; 26.1732 90; 96.851; 90 | 14020.8 | Perla, Luis G.; Sevov, Slavi C. A Stannyl-Decorated Zintl Ion [Ge18Pd3(Sn(i)Pr3)6](2-): Twinned Icosahedron with a Common Pd3-Face or 18-Vertex Hypho-Deltahedron with a Pd3-Triangle Inside. Journal of the American Chemical Society, 2016, 138, 9795-9798 |
| 4130766 | CIF | C12 H16 O3 | P 1 21 1 | 6.3424; 16.9401; 9.9234 90; 103.876; 90 | 1035.06 | 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 |
| 4130767 | CIF | C20 H30 O3 | P 1 21 1 | 8.5261; 9.7486; 11.1669 90; 107.702; 90 | 884.22 | 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 |
| 4130768 | CIF | C16 H20 O3 | P n a 21 | 17.152; 5.834; 13.48 90; 90; 90 | 1348.9 | 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 |
| 4130769 | CIF | C28 H48 O4 Si | P 1 21 1 | 8.682; 10.303; 15.433 90; 101.054; 90 | 1354.9 | 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 |
| 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 |
| 4130771 | CIF | C25 H27 Br O4 | P 1 21/c 1 | 18.1209; 6.9681; 17.8943 90; 102.802; 90 | 2203.3 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130772 | CIF | C19 H28 O3 | P 1 21 1 | 8.6715; 10.3828; 9.4244 90; 100.887; 90 | 833.25 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130773 | CIF | C19 H24 O5 | P 1 21/n 1 | 17.606; 10.2852; 19.9102 90; 116.176; 90 | 3235.61 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130774 | CIF | C19 H22 O5 | P 31 | 15.2396; 15.2396; 6.5378 90; 90; 120 | 1314.95 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130775 | CIF | C19 H26 O3 Si | P 1 21 1 | 10.0283; 6.7122; 14.1747 90; 101.993; 90 | 933.3 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130776 | CIF | C319 H24 O3 | P -1 | 11.1643; 11.8846; 12.7007 75.011; 76.716; 89.935 | 1581.23 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130777 | CIF | C18 H24 O3 | P 1 21/c 1 | 9.13; 7.6658; 21.832 90; 95.398; 90 | 1521.2 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130778 | CIF | C19 H24 O5 | P 1 21/n 1 | 13.798; 7.124; 16.8297 90; 94.256; 90 | 1649.7 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130779 | CIF | C19 H28 O3 | P 1 21/n 1 | 10.3974; 12.7181; 13.2489 90; 112.175; 90 | 1622.4 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130780 | CIF | C17 H22 O2 | P 1 21/c 1 | 21.5194; 10.6148; 12.7272 90; 102.271; 90 | 2840.8 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130781 | CIF | C19 H25 I O5 | P 1 21/c 1 | 9.8414; 24.468; 7.9373 90; 108.333; 90 | 1814.3 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130782 | CIF | C17 H22 O2 | P 1 21/c 1 | 10.931; 9.641; 13.213 90; 92.018; 90 | 1391.6 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130783 | CIF | C18 H26 O3 | P c a 21 | 14.6942; 9.3324; 11.6047 90; 90; 90 | 1591.4 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
| 4130784 | CIF | C254 H205 F48 Fe4 N31 O2 Sb8 | P -1 | 22.5576; 25.9536; 26.6117 102.011; 93.562; 100.843 | 14883.3 | Ronson, Tanya K.; Pilgrim, Ben S.; Nitschke, Jonathan R. Pathway-Dependent Post-assembly Modification of an Anthracene-Edged M(II)4L6 Tetrahedron. Journal of the American Chemical Society, 2016, 138, 10417-10420 |
| 4130785 | CIF | C313 H183 F48 Fe4 N26 Sb8 | P -1 | 21.8874; 27.4261; 30.8088 64.666; 87.269; 79.937 | 16450.7 | Ronson, Tanya K.; Pilgrim, Ben S.; Nitschke, Jonathan R. Pathway-Dependent Post-assembly Modification of an Anthracene-Edged M(II)4L6 Tetrahedron. Journal of the American Chemical Society, 2016, 138, 10417-10420 |
| 4130786 | CIF | C330 H165 Cl8 Fe4 N51 O32 | R -3 :H | 26.1142; 26.1142; 110.422 90; 90; 120 | 65214 | Ronson, Tanya K.; Pilgrim, Ben S.; Nitschke, Jonathan R. Pathway-Dependent Post-assembly Modification of an Anthracene-Edged M(II)4L6 Tetrahedron. Journal of the American Chemical Society, 2016, 138, 10417-10420 |
| 4130787 | CIF | C71 H90 Cl2 Fe N4 O3 Si2 | P 1 21/c 1 | 19.251; 16.018; 21.996 90; 92.636; 90 | 6775.6 | Hickox, Hunter P.; Wang, Yuzhong; Xie, Yaoming; Wei, Pingrong; Schaefer, 3rd, Henry F; Robinson, Gregory H. Push-Pull Stabilization of Parent Monochlorosilylenes. Journal of the American Chemical Society, 2016, 138, 9799-9802 |
| 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 |
| 4130789 | CIF | C2.17 O0.45 Zr0.09 | P m -3 n | 41.616; 41.616; 41.616 90; 90; 90 | 72074 | 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 |
| 4130791 | CIF | C6 H12 Fe N8 O2 Sr | C 1 2/c 1 | 12.2629; 7.4837; 15.1106 90; 106.601; 90 | 1328.93 | Duyker, Samuel G.; Hill, Joshua A.; Howard, Christopher J.; Goodwin, Andrew L. Guest-Activated Forbidden Tilts in a Molecular Perovskite Analogue. Journal of the American Chemical Society, 2016, 138, 11121-11123 |
| 4130792 | CIF | C6 H8 Fe N8 Sr | P 1 21/n 1 | 7.4087; 7.5926; 10.7605 90; 90.336; 90 | 605.28 | Duyker, Samuel G.; Hill, Joshua A.; Howard, Christopher J.; Goodwin, Andrew L. Guest-Activated Forbidden Tilts in a Molecular Perovskite Analogue. Journal of the American Chemical Society, 2016, 138, 11121-11123 |
| 4130793 | CIF | C18 H26 N4 Ni | C 1 2/c 1 | 14.251; 13.1814; 9.2333 90; 98.28; 90 | 1716.38 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
| 4130794 | CIF | C46 H54 B N4 Ni O | P -1 | 8.96; 14.2611; 16.7826 88.779; 75.985; 73.867 | 1996.3 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
| 4130795 | CIF | C30 H40 N4 Ni O | P 1 n 1 | 11.5021; 17.8327; 12.9451 90; 90.026; 90 | 2655.2 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
| 4130796 | CIF | C62 H76 B N4 Ni O3 | P 1 21/c 1 | 18.0244; 12.6029; 23.9084 90; 98.41; 90 | 5372.6 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
| 4130797 | CIF | C20 H26 F12 N6 Ni P2 | P 1 21/n 1 | 9.2668; 16.5937; 18.2485 90; 92.739; 90 | 2802.9 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
| 4130798 | CIF | C30 H20 | P 1 c 1 | 5.945; 7.244; 40.577 90; 91.345; 90 | 1747 | Yamaguchi, Yuji; Takubo, Maki; Ogawa, Keisuke; Nakayama, Ken-Ichi; Koganezawa, Tomoyuki; Katagiri, Hiroshi Terazulene Isomers: Polarity Change of OFETs through Molecular Orbital Distribution Contrast. Journal of the American Chemical Society, 2016, 138, 11335-11343 |
| 4130799 | CIF | C30 H20 | P 1 | 6.0461; 7.3963; 20.9073 81.327; 89.655; 88.536 | 923.95 | Yamaguchi, Yuji; Takubo, Maki; Ogawa, Keisuke; Nakayama, Ken-Ichi; Koganezawa, Tomoyuki; Katagiri, Hiroshi Terazulene Isomers: Polarity Change of OFETs through Molecular Orbital Distribution Contrast. Journal of the American Chemical Society, 2016, 138, 11335-11343 |
| 4130800 | CIF | C30 H20 | P -1 | 5.917; 7.782; 20.718 81.545; 87.448; 89.023 | 942.6 | Yamaguchi, Yuji; Takubo, Maki; Ogawa, Keisuke; Nakayama, Ken-Ichi; Koganezawa, Tomoyuki; Katagiri, Hiroshi Terazulene Isomers: Polarity Change of OFETs through Molecular Orbital Distribution Contrast. Journal of the American Chemical Society, 2016, 138, 11335-11343 |
| 4130801 | CIF | C18 H18 O3 S | P -1 | 6.1119; 10.41; 13.6296 76.812; 81.978; 82.825 | 832.15 | Li, Yuanyuan; Qiu, Dachuan; Gu, Rongrong; Wang, Junli; Shi, Jiarong; Li, Yang Aryne 1,2,3-Trifunctionalization with Aryl Allyl Sulfoxides. Journal of the American Chemical Society, 2016, 138, 10814-10817 |
| 4130802 | CIF | C19 H27 Au I P | P 1 21 1 | 8.5059; 10.5556; 11.4816 90; 93.9911; 90 | 1028.37 | Rekhroukh, Feriel; Estevez, Laura; Mallet-Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier β-Hydride Elimination at Low-Coordinate Gold(III) Centers. Journal of the American Chemical Society, 2016, 138, 11920-11929 |
| 4130803 | CIF | C17 H23 Au I P | P b c a | 8.2625; 13.7282; 32.2865 90; 90; 90 | 3662.2 | Rekhroukh, Feriel; Estevez, Laura; Mallet-Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier β-Hydride Elimination at Low-Coordinate Gold(III) Centers. Journal of the American Chemical Society, 2016, 138, 11920-11929 |
| 4130804 | CIF | C19 H22 N2 O | F d d 2 | 17.6684; 50.2977; 7.4226 90; 90; 90 | 6596.3 | McCreanor, Niall G.; Stanton, Steven; Bower, John F. Capture-Collapse Heterocyclization: 1,3-Diazepanes by C-N Reductive Elimination from Rhodacyclopentanones. Journal of the American Chemical Society, 2016, 138, 11465-11468 |
| 4130805 | CIF | C22 H24 N2 O4 | P -1 | 9.614; 10.268; 10.553 67.181; 83.169; 84.093 | 951.6 | McCreanor, Niall G.; Stanton, Steven; Bower, John F. Capture-Collapse Heterocyclization: 1,3-Diazepanes by C-N Reductive Elimination from Rhodacyclopentanones. Journal of the American Chemical Society, 2016, 138, 11465-11468 |
| 4130806 | CIF | C18 H18 N2 O2 S | C 1 2/c 1 | 16.4142; 10.5216; 19.1349 90; 101.713; 90 | 3235.85 | McCreanor, Niall G.; Stanton, Steven; Bower, John F. Capture-Collapse Heterocyclization: 1,3-Diazepanes by C-N Reductive Elimination from Rhodacyclopentanones. Journal of the American Chemical Society, 2016, 138, 11465-11468 |
| 4130807 | CIF | C41 H42.18 Cl1.12 Co N4 P | P 1 21/n 1 | 12.2774; 18.0919; 16.3936 90; 94.5253; 90 | 3630 | Tokmic, Kenan; Markus, Charles R.; Zhu, Lingyang; Fout, Alison R. Well-Defined Cobalt(I) Dihydrogen Catalyst: Experimental Evidence for a Co(I)/Co(III) Redox Process in Olefin Hydrogenation. Journal of the American Chemical Society, 2016, 138, 11907-11913 |
| 4130808 | CIF | C41 H42 Co N6 P | P 1 21/n 1 | 7.8946; 16.5851; 27.3473 90; 94.4478; 90 | 3569.9 | Tokmic, Kenan; Markus, Charles R.; Zhu, Lingyang; Fout, Alison R. Well-Defined Cobalt(I) Dihydrogen Catalyst: Experimental Evidence for a Co(I)/Co(III) Redox Process in Olefin Hydrogenation. Journal of the American Chemical Society, 2016, 138, 11907-11913 |
| 4130809 | CIF | C6 H19 B10 N O | P 1 21/n 1 | 6.782; 16.6525; 12.2196 90; 100.039; 90 | 1358.9 | 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 |
| 4130810 | CIF | C12 H30 B10 N2 O2 | C 1 2/c 1 | 29.8616; 6.6361; 20.4917 90; 99.0968; 90 | 4009.66 | 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 |
| 4130811 | CIF | C10 H25 B10 N O2 | P 1 21/n 1 | 8.0349; 18.023; 12.072 90; 96.799; 90 | 1735.9 | 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 |
| 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 |
| 4130814 | CIF | C60 H48 Cl4 O8 | P 1 21 1 | 14.713; 11.1639; 16.1379 90; 103.704; 90 | 2575.3 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
| 4130815 | CIF | C60 H48 Cl4 O8 | P 1 21 1 | 14.7006; 11.1469; 16.1292 90; 103.773; 90 | 2567 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
| 4130816 | CIF | C47 H34 Cl2 O8 | C 1 2/c 1 | 29.664; 11.951; 26.712 90; 105.51; 90 | 9125 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
| 4130817 | CIF | C60 H48 Cl4 O8 | C 1 2/c 1 | 43.667; 14.9611; 31.555 90; 133.563; 90 | 14938 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
| 4130818 | CIF | C22 H23 Cl N O2 S2 | P 21 n b | 9.4658; 11.3757; 19.3517 90; 90; 90 | 2083.79 | Kennemur, Jennifer L.; Kortman, Gregory D.; Hull, Kami L. Rhodium-Catalyzed Regiodivergent Hydrothiolation of Allyl Amines and Imines. Journal of the American Chemical Society, 2016, 138, 11914-11919 |
| 4130819 | CIF | C17 H17 Br N4 O2 | P 1 21 1 | 10.587; 5.476; 15.006 90; 98.981; 90 | 859.3 | Momiyama, Norie; Tabuse, Hideaki; Noda, Hirofumi; Yamanaka, Masahiro; Fujinami, Takeshi; Yamanishi, Katsunori; Izumiseki, Atsuto; Funayama, Kosuke; Egawa, Fuyuki; Okada, Shino; Adachi, Hiroaki; Terada, Masahiro Molecular Design of a Chiral Brønsted Acid with Two Different Acidic Sites: Regio-, Diastereo-, and Enantioselective Hetero-Diels-Alder Reaction of Azopyridinecarboxylate with Amidodienes Catalyzed by Chiral Carboxylic Acid-Monophosphoric Acid. Journal of the American Chemical Society, 2016, 138, 11353-11359 |
| 4130820 | CIF | C26 H22 Br F3 N4 O4 | P 21 21 21 | 6.7967; 15.8; 23.896 90; 90; 90 | 2566.1 | Momiyama, Norie; Tabuse, Hideaki; Noda, Hirofumi; Yamanaka, Masahiro; Fujinami, Takeshi; Yamanishi, Katsunori; Izumiseki, Atsuto; Funayama, Kosuke; Egawa, Fuyuki; Okada, Shino; Adachi, Hiroaki; Terada, Masahiro Molecular Design of a Chiral Brønsted Acid with Two Different Acidic Sites: Regio-, Diastereo-, and Enantioselective Hetero-Diels-Alder Reaction of Azopyridinecarboxylate with Amidodienes Catalyzed by Chiral Carboxylic Acid-Monophosphoric Acid. Journal of the American Chemical Society, 2016, 138, 11353-11359 |
| 4130821 | CIF | C65 H63 O8 P Si | P 21 21 21 | 9.777; 14.488; 38.079 90; 90; 90 | 5393.9 | Momiyama, Norie; Tabuse, Hideaki; Noda, Hirofumi; Yamanaka, Masahiro; Fujinami, Takeshi; Yamanishi, Katsunori; Izumiseki, Atsuto; Funayama, Kosuke; Egawa, Fuyuki; Okada, Shino; Adachi, Hiroaki; Terada, Masahiro Molecular Design of a Chiral Brønsted Acid with Two Different Acidic Sites: Regio-, Diastereo-, and Enantioselective Hetero-Diels-Alder Reaction of Azopyridinecarboxylate with Amidodienes Catalyzed by Chiral Carboxylic Acid-Monophosphoric Acid. Journal of the American Chemical Society, 2016, 138, 11353-11359 |
| 4130822 | CIF | C208 H234 Au44 S26 | P -1 | 19.097; 24.0131; 29.8101 88.62; 89.464; 71.411 | 12953.3 | Liao, Lingwen; Zhuang, Shengli; Yao, Chuanhao; Yan, Nan; Chen, Jishi; Wang, Chengming; Xia, Nan; Liu, Xu; Li, Man-Bo; Li, Lingling; Bao, Xiaoli; Wu, Zhikun Structure of Chiral Au44(2,4-DMBT)26 Nanocluster with an 18-Electron Shell Closure. Journal of the American Chemical Society, 2016, 138, 10425-10428 |
| 4130823 | CIF | C14 H18 F7 N O2 | P 1 21/c 1 | 14.135; 12.502; 9.632 90; 100.507; 90 | 1673.6 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
| 4130824 | CIF | C13 H10 F7 N O2 | P 43 21 2 | 13.3576; 13.3576; 16.362 90; 90; 90 | 2919.4 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
| 4130825 | CIF | C32 H41 B2 F8 Fe N7 O4 | P b c a | 16.8624; 18.8653; 22.9188 90; 90; 90 | 7290.8 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
| 4130826 | CIF | C17 H26 B2 F8 Fe N4 O4 | P 1 21 1 | 8.4516; 13.5668; 11.368 90; 97.205; 90 | 1293.2 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
| 4130827 | CIF | C36 H28 B2 F20 N2 O3 S2 | C 1 2 1 | 18.608; 10.59; 20.591 90; 98.67; 90 | 4011.3 | Li, Songlei; Li, Gen; Meng, Wei; Du, Haifeng A Frustrated Lewis Pair Catalyzed Asymmetric Transfer Hydrogenation of Imines Using Ammonia Borane. Journal of the American Chemical Society, 2016, 138, 12956-12962 |
| 4130828 | CIF | C31 H38 N2 O11 S | P 1 21/c 1 | 14.4739; 16.2599; 14.1217 90; 110.575; 90 | 3111.5 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
| 4130829 | CIF | C22 H27 N O4 | P 1 c 1 | 9.5745; 17.2047; 12.0212 90; 103.504; 90 | 1925.5 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
| 4130830 | CIF | C25 H35 N O6 | C 1 2/c 1 | 23.9341; 11.7122; 16.9699 90; 109.488; 90 | 4484.5 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
| 4130831 | CIF | C22 H27 N O4 | P 1 21/n 1 | 6.7056; 19.1395; 14.5164 90; 98.255; 90 | 1843.8 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
| 4130832 | CIF | C23 H29 N O5 | P 1 c 1 | 6.7971; 17.5258; 8.2107 90; 91.635; 90 | 977.7 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
| 4130833 | CIF | C67.5 H55.5 Cl8.5 N5 O3.25 Rh | I 4 | 25.0036; 25.0036; 23.9683 90; 90; 90 | 14984.5 | Nakamura, Munechika; Kishimoto, Kazuki; Kobori, Yasuhiro; Abe, Tomoka; Yoza, Kenji; Kobayashi, Kenji Self-Assembled Molecular Gear: A 4:1 Complex of Rh(III)Cl Tetraarylporphyrin and Tetra(p-pyridyl)cavitand. Journal of the American Chemical Society, 2016, 138, 12564-12577 |
| 4130834 | CIF | C30 H44 Cl3 Mg N3 O | P 21 21 21 | 7.9066; 17.551; 22.4279 90; 90; 90 | 3112.3 | Rosen, Tomer; Goldberg, Israel; Venditto, Vincenzo; Kol, Moshe Tailor-Made Stereoblock Copolymers of Poly(lactic acid) by a Truly Living Polymerization Catalyst. Journal of the American Chemical Society, 2016, 138, 12041-12044 |
| 4130835 | CIF | C40 H53 Cl Hf Si2 Sn | P n m a | 31.894; 15.394; 7.9405 90; 90; 90 | 3898.6 | Kuwabara, Takuya; Nakada, Marisa; Hamada, Jumpei; Guo, Jing Dong; Nagase, Shigeru; Saito, Masaichi (η(4)-Butadiene)Sn(0) Complexes: A New Approach for Zero-Valent p-Block Elements Utilizing a Butadiene as a 4π-Electron Donor. Journal of the American Chemical Society, 2016, 138, 11378-11382 |
| 4130836 | CIF | C42 H58 Hf O Si2 Sn | P 21 21 21 | 8.0406; 15.0059; 33.2314 90; 90; 90 | 4009.6 | Kuwabara, Takuya; Nakada, Marisa; Hamada, Jumpei; Guo, Jing Dong; Nagase, Shigeru; Saito, Masaichi (η(4)-Butadiene)Sn(0) Complexes: A New Approach for Zero-Valent p-Block Elements Utilizing a Butadiene as a 4π-Electron Donor. Journal of the American Chemical Society, 2016, 138, 11378-11382 |
| 4130837 | CIF | C40 H64 N2 Si2 | P -1 | 9.229; 10.253; 11.671 89.69; 77.64; 64.1 | 965.5 | Mohapatra, Chandrajeet; Kundu, Subrata; Paesch, Alexander N.; Herbst-Irmer, Regine; Stalke, Dietmar; Andrada, Diego M.; Frenking, Gernot; Roesky, Herbert W. The Structure of the Carbene Stabilized Si2H2 May Be Equally Well Described with Coordinate Bonds as with Classical Double Bonds. Journal of the American Chemical Society, 2016, 138, 10429-10432 |
| 4130838 | CIF | C16 H23 N O | P 1 21 1 | 6.3276; 15.14; 14.425 90; 94.901; 90 | 1376.9 | Guo, Wusheng; Martínez-Rodríguez, Luis; Kuniyil, Rositha; Martin, Eddy; Escudero-Adán, Eduardo C; Maseras, Feliu; Kleij, Arjan W. Stereoselective and Versatile Preparation of Tri- and Tetrasubstituted Allylic Amine Scaffolds under Mild Conditions. Journal of the American Chemical Society, 2016, 138, 11970-11978 |
| 4130839 | CIF | C17 H19 N O | C 1 2/c 1 | 30.582; 12.1062; 7.4499 90; 97.785; 90 | 2732.8 | Guo, Wusheng; Martínez-Rodríguez, Luis; Kuniyil, Rositha; Martin, Eddy; Escudero-Adán, Eduardo C; Maseras, Feliu; Kleij, Arjan W. Stereoselective and Versatile Preparation of Tri- and Tetrasubstituted Allylic Amine Scaffolds under Mild Conditions. Journal of the American Chemical Society, 2016, 138, 11970-11978 |
| 4130840 | CIF | C47.5 H75 N6 P3 Si3 | P 1 21/c 1 | 21.4117; 21.3974; 25.7847 90; 114.123; 90 | 10781.7 | Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred Pnictogen-Silicon Analogues of Benzene. Journal of the American Chemical Society, 2016, 138, 10433-10436 |
| 4130841 | CIF | C48.5 H73 As3 N6 Si3 | F d d d :2 | 21.5579; 21.7446; 46.7236 90; 90; 90 | 21902.5 | Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred Pnictogen-Silicon Analogues of Benzene. Journal of the American Chemical Society, 2016, 138, 10433-10436 |
| 4130842 | CIF | C42 H46 As2 D12 N4 Si2 | P -1 | 9.29; 9.9536; 12.5142 69.954; 77.338; 86.516 | 1060.5 | Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred Pnictogen-Silicon Analogues of Benzene. Journal of the American Chemical Society, 2016, 138, 10433-10436 |
| 4130843 | CIF | C8 H6 O4 | P -1 | 5.0374; 5.3641; 7.0068 72.004; 76.098; 87.219 | 174.73 | Karothu, Durga Prasad; Weston, James; Desta, Israel Tilahun; Naumov, Panče Shape-Memory and Self-Healing Effects in Mechanosalient Molecular Crystals. Journal of the American Chemical Society, 2016, 138, 13298-13306 |
| 4130844 | CIF | C8 H6 O4 | P -1 | 3.7793; 6.4791; 7.404 82.942; 81.006; 88.982 | 177.71 | Karothu, Durga Prasad; Weston, James; Desta, Israel Tilahun; Naumov, Panče Shape-Memory and Self-Healing Effects in Mechanosalient Molecular Crystals. Journal of the American Chemical Society, 2016, 138, 13298-13306 |
| 4130845 | CIF | C8 H6 O4 | P -1 | 5.0384; 5.3623; 7.006 71.993; 76.093; 87.198 | 174.67 | Karothu, Durga Prasad; Weston, James; Desta, Israel Tilahun; Naumov, Panče Shape-Memory and Self-Healing Effects in Mechanosalient Molecular Crystals. Journal of the American Chemical Society, 2016, 138, 13298-13306 |
| 4130846 | CIF | C36.5 H21 Cl O | P 1 21 1 | 15.0088; 10.2881; 16.7851 90; 105.568; 90 | 2496.7 | Sako, Makoto; Takeuchi, Yoshiki; Tsujihara, Tetsuya; Kodera, Junpei; Kawano, Tomikazu; Takizawa, Shinobu; Sasai, Hiroaki Efficient Enantioselective Synthesis of Oxahelicenes Using Redox/Acid Cooperative Catalysts. Journal of the American Chemical Society, 2016, 138, 11481-11484 |
| 4130847 | CIF | C24 H17 N O6 | P 1 21/c 1 | 7.417; 10.589; 25.5745 90; 93.439; 90 | 2005 | Liu, Chong; Zeng, Chenjie; Luo, Tian-Yi; Merg, Andrea D.; Jin, Rongchao; Rosi, Nathaniel L. Establishing Porosity Gradients within Metal-Organic Frameworks Using Partial Postsynthetic Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 12045-12048 |
| 4130848 | CIF | C16 H10 Br N O4 | P -1 | 3.9365; 12.261; 15.859 111.241; 91.027; 91.753 | 712.8 | Liu, Chong; Zeng, Chenjie; Luo, Tian-Yi; Merg, Andrea D.; Jin, Rongchao; Rosi, Nathaniel L. Establishing Porosity Gradients within Metal-Organic Frameworks Using Partial Postsynthetic Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 12045-12048 |
| 4130849 | CIF | C13 H15 B N2 | C 1 2/c 1 | 22.7448; 6.433; 16.2309 90; 105.714; 90 | 2286.1 | Gellrich, Urs; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Reversible Aromaticity Transfer in a Bora-Cycle: Boron-Ligand Cooperation. Journal of the American Chemical Society, 2016, 138, 13307-13313 |
| 4130850 | CIF | C20 H19 B N2 O2 | P 1 21/c 1 | 11.76794; 11.3623; 13.01027 90; 104.026; 90 | 1687.75 | Gellrich, Urs; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Reversible Aromaticity Transfer in a Bora-Cycle: Boron-Ligand Cooperation. Journal of the American Chemical Society, 2016, 138, 13307-13313 |
| 4130851 | CIF | C33 H30 Cu F5 N2 | C 1 2/c 1 | 8.4885; 22.9762; 15.9265 90; 99.651; 90 | 3062.2 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130852 | CIF | C14 H15 Cl N2 O3 | P -1 | 6.9147; 7.9421; 13.3691 97.113; 101.828; 99.78 | 698.52 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130853 | CIF | C8 H12 N2 O2 S | P 1 21/c 1 | 10.0597; 10.189; 19.756 90; 95.22; 90 | 2016.56 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130854 | CIF | C12 H14 N2 O2 S | P 1 21/c 1 | 6.1687; 22.867; 8.7061 90; 94.893; 90 | 1223.6 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130855 | CIF | C32 H42 Br Cu N3 O0.5 S | P b c n | 16.3196; 19.5049; 20.4967 90; 90; 90 | 6524.3 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130856 | CIF | C32 H34 Cu F4 N3 O2 | P -1 | 9.9952; 11.0255; 16.6818 107.292; 93.899; 113.654 | 1570.52 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130857 | CIF | C12 H13 F4 N O3 | P 1 21/c 1 | 13.3949; 5.0875; 19.3422 90; 102.165; 90 | 1288.51 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
| 4130858 | CIF | C11 H17 N5 O2 | C 1 2 1 | 28.274; 4.8094; 10.6249 90; 107.141; 90 | 1380.6 | Krishnan, Baiju P.; Rai, Rishika; Asokan, Aromal; Sureshan, Kana M. Crystal-to-Crystal Synthesis of Triazole-Linked Pseudo-proteins via Topochemical Azide-Alkyne Cycloaddition Reaction. Journal of the American Chemical Society, 2016, 138, 14824-14827 |
| 4130859 | CIF | C20 H19 Br O2 | P 1 21 1 | 5.4275; 18.9357; 16.5145 90; 91.1186; 90 | 1696.9 | Erickson, Lucas W.; Lucas, Erika L.; Tollefson, Emily J.; Jarvo, Elizabeth R. Nickel-Catalyzed Cross-Electrophile Coupling of Alkyl Fluorides: Stereospecific Synthesis of Vinylcyclopropanes. Journal of the American Chemical Society, 2016, 138, 14006-14011 |
| 4130860 | CIF | C14 H18 O4 S | P 21 21 21 | 5.355; 8.9629; 28.7336 90; 90; 90 | 1379.11 | Erickson, Lucas W.; Lucas, Erika L.; Tollefson, Emily J.; Jarvo, Elizabeth R. Nickel-Catalyzed Cross-Electrophile Coupling of Alkyl Fluorides: Stereospecific Synthesis of Vinylcyclopropanes. Journal of the American Chemical Society, 2016, 138, 14006-14011 |
| 4130861 | CIF | C20 H22 O4 S | P 1 21 1 | 5.7195; 14.2673; 11.2806 90; 90.5948; 90 | 920.47 | Erickson, Lucas W.; Lucas, Erika L.; Tollefson, Emily J.; Jarvo, Elizabeth R. Nickel-Catalyzed Cross-Electrophile Coupling of Alkyl Fluorides: Stereospecific Synthesis of Vinylcyclopropanes. Journal of the American Chemical Society, 2016, 138, 14006-14011 |
| 4130862 | CIF | C51 H56 N10 O11 Zn | P 1 21/c 1 | 11.1579; 41.517; 12.1931 90; 104.766; 90 | 5461.8 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
| 4130863 | CIF | C51 H56 Mn N10 O11 | P 1 21/c 1 | 11.2462; 41.9047; 12.0982 90; 104.024; 90 | 5531.6 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
| 4130864 | CIF | C51 H56 Fe N10 O11 | P 1 21/c 1 | 11.134; 41.701; 12.1981 90; 104.828; 90 | 5475 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
| 4130865 | CIF | C51 H56 N10 Ni O11 | P 1 21/c 1 | 11.1373; 41.835; 12.177 90; 104.831; 90 | 5484.6 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
| 4130866 | CIF | C25 H27 N5 O5 | P 1 21/c 1 | 10.3389; 7.9833; 28.328 90; 93.658; 90 | 2333.39 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
| 4130867 | CIF | C57 H44 O6 | C 1 2/c 1 | 23.676; 19.0674; 19.8863 90; 104.224; 90 | 8702.2 | Xu, Feng; Hershey, Kyle W.; Holmes, Russell J.; Hoye, Thomas R. Blue-Emitting Arylalkynyl Naphthalene Derivatives via a Hexadehydro-Diels-Alder Cascade Reaction. Journal of the American Chemical Society, 2016, 138, 12739-12742 |
| 4130868 | CIF | C60 H68 N28 O34 | P 21 21 21 | 16.931; 18.21; 25.511 90; 90; 90 | 7865 | Lazar, Alexandra I.; Biedermann, Frank; Mustafina, Kamila R.; Assaf, Khaleel I.; Hennig, Andreas; Nau, Werner M. Nanomolar Binding of Steroids to Cucurbit[n]urils: Selectivity and Applications. Journal of the American Chemical Society, 2016, 138, 13022-13029 |
| 4130869 | CIF | C28 H14 B2 N2 O8 S2 | P 1 n 1 | 7.2433; 20.504; 27.708 90; 90; 90 | 4115.1 | Carrillo, Josue Ayuso; Turner, Michael L.; Ingleson, Michael J. A General Protocol for the Polycondensation of Thienyl N-Methyliminodiacetic Acid Boronate Esters To Form High Molecular Weight Copolymers. Journal of the American Chemical Society, 2016, 138, 13361-13368 |
| 4130870 | CIF | C44 H69 B2 N3 O8 S2 | P -1 | 8.286; 10.6177; 28.689 82.158; 83.815; 69.036 | 2330.15 | Carrillo, Josue Ayuso; Turner, Michael L.; Ingleson, Michael J. A General Protocol for the Polycondensation of Thienyl N-Methyliminodiacetic Acid Boronate Esters To Form High Molecular Weight Copolymers. Journal of the American Chemical Society, 2016, 138, 13361-13368 |
| 4130871 | CIF | C54 H68 B4 Cl4 O8 | P 1 21/n 1 | 6.7782; 34.87; 12.1646 90; 100.344; 90 | 2828.4 | Huang, Ze-Ao; Chen, Chen; Yang, Xiao-Di; Fan, Xiang-Bing; Zhou, Wen; Tung, Chen-Ho; Wu, Li-Zhu; Cong, Huan Synthesis of Oligoparaphenylene-Derived Nanohoops Employing an Anthracene Photodimerization-Cycloreversion Strategy. Journal of the American Chemical Society, 2016, 138, 11144-11147 |
| 4130872 | CIF | C100 H64 | P -1 | 16.5652; 17.2511; 19.2794 68.221; 79.126; 74.271 | 4900.6 | Huang, Ze-Ao; Chen, Chen; Yang, Xiao-Di; Fan, Xiang-Bing; Zhou, Wen; Tung, Chen-Ho; Wu, Li-Zhu; Cong, Huan Synthesis of Oligoparaphenylene-Derived Nanohoops Employing an Anthracene Photodimerization-Cycloreversion Strategy. Journal of the American Chemical Society, 2016, 138, 11144-11147 |
| 4130873 | CIF | C52 H47 N4 O Rh S2 | P 1 21/n 1 | 11.6759; 23.0296; 16.4573 90; 92.66; 90 | 4420.5 | Huang, Xiaoqiang; Webster, Richard D.; Harms, Klaus; Meggers, Eric Asymmetric Catalysis with Organic Azides and Diazo Compounds Initiated by Photoinduced Electron Transfer. Journal of the American Chemical Society, 2016, 138, 12636-12642 |
| 4130874 | CIF | C22 H21 Br N2 O3 | P 21 21 21 | 9.8543; 13.1873; 15.4684 90; 90; 90 | 2010.14 | Huang, Xiaoqiang; Webster, Richard D.; Harms, Klaus; Meggers, Eric Asymmetric Catalysis with Organic Azides and Diazo Compounds Initiated by Photoinduced Electron Transfer. Journal of the American Chemical Society, 2016, 138, 12636-12642 |
| 4130875 | CIF | C32 H40 Cl2 Ir2 N4 O5 | C 1 c 1 | 33.1646; 16.8051; 16.116 90; 102.709; 90 | 8761.9 | Sharninghausen, Liam S.; Sinha, Shashi Bhushan; Shopov, Dimitar Y.; Choi, Bonnie; Mercado, Brandon Q.; Roy, Xavier; Balcells, David; Brudvig, Gary W.; Crabtree, Robert H. High Oxidation State Iridium Mono-μ-oxo Dimers Related to Water Oxidation Catalysis. Journal of the American Chemical Society, 2016, 138, 15917-15926 |
| 4130876 | CIF | C32 H40 Cl2 Ir2 N4 O5 | C 1 2/c 1 | 22.2543; 8.3385; 18.2152 90; 98.991; 90 | 3338.6 | Sharninghausen, Liam S.; Sinha, Shashi Bhushan; Shopov, Dimitar Y.; Choi, Bonnie; Mercado, Brandon Q.; Roy, Xavier; Balcells, David; Brudvig, Gary W.; Crabtree, Robert H. High Oxidation State Iridium Mono-μ-oxo Dimers Related to Water Oxidation Catalysis. Journal of the American Chemical Society, 2016, 138, 15917-15926 |
| 4130877 | CIF | C32 H40 Cl2 Ir2 N4 O5 | P -1 | 10.8298; 12.6652; 15.9733 69.833; 89.721; 67.888 | 1885.6 | Sharninghausen, Liam S.; Sinha, Shashi Bhushan; Shopov, Dimitar Y.; Choi, Bonnie; Mercado, Brandon Q.; Roy, Xavier; Balcells, David; Brudvig, Gary W.; Crabtree, Robert H. High Oxidation State Iridium Mono-μ-oxo Dimers Related to Water Oxidation Catalysis. Journal of the American Chemical Society, 2016, 138, 15917-15926 |
| 4130878 | CIF | C38 H36 Au F2 N | P 1 21/c 1 | 17.69275; 12.14541; 15.50402 90; 114.032; 90 | 3042.8 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130879 | CIF | C34.83 H39.33 Au Cl2.33 F N | I 41/a :2 | 31.0475; 31.0475; 41.4313 90; 90; 90 | 39937.6 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130880 | CIF | C12 H9 Au F3 N | P b c a | 7.45956; 16.6803; 16.8248 90; 90; 90 | 2093.47 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130881 | CIF | C15.5 H17 Au Cl F2 N O3 | C 1 2/c 1 | 13.7561; 16.1; 14.8396 90; 101.209; 90 | 3223.88 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130882 | CIF | C47 H58 Au N | P 1 21/a 1 | 18.8532; 10.5063; 19.8505 90; 93.844; 90 | 3923.1 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130883 | CIF | C24 H15 Au F11 N O3 | P n a 21 | 21.1376; 16.4885; 7.53055 90; 90; 90 | 2624.6 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130884 | CIF | C20 H12 Au Br F7 N | P -1 | 9.0882; 9.6379; 13.1489 76.8345; 74.7697; 64.6373 | 995.36 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130885 | CIF | C12 H9 Au Cl2 F N | P b c a | 7.8063; 17.0746; 17.892 90; 90; 90 | 2384.81 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130886 | CIF | C20 H12 Au F8 N | P n a 21 | 15.4933; 26.3923; 4.40199 90; 90; 90 | 1799.99 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130887 | CIF | C26 H14 Au F10 N | P 1 21/c 1 | 7.3719; 18.1864; 17.5332 90; 93.3304; 90 | 2346.68 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130888 | CIF | C15 H16 Au Cl2 N O3 | P -1 | 7.4578; 11.0845; 19.2172 84.5978; 89.4342; 87.8411 | 1580.4 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130889 | CIF | C19 H12 Au F6 N | P 1 21/n 1 | 10.2954; 9.799; 17.9311 90; 104.827; 90 | 1748.74 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130890 | CIF | C13 H12 Au F2 N | P 1 21/c 1 | 7.5121; 18.0598; 17.0484 90; 99.554; 90 | 2280.82 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
| 4130891 | CIF | C71 H106 Ge N2 Si2 | R -3 :H | 37.7343; 37.7343; 25.323 90; 90; 120 | 31226 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
| 4130892 | CIF | C83 H117 Ge N2 Si2 | P -1 | 15.9617; 16.6009; 17.9948 114.148; 112.883; 96.575 | 3790.4 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
| 4130893 | CIF | C77 H108 Ge N2 Si2 | P -1 | 11.4319; 14.6466; 21.5014 100.512; 92.045; 95.265 | 3519.7 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
| 4130894 | CIF | C76.25 H115 Ge N2 Si2 | P 1 21/n 1 | 12.6352; 23.8472; 25.5287 90; 101.535; 90 | 7536.8 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
| 4130895 | CIF | C74.5 H107 Ge N3 Si2 | P 1 21/n 1 | 12.7844; 22.7467; 23.418 90; 94.49; 90 | 6789.1 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
| 4130896 | CIF | C81 H127 Ge N3 Si2 | P 1 21/n 1 | 13.255; 25.4218; 23.768 90; 101.111; 90 | 7858.9 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
| 4130897 | CIF | C146 H112 Cl18 N8 O8 | I -4 | 28.178; 28.178; 8.7335 90; 90; 90 | 6934 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
| 4130898 | CIF | C16 H7 N O3 | P -1 | 7.2916; 8.7529; 9.7443 88.49; 69.51; 67.04 | 532 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
| 4130899 | CIF | C176.75 H189 Cl4.5 N8 O8 Zn | C 1 2/c 1 | 29.19; 28.114; 42.68 90; 102.19; 90 | 34236 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
| 4130900 | CIF | C21 H21 Cl2 N3 O2 | P 1 21 1 | 7.1366; 12.004; 11.688 90; 102.43; 90 | 977.8 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
| 4130901 | CIF | C18 H12 Br F2 N O2 | P 1 21 1 | 7.2467; 12.0275; 9.5303 90; 109.102; 90 | 784.92 | Huang, Yinhua; Hayashi, Tamio Rhodium-Catalyzed Asymmetric Arylation/Defluorination of 1-(Trifluoromethyl)alkenes Forming Enantioenriched 1,1-Difluoroalkenes. Journal of the American Chemical Society, 2016, 138, 12340-12343 |
| 4130902 | CIF | C108 H156 K2 O16 Si2 | P 1 21/c 1 | 14.2971; 31.786; 13.0756 90; 94.512; 90 | 5923.8 | Rudebusch, Gabriel E.; Espejo, Guzmán L; Zafra, José L; Peña-Alvarez, Miriam; Spisak, Sarah N.; Fukuda, Kotaro; Wei, Zheng; Nakano, Masayoshi; Petrukhina, Marina A.; Casado, Juan; Haley, Michael M. A Biradical Balancing Act: Redox Amphoterism in a Diindenoanthracene Derivative Results from Quinoidal Acceptor and Aromatic Donor Motifs. Journal of the American Chemical Society, 2016, 138, 12648-12654 |
| 4130903 | CIF | C88 H120 K2 O8 Si2 | P -1 | 9.169; 15.4719; 17.6353 66.24; 84.584; 81.803 | 2264.45 | Rudebusch, Gabriel E.; Espejo, Guzmán L; Zafra, José L; Peña-Alvarez, Miriam; Spisak, Sarah N.; Fukuda, Kotaro; Wei, Zheng; Nakano, Masayoshi; Petrukhina, Marina A.; Casado, Juan; Haley, Michael M. A Biradical Balancing Act: Redox Amphoterism in a Diindenoanthracene Derivative Results from Quinoidal Acceptor and Aromatic Donor Motifs. Journal of the American Chemical Society, 2016, 138, 12648-12654 |
| 4130904 | CIF | C88 H116 K O8 Si2 | P -1 | 11.5995; 12.1738; 17.0652 78.478; 82.51; 72.257 | 2242.66 | Rudebusch, Gabriel E.; Espejo, Guzmán L; Zafra, José L; Peña-Alvarez, Miriam; Spisak, Sarah N.; Fukuda, Kotaro; Wei, Zheng; Nakano, Masayoshi; Petrukhina, Marina A.; Casado, Juan; Haley, Michael M. A Biradical Balancing Act: Redox Amphoterism in a Diindenoanthracene Derivative Results from Quinoidal Acceptor and Aromatic Donor Motifs. Journal of the American Chemical Society, 2016, 138, 12648-12654 |
| 4130905 | CIF | C24 H15 B F5 N | P 1 21/c 1 | 13.8288; 8.7441; 17.122 90; 111.064; 90 | 1932.05 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130906 | CIF | C24 H10 B F10 N | P 1 21/n 1 | 9.7376; 16.5554; 12.6822 90; 101.085; 90 | 2006.35 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130907 | CIF | C60 H28 B2 F36 N2 | P -1 | 8.8041; 16.8557; 20.7579 78.709; 79.587; 82.468 | 2956.43 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130908 | CIF | C27 H32 B N | P b c n | 31.316; 8.2742; 16.832 90; 90; 90 | 4361.4 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130909 | CIF | C42 H56 B N | P 1 21/c 1 | 11.275; 18.5252; 17.7958 90; 98.066; 90 | 3680.3 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130910 | CIF | C24 H20 B N | P 1 21/c 1 | 12.4542; 15.7598; 9.765 90; 107.055; 90 | 1832.35 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130911 | CIF | C30 H14 B F18 N | P -1 | 10.8184; 11.8123; 12.9256 76.622; 67.526; 70.094 | 1425.35 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
| 4130912 | CIF | C30 H18 Cl2 In3 N9 O17 Zn2 | P 63/m m c | 13.81; 13.81; 18.33 90; 90; 120 | 3027 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130913 | CIF | C30 H18 Cl2 In3 N9 Ni2 O17 | P 63/m m c | 13.8618; 13.8618; 18.5079 90; 90; 120 | 3079.8 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130914 | CIF | C30 H18 Fe4 Mg N9 O19 | P 63/m m c | 13.857; 13.857; 17.925 90; 90; 120 | 2981 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130915 | CIF | C30 H18 Cl3 In5 N9 O16 | P 63/m m c | 13.873; 13.873; 18.455 90; 90; 120 | 3076 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130916 | CIF | C30 H18 Cl3 In3 Mn2 N9 O16 | P 63/m m c | 14.0529; 14.0529; 18.4071 90; 90; 120 | 3148.1 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130917 | CIF | C30 H18 Cl2 Co2 In3 N9 O17 | P 63/m m c | 13.905; 13.905; 18.4663 90; 90; 120 | 3092.1 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130918 | CIF | C30 H18 Cl3 Co2 In3 N12 O16 | P 63/m m c | 13.9818; 13.9818; 18.3209 90; 90; 120 | 3101.73 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130920 | CIF | C30 H24 Cl2 Co2 In3 N15 O17 | P 63/m m c | 14.1065; 14.1065; 18.2678 90; 90; 120 | 3148.2 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130921 | CIF | C30 H16 Cl2 Co2 In3 N9 O20 | P 63/m m c | 13.893; 13.893; 18.368 90; 90; 120 | 3070 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130922 | CIF | C30 H6 Cl2 Co2 In3 N12 O20 | P 63/m m c | 13.9738; 13.9738; 18.373 90; 90; 120 | 3107 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130923 | CIF | C30 H6 Cl2 Co2 In3 N9 O23 | P 63/m m c | 13.804; 13.804; 18.435 90; 90; 120 | 3042.2 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130924 | CIF | C42 H6 Cl4 Co2 In3 N9 O16 | P -3 1 c | 13.8392; 13.8392; 23.269 90; 90; 120 | 3859.5 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130925 | CIF | C30 H18 Ag3 In3 N9 O13 | P 63/m m c | 15.727; 15.727; 16.957 90; 90; 120 | 3632.2 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130926 | CIF | C30 H6 Cu3 Fe3 N9 O20 | P 63/m m c | 15.7672; 15.7672; 16.6814 90; 90; 120 | 3591.5 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130927 | CIF | C21 H9 Ag In3 N3 O16 | P -6 2 c | 13.636; 13.636; 14.9222 90; 90; 120 | 2402.9 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130928 | CIF | C21 H9 Cu Mg3 N3 O16 | P -6 2 c | 13.1696; 13.1696; 14.7973 90; 90; 120 | 2222.6 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
| 4130929 | CIF | C38 H79 Ce Li N4 O5 Si3 | P -1 | 11.745; 12.572; 18.886 85.344; 78.547; 63 | 2435.1 | Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction. Journal of the American Chemical Society, 2016, 138, 12743-12746 |
| 4130930 | CIF | C71 H154 Ce2 Li2 N10 O14 Si6 | C 1 2/c 1 | 37.342; 11.365; 22.312 90; 99.875; 90 | 9329 | Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction. Journal of the American Chemical Society, 2016, 138, 12743-12746 |
| 4130931 | CIF | C30 H72 Ce N4 O Si4 | P 1 21/n 1 | 11.8041; 20.3061; 17.3715 90; 93.916; 90 | 4154.1 | Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction. Journal of the American Chemical Society, 2016, 138, 12743-12746 |
| 4130932 | CIF | C65 H68 B D4 F24 P2 Rh | P 1 21/n 1 | 19.0579; 17.9828; 19.5453 90; 91.7138; 90 | 6695.46 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
| 4130933 | CIF | C65 H68 B D4 F24 P2 Rh | P 1 21/n 1 | 19.0579; 17.9828; 19.5453 90; 91.7138; 90 | 6695.46 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
| 4130934 | CIF | C65 H64 B D8 F24 P2 Rh | P 1 21/n 1 | 19.0579; 17.9828; 19.5453 90; 91.7138; 90 | 6695.46 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
| 4130935 | CIF | C65 H72 B F24 P2 Rh | P 1 21/c 1 | 19.1; 18.289; 27.926 90; 134.55; 90 | 6952 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
| 4130936 | CIF | C65 H70 B F24 P2 Rh | P -1 | 12.8281; 13.1804; 19.8019 93.895; 91.116; 94.19 | 3330.4 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
| 4130937 | CIF | C51 H34 F3 N2 O3 P Pd S | P 21 21 21 | 12.5207; 18.3664; 20.2423 90; 90; 90 | 4654.9 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
| 4130938 | CIF | C22.5 H17 Br Cl N2 | P 41 21 2 | 9.591; 9.591; 43.0251 90; 90; 90 | 3957.76 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
| 4130939 | CIF | C25 H17 Br0.5 N P0.5 Pd0.5 | P 1 | 11.1433; 11.3328; 20.944 85.41; 76.594; 63.661 | 2304.95 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
| 4130940 | CIF | C51 H38 Cl2 Cu F6 N4 P | P 21 21 21 | 13.455; 14.1052; 23.7803 90; 90; 90 | 4513.2 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
| 4130941 | CIF | C7 H18 Cl4 Cu N2 | P n a 21 | 14.2729; 7.7016; 12.3179 90; 90; 90 | 1354.03 | Su, Lebin; Dong, Jianyu; Liu, Long; Sun, Mengli; Qiu, Renhua; Zhou, Yongbo; Yin, Shuang-Feng Copper Catalysis for Selective Heterocoupling of Terminal Alkynes. Journal of the American Chemical Society, 2016, 138, 12348-12351 |
| 4130942 | CIF | C14 H10 F6 I2 O7 S2 | P 1 21/n 1 | 21.9618; 9.3625; 22.1686 90; 108.081; 90 | 4333.2 | 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 |
| 4130943 | CIF | C10 H7 F4 I O4 | P -1 | 4.1971; 10.0492; 14.9871 108.6; 93.4806; 93.8251 | 595.52 | 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 |
| 4130944 | CIF | C10 H9 B F5 I O4 | P -1 | 5.4807; 9.086; 14.021 78.903; 81.424; 89.698 | 677.3 | 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 |
| 4130945 | CIF | C10 H9 F2 I O4 | P 1 21/n 1 | 4.7135; 14.0456; 17.2837 90; 97.432; 90 | 1134.64 | 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 |
| 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 |
| 4130947 | CIF | C9 H8 F3 I O5 S | P 1 21/c 1 | 10.4843; 18.257; 7.1821 90; 105.714; 90 | 1323.4 | 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 |
| 4130948 | CIF | C26 H49 N2 Si2 Ti | P 1 21/n 1 | 10.013; 10.1635; 27.9932 90; 96.198; 90 | 2832.1 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130949 | CIF | C26 H49 Cl N2 Si2 Ti | P 1 21/n 1 | 9.354; 34.1029; 9.8695 90; 112.423; 90 | 2910.32 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130950 | CIF | C35 H57 Cr N O3 Si3 Ti | P 1 21/n 1 | 16.947; 25.011; 18.486 90; 103.507; 90 | 7619 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130951 | CIF | C39 H55 Cl Cr O3 Si2 Ti | P -1 | 9.1532; 12.5803; 17.0067 83.424; 81.854; 87.114 | 1924.6 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130952 | CIF | C40 H52 Cr2 O6 Si2 Ti | P -1 | 11.3506; 11.4109; 19.1965 90.264; 92.62; 111.119 | 2316.33 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130953 | CIF | C37 H57 Cr O3 Si2 Ti | P -1 | 10.3627; 12.2002; 17.5696 70.851; 86.046; 65.795 | 1908.34 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130954 | CIF | C37 H57 Cl Cr O3 Si2 Zr | C 1 2/c 1 | 39.623; 12.6771; 17.4694 90; 108.997; 90 | 8297 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
| 4130955 | CIF | C29 H33 Cu N5 O7 | R 3 2 :H | 18.3847; 18.3847; 48.568 90; 90; 120 | 14216.5 | Benson, Oguarabau; da Silva, Ivan; Argent, Stephen P.; Cabot, Rafel; Savage, Mathew; Godfrey, Harry G. W.; Yan, Yong; Parker, Stewart F.; Manuel, Pascal; Lennox, Matthew J.; Mitra, Tamoghna; Easun, Timothy L.; Lewis, William; Blake, Alexander J.; Besley, Elena; Yang, Sihai; Schröder, Martin Amides Do Not Always Work: Observation of Guest Binding in an Amide-Functionalized Porous Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 14828-14831 |
| 4130956 | CIF | C22 H15 N O | P -1 | 8.8713; 9.1631; 11.2812 83.142; 78.687; 71.594 | 851.58 | Pearson, Ryan M.; Lim, Chern-Hooi; McCarthy, Blaine G.; Musgrave, Charles B.; Miyake, Garret M. Organocatalyzed Atom Transfer Radical Polymerization Using N-Aryl Phenoxazines as Photoredox Catalysts. Journal of the American Chemical Society, 2016, 138, 11399-11407 |
| 4130957 | CIF | C22 H15 N S | P 1 21/n 1 | 14.79; 6.904; 17.265 90; 113.094; 90 | 1621.7 | Pearson, Ryan M.; Lim, Chern-Hooi; McCarthy, Blaine G.; Musgrave, Charles B.; Miyake, Garret M. Organocatalyzed Atom Transfer Radical Polymerization Using N-Aryl Phenoxazines as Photoredox Catalysts. Journal of the American Chemical Society, 2016, 138, 11399-11407 |
| 4130958 | CIF | C60 H89 K N2 Ni O7 S | P -1 | 12.668; 13.37; 20.68 80.951; 88.335; 62.771 | 3072 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Reactivity of a Nickel Sulfide with Carbon Monoxide and Nitric Oxide. Journal of the American Chemical Society, 2016, 138, 12352-12355 |
| 4130959 | CIF | C35 H53 N3 Ni O | C 1 2/c 1 | 16.8321; 9.37; 22.5816 90; 106.526; 90 | 3414.4 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Reactivity of a Nickel Sulfide with Carbon Monoxide and Nitric Oxide. Journal of the American Chemical Society, 2016, 138, 12352-12355 |
| 4130960 | CIF | C13 H26 Cl2 K N O7 S2 | P 1 21/n 1 | 9.4771; 14.0478; 16.771 90; 98.978; 90 | 2205.4 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Reactivity of a Nickel Sulfide with Carbon Monoxide and Nitric Oxide. Journal of the American Chemical Society, 2016, 138, 12352-12355 |
| 4130961 | CIF | C21 H19 N O7 S | P 1 21/c 1 | 8.8855; 17.9963; 13.146 90; 105.177; 90 | 2028.8 | Shen, Tao; Zhang, Yiqun; Liang, Yu-Feng; Jiao, Ning Direct Tryptophols Synthesis from 2-Vinylanilines and Alkynes via C≡C Triple Bond Cleavage and Dioxygen Activation. Journal of the American Chemical Society, 2016, 138, 13147-13150 |
| 4130962 | CIF | C21 H21 N O7 S | P 1 21/n 1 | 11.7697; 14.8198; 13.0749 90; 107.482; 90 | 2175.25 | Shen, Tao; Zhang, Yiqun; Liang, Yu-Feng; Jiao, Ning Direct Tryptophols Synthesis from 2-Vinylanilines and Alkynes via C≡C Triple Bond Cleavage and Dioxygen Activation. Journal of the American Chemical Society, 2016, 138, 13147-13150 |
| 4130963 | CIF | C91.5 H91.5 N0 | C 1 2/c 1 | 47.8736; 19.1675; 16.5421 90; 97.306; 90 | 15056.1 | Lu, Xuefeng; Lee, Sangsu; Kim, Jun Oh; Gopalakrishna, Tullimilli Y.; Phan, Hoa; Herng, Tun Seng; Lim, Zhenglong; Zeng, Zebing; Ding, Jun; Kim, Dongho; Wu, Jishan Stable 3,6-Linked Fluorenyl Radical Oligomers with Intramolecular Antiferromagnetic Coupling and Polyradical Characters. Journal of the American Chemical Society, 2016, 138, 13048-13058 |
| 4130964 | CIF | C102 H96 | C 1 2/c 1 | 53.095; 10.224; 35.66 90; 109.528; 90 | 18244 | Lu, Xuefeng; Lee, Sangsu; Kim, Jun Oh; Gopalakrishna, Tullimilli Y.; Phan, Hoa; Herng, Tun Seng; Lim, Zhenglong; Zeng, Zebing; Ding, Jun; Kim, Dongho; Wu, Jishan Stable 3,6-Linked Fluorenyl Radical Oligomers with Intramolecular Antiferromagnetic Coupling and Polyradical Characters. Journal of the American Chemical Society, 2016, 138, 13048-13058 |
| 4130965 | CIF | C30 H46 B2 Cl4 F N O7 S | C 1 2/m 1 | 33.5416; 7.4594; 15.8608 90; 106.7; 90 | 3801 | Davis, Holly J.; Mihai, Madalina T.; Phipps, Robert J. Ion Pair-Directed Regiocontrol in Transition-Metal Catalysis: A Meta-Selective C-H Borylation of Aromatic Quaternary Ammonium Salts. Journal of the American Chemical Society, 2016, 138, 12759-12762 |
| 4130966 | CIF | C94 H68 O32 Zr6 | F d -3 m :2 | 44.856; 44.856; 44.856 90; 90; 90 | 90253 | Alezi, Dalal; Spanopoulos, Ioannis; Tsangarakis, Constantinos; Shkurenko, Aleksander; Adil, Karim; Belmabkhout, Youssef; O Keeffe, Michael; Eddaoudi, Mohamed; Trikalitis, Pantelis N. Reticular Chemistry at Its Best: Directed Assembly of Hexagonal Building Units into the Awaited Metal-Organic Framework with the Intricate Polybenzene Topology, pbz-MOF. Journal of the American Chemical Society, 2016, 138, 12767-12770 |
| 4130967 | CIF | C18 H33 Li3 O3 | P -1 | 10.3259; 10.7672; 10.8895 102.936; 115.2; 99.243 | 1021.7 | Guang, Jie; Liu, Qiyong; Hopson, Russell; Kagan, Gerald; Li, Weibin; Monroe, Thomas B.; Williard, Paul G. Conformational Polymorphism of Lithium Pinacolone Enolate. Journal of the American Chemical Society, 2016, 138, 15177-15188 |
| 4130968 | CIF | C64 H48 B Cl2 F24 Ir N2 O2 | P -1 | 12.6934; 16.405; 17.556 62.79; 82.644; 89.71 | 3218.5 | Park, Yoonsu; Heo, Joon; Baik, Mu-Hyun; Chang, Sukbok Why is the Ir(III)-Mediated Amido Transfer Much Faster Than the Rh(III)-Mediated Reaction? A Combined Experimental and Computational Study. Journal of the American Chemical Society, 2016, 138, 14020-14029 |
| 4130969 | CIF | C41 H67 N5 O8 | P -1 | 12.826; 16.245; 21.953 89.214; 89.3; 89.609 | 4573 | Shin, Seonho; Lee, Mihye; Guzei, Ilia A.; Kang, Young Kee; Choi, Soo Hyuk 12/10-Helical β-Peptide with Dynamic Folding Propensity: Coexistence of Right- and Left-Handed Helices in an Enantiomeric Foldamer. Journal of the American Chemical Society, 2016, 138, 13390-13395 |
| 4130970 | CIF | C44.5 H76.5 N6 O7 | P 21 21 21 | 9.727; 17.75; 25.98 90; 90; 90 | 4485.6 | Shin, Seonho; Lee, Mihye; Guzei, Ilia A.; Kang, Young Kee; Choi, Soo Hyuk 12/10-Helical β-Peptide with Dynamic Folding Propensity: Coexistence of Right- and Left-Handed Helices in an Enantiomeric Foldamer. Journal of the American Chemical Society, 2016, 138, 13390-13395 |
| 4130971 | CIF | C44 H74 N6 O7 | P 1 21 1 | 11.5874; 23.587; 16.789 90; 93.663; 90 | 4579.3 | Shin, Seonho; Lee, Mihye; Guzei, Ilia A.; Kang, Young Kee; Choi, Soo Hyuk 12/10-Helical β-Peptide with Dynamic Folding Propensity: Coexistence of Right- and Left-Handed Helices in an Enantiomeric Foldamer. Journal of the American Chemical Society, 2016, 138, 13390-13395 |
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