Crystallography Open Database
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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 136
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4120624 | CIF | C28 H30 N2 O3 | P 1 21 1 | 8.306; 6.569; 21.01 90; 100.631; 90 | 1126.7 | Lee, Kiyoun; Boger, Dale L. Total Syntheses of (-)-Kopsifoline D and (-)-Deoxoapodine: Divergent Total Synthesis via Late-Stage Key Strategic Bond Formation. Journal of the American Chemical Society, 2014, 136, 3312 |
| 4120625 | CIF | C28 H30 N2 O2 S | P 21 21 21 | 6.6931; 18.67; 18.714 90; 90; 90 | 2338.5 | Lee, Kiyoun; Boger, Dale L. Total Syntheses of (-)-Kopsifoline D and (-)-Deoxoapodine: Divergent Total Synthesis via Late-Stage Key Strategic Bond Formation. Journal of the American Chemical Society, 2014, 136, 3312 |
| 4120626 | CIF | C20 H0 N2 O4 | P 21 21 21 | 7.7075; 12.7478; 25.5515 90; 90; 90 | 2510.53 | Lee, Kiyoun; Boger, Dale L. Total Syntheses of (-)-Kopsifoline D and (-)-Deoxoapodine: Divergent Total Synthesis via Late-Stage Key Strategic Bond Formation. Journal of the American Chemical Society, 2014, 136, 3312 |
| 4120627 | CIF | C27 H23 N2 O3 S | P 1 21 1 | 9.7575; 10.35; 11.999 90; 111.993; 90 | 1123.6 | Gawade, Sagar Ashok; Huple, Deepak B.; Liu, Rai-Shung Zn(II)- or Ag(I)-Catalyzed 1,4-Metathesis Reactions between 3-En-1-ynamides and Nitrosoarenes. Journal of the American Chemical Society, 2014, 136, 2978 |
| 4120628 | CIF | C37 H59.5 N3.5 Nb O0.5 | P -1 | 10.4594; 11.0607; 18.1995 77.313; 85.045; 63.691 | 1841.2 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120629 | CIF | C36 H59 N6 Nb Si | P -1 | 12.5538; 16.438; 19.6288 89.171; 80.656; 88.005 | 3994.3 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120630 | CIF | C37 H59 N6 Nb | P c a 21 | 24.042; 18.1865; 17.3262 90; 90; 90 | 7575.7 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120631 | CIF | C37 H59 N4 Nb | P 1 21/n 1 | 12.7024; 21.4305; 13.6706 90; 93.776; 90 | 3713.3 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120632 | CIF | C37 H59 N4 Nb | P -1 | 11.1687; 17.714; 19.7346 105.313; 102.083; 98.673 | 3593.3 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120633 | CIF | C45 H67 N4 Nb | P 1 21/c 1 | 11.4761; 17.2593; 21.9265 90; 94.514; 90 | 4329.5 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120634 | CIF | C45 H67 N4 Nb | P 1 21/n 1 | 12.1424; 22.102; 15.9149 90; 92.287; 90 | 4267.7 | Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society, 2014, 136, 2994 |
| 4120635 | CIF | C37.5 H34 B F10 P | P 1 21/c 1 | 8.5881; 20.1695; 19.1928 90; 92.38; 90 | 3321.66 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120636 | CIF | C22 H29 P | P -1 | 11.3351; 11.4675; 17.6404 87.588; 77.145; 61.359 | 1956.39 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120637 | CIF | C44.5 H44 B F10 P | P 1 21/n 1 | 14.7877; 14.8191; 18.9752 90; 92.799; 90 | 4153.3 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120638 | CIF | C34 H30 B F10 O P | P -1 | 10.2513; 10.7475; 14.2965 91.802; 101.483; 93.419 | 1539.34 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120639 | CIF | C36 H22 B F10 Fe P | P 1 21 1 | 11.0386; 10.5787; 13.2111 90; 95.315; 90 | 1536.08 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120640 | CIF | C34 H41 Fe O3 P | P 21 21 21 | 11.3753; 14.52; 17.6399 90; 90; 90 | 2913.57 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120641 | CIF | C29 H31 Fe O P | P 1 21 1 | 7.88; 9.68; 16.237 90; 101.258; 90 | 1214.7 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120642 | CIF | C30 H33 Fe P | P 21 21 21 | 10.092; 15.3552; 16.1914 90; 90; 90 | 2509.1 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120643 | CIF | C47 H46 B F10 Fe P | P 21 21 21 | 8.8458; 20.3854; 24.0753 90; 90; 90 | 4341.38 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120644 | CIF | C47 H39 B F10 Fe N P | P 21 21 21 | 8.8713; 9.5648; 49.7807 90; 90; 90 | 4224 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120645 | CIF | C47 H43 B F10 Fe N P | P 21 21 21 | 9.9126; 26.8254; 49.04 90; 90; 90 | 13040.2 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120646 | CIF | C58 H50 B F10 Fe P | P 21 21 21 | 11.5309; 18.6255; 23.0996 90; 90; 90 | 4961.07 | Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society, 2014, 136, 3293 |
| 4120647 | CIF | C38 H40 N4 | P 1 21/c 1 | 10.8786; 12.5301; 22.1389 90; 98.988; 90 | 2980.7 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120648 | CIF | C44 H45 Cl F10 N6 | P 1 21/c 1 | 19.9123; 11.0521; 19.7629 90; 103.857; 90 | 4222.7 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120649 | CIF | C38 H36 N8 O8 | C 1 2/c 1 | 40.8091; 10.2663; 19.3106 90; 117.971; 90 | 7145.3 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120650 | CIF | C42 H42 N10 O8 | P 1 21/n 1 | 12.455; 12.1362; 13.8791 90; 104.608; 90 | 2030.1 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120651 | CIF | C15 H15 N3 | F d d 2 | 26.445; 29.271; 6.4052 90; 90; 90 | 4958.1 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120652 | CIF | C16 H15 Br N2 | P 1 21/c 1 | 15.485; 17.588; 10.7656 90; 109.139; 90 | 2769.9 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120653 | CIF | C56 H77 Br N8 O4 | C 1 2/c 1 | 21.282; 17.2226; 15.5673 90; 108.712; 90 | 5404.3 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120654 | CIF | C42 H44 Br2 N6 | P -1 | 10.9585; 11.1069; 16.6867 78.438; 77.178; 75.91 | 1897.6 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120655 | CIF | C39.8 H33.6 Cl3.6 F10 N4 | C 1 2/c 1 | 17.3174; 11.0464; 20.6877 90; 101.035; 90 | 3884.3 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120656 | CIF | C42 H36 F10 N6 | P 1 21/n 1 | 11.8894; 11.8311; 14.1611 90; 103.366; 90 | 1938 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120657 | CIF | C16 H14 N4 O4 | P 1 21/c 1 | 10.6399; 24.5713; 11.5358 90; 92.741; 90 | 3012.4 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120658 | CIF | C44 H41 Br F10 N6 | P 1 21/c 1 | 19.684; 11.1411; 19.52 90; 99.53; 90 | 4221.7 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120659 | CIF | C44 H51 Br N10 O8 | P 1 | 10.0512; 10.709; 11.1899 109.207; 102.04; 93.042 | 1102.7 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120660 | CIF | C46 H56 N4 O4 | P 1 21/c 1 | 10.4344; 28.1432; 13.8084 90; 90.98; 90 | 4054.3 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120661 | CIF | C46 H59 Cl N6 O2 | P -1 | 14.492; 15.192; 20.462 84.139; 71.702; 85.832 | 4250.9 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120662 | CIF | C44 H53 Br2 Cl N6 | P 1 21/n 1 | 12.4523; 19.2145; 17.6399 90; 93.479; 90 | 4212.8 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120663 | CIF | C45 H54 Cl N9 O9 | P 1 21/n 1 | 10.7531; 19.8526; 21.1338 90; 96.105; 90 | 4486 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120664 | CIF | C44 H45 F10 I N6 | P 1 21/c 1 | 19.646; 11.2296; 19.645 90; 99.022; 90 | 4280.4 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120665 | CIF | C40 H41 Br2 N5 | P 1 21/n 1 | 12.2705; 10.5841; 27.6226 90; 93.39; 90 | 3581.1 | Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society, 2014, 136, 3208 |
| 4120666 | CIF | C130 H192 Cl2 N43.67 O61.1 P2 Pd6 Pt Si2 | P n m a | 22.628; 22.198; 41.504 90; 90; 90 | 20847 | Kohyama, Yuh; Murase, Takashi; Fujita, Makoto Metal-Organic Proximity in a Synthetic Pocket. Journal of the American Chemical Society, 2014, 136, 2966 |
| 4120667 | CIF | C29 H39 Al Cl2 N2 O2 | P 21 21 21 | 10.136; 10.9801; 25.322 90; 90; 90 | 2818.2 | Pilone, Alessia; Press, Konstantin; Goldberg, Israel; Kol, Moshe; Mazzeo, Mina; Lamberti, Marina Gradient Isotactic Multiblock Polylactides from Aluminum Complexes of Chiral Salalen Ligands. Journal of the American Chemical Society, 2014, 136, 2940 |
| 4120668 | CIF | C146 H168 Cu4 F24 Ir8 N16 O54 S8 | P 1 21/n 1 | 18.26; 20.91; 27.801 90; 93.071; 90 | 10600 | Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society, 2014, 136, 2982 |
| 4120669 | CIF | C192 H348 Cu4 F24 Ir8 N16 O114 S8 | P -4 n 2 | 34.111; 34.111; 22.396 90; 90; 90 | 26059 | Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society, 2014, 136, 2982 |
| 4120670 | CIF | C148 H172 Ag2 Cu4 F30 Ir8 N16 O62 S10 | P b c a | 29.4297; 24.1596; 31.8628 90; 90; 90 | 22654.8 | Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society, 2014, 136, 2982 |
| 4120671 | CIF | C156 H188 F24 Ir8 N20 Ni4 O58 S8 | P 1 21/n 1 | 18.2183; 21.039; 27.5149 90; 92.989; 90 | 10532 | Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society, 2014, 136, 2982 |
| 4120672 | CIF | C162 H206 Ag2 F30 Ir8 N18 O66 S10 Zn4 | P 1 21/n 1 | 15.892; 32.88; 20.486 90; 94.06; 90 | 10678 | Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society, 2014, 136, 2982 |
| 4120673 | CIF | C24 H26 B F4 N5 Pt | P 1 21/n 1 | 14.6099; 7.1043; 22.2579 90; 95.823; 90 | 2298.3 | Krikorian, Markrete; Liu, Shuang; Swager, Timothy M. Columnar Liquid Crystallinity and Mechanochromism in Cationic Platinum(II) Complexes. Journal of the American Chemical Society, 2014, 136, 2952 |
| 4120674 | CIF | C22 H28 B N Si2 | P -1 | 10.1495; 10.3634; 12.2788 92.766; 107.648; 98.821 | 1210 | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society, 2014, 136, 68-71 |
| 4120675 | CIF | C45 H33 B2 F15 N2 Si2 | P -1 | 11.1344; 11.8923; 17.9487 91.256; 98.181; 104.156 | 2277.04 | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society, 2014, 136, 68-71 |
| 4120676 | CIF | C40 H28 B2 F15 N Si2 | P 1 21/c 1 | 21.0316; 14.0496; 14.0809 90; 103.671; 90 | 4042.83 | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society, 2014, 136, 68-71 |
| 4120677 | CIF | C40 H33 B2 F15 Si2 | P -1 | 11.6645; 12.2645; 18.5329 108.563; 96.887; 98.819 | 2443.04 | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society, 2014, 136, 68-71 |
| 4120678 | CIF | C34 H23 B2 F15 Si2 | P -1 | 10.8632; 11.8992; 14.8632 81.215; 84.155; 68.825 | 1768.26 | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society, 2014, 136, 68-71 |
| 4120679 | CIF | C18 H21 O6 P | P 1 | 7.1747; 7.9625; 8.5502 69.509; 84.347; 75.715 | 443.37 | Jang, Ki Po; Hutson, Gerri E.; Johnston, Ryne C.; McCusker, Elizabeth O.; Cheong, Paul H.-Y.; Scheidt, Karl A. Asymmetric Homoenolate Additions to Acyl Phosphonates through Rational Design of a Tailored N-Heterocyclic Carbene Catalyst. Journal of the American Chemical Society, 2014, 136, 76-79 |
| 4120680 | CIF | C32 H58 Ge O4 Si3 W | P 1 21/a 1 | 16.9057; 10.5686; 21.5417 90; 101.02; 90 | 3777.9 | Fukuda, Tetsuya; Hashimoto, Hisako; Tobita, Hiromi Reactions of a Tungsten-Germylyne Complex with α,β-Unsaturated Ketones: Complete Cleavage of the W≡Ge Bond and Formation of Two Types of η(3)-Germoxyallyl Tungsten Complexes. Journal of the American Chemical Society, 2014, 136, 80-83 |
| 4120681 | CIF | C27 H50 Ge O3 Si3 W | P -1 | 8.9578; 9.0925; 21.22 81.533; 78.365; 76.447 | 1636.6 | Fukuda, Tetsuya; Hashimoto, Hisako; Tobita, Hiromi Reactions of a Tungsten-Germylyne Complex with α,β-Unsaturated Ketones: Complete Cleavage of the W≡Ge Bond and Formation of Two Types of η(3)-Germoxyallyl Tungsten Complexes. Journal of the American Chemical Society, 2014, 136, 80-83 |
| 4120682 | CIF | C17 H18 N2 O3 S | P -1 | 9.722; 16.2451; 21.645 98.61; 100.124; 94.125 | 3310.4 | Chuprakov, Stepan; Worrell, Brady T.; Selander, Nicklas; Sit, Rakesh K.; Fokin, Valery V. Stereoselective 1,3-Insertions of Rhodium(II) Azavinyl Carbenes. Journal of the American Chemical Society, 2014, 136, 195-202 |
| 4120683 | CIF | C27 H27 Cl2 N O3 S | P -1 | 10.5744; 10.7434; 12.6461 74.312; 71.548; 79.44 | 1304.51 | Chuprakov, Stepan; Worrell, Brady T.; Selander, Nicklas; Sit, Rakesh K.; Fokin, Valery V. Stereoselective 1,3-Insertions of Rhodium(II) Azavinyl Carbenes. Journal of the American Chemical Society, 2014, 136, 195-202 |
| 4120684 | CIF | C11 H14 N2 O4 S | P 1 21 1 | 5.0497; 9.2653; 13.2307 90; 98.504; 90 | 612.22 | Chuprakov, Stepan; Worrell, Brady T.; Selander, Nicklas; Sit, Rakesh K.; Fokin, Valery V. Stereoselective 1,3-Insertions of Rhodium(II) Azavinyl Carbenes. Journal of the American Chemical Society, 2014, 136, 195-202 |
| 4120685 | CIF | C56 H55 Cl O8 P2 Pd | P 1 21 1 | 11.3703; 18.4887; 13.6456 90; 113.629; 90 | 2628.1 | Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society, 2014, 136, 405-411 |
| 4120686 | CIF | C59 H55 Cl O2 P2 Pd | P 21 21 21 | 9.7484; 19.9815; 25.907 90; 90; 90 | 5046.4 | Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society, 2014, 136, 405-411 |
| 4120687 | CIF | C44 H38 O2 P2 | P 21 21 21 | 7.5337; 17.205; 27.444 90; 90; 90 | 3557.2 | Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society, 2014, 136, 405-411 |
| 4120688 | CIF | C49 H47 Br Cl4 O2 P2 Pd | P 21 21 21 | 9.4609; 21.4594; 22.4518 90; 90; 90 | 4558.3 | Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society, 2014, 136, 405-411 |
| 4120689 | CIF | C58 H54 Cl2 O2 P2 Pd | P 21 21 21 | 9.2918; 20.1508; 25.42 90; 90; 90 | 4759.6 | Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society, 2014, 136, 405-411 |
| 4120690 | CIF | C27 H31 Au N4 O3 S | P 1 21/c 1 | 9.7151; 15.526; 17.882 90; 103.757; 90 | 2619.9 | Ball, Liam T.; Lloyd-Jones, Guy C; Russell, Christopher A. Gold-Catalyzed Oxidative Coupling of Arylsilanes and Arenes: Origin of Selectivity and Improved Precatalyst. Journal of the American Chemical Society, 2014, 136, 254-264 |
| 4120691 | CIF | C4 H8 Au Br3 S | P 1 21/c 1 | 17.133; 7.1093; 17.3925 90; 116.397; 90 | 1897.59 | Ball, Liam T.; Lloyd-Jones, Guy C; Russell, Christopher A. Gold-Catalyzed Oxidative Coupling of Arylsilanes and Arenes: Origin of Selectivity and Improved Precatalyst. Journal of the American Chemical Society, 2014, 136, 254-264 |
| 4120692 | CIF | C96 H108 Au11 P6 | P -1 | 15.493; 17.157; 21.556 82.13; 73.244; 64.983 | 4971 | Chen, Jing; Zhang, Qian-Fan; Bonaccorso, Timary A.; Williard, Paul G.; Wang, Lai-Sheng Controlling gold nanoclusters by diphospine ligands. Journal of the American Chemical Society, 2014, 136, 92-95 |
| 4120693 | CIF | C10 H8 Cu N2 O3 | P 21 21 21 | 4.3886; 13.3722; 15.5729 90; 90; 90 | 913.9 | Zhang, Teng; Wang, Cheng; Liu, Shubin; Wang, Jin-Liang; Lin, Wenbin A biomimetic copper water oxidation catalyst with low overpotential. Journal of the American Chemical Society, 2014, 136, 273-281 |
| 4120694 | CIF | Ba3 Cl O10 P3 | P c a 21 | 14.2771; 5.5968; 14.1592 90; 90; 90 | 1131.41 | Yu, Peng; Wu, Li-Ming; Zhou, Liu-Jiang; Chen, Ling Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). Journal of the American Chemical Society, 2014, 136, 480-487 |
| 4120695 | CIF | Ba3 Br O10 P3 | P 21 21 21 | 7.1722; 11.364; 13.998 90; 90; 90 | 1140.9 | Yu, Peng; Wu, Li-Ming; Zhou, Liu-Jiang; Chen, Ling Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). Journal of the American Chemical Society, 2014, 136, 480-487 |
| 4120696 | CIF | C184 H160 F48 N40 O8 P8 Ru8 | C 1 2/c 1 | 23.329; 18.055; 25.448 90; 114.892; 90 | 9723 | Neudeck, Sven; Maji, Somnath; López, Isidoro; Meyer, Steffen; Meyer, Franc; Llobet, Antoni New powerful and oxidatively rugged dinuclear ru water oxidation catalyst: control of mechanistic pathways by tailored ligand design. Journal of the American Chemical Society, 2014, 136, 24-27 |
| 4120697 | CIF | C30 H78 K N3 O6 S Si6 U | P -1 | 12.7175; 18.84; 21.7489 91.46; 105.661; 92.752 | 5007.7 | Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society, 2014, 136, 96-99 |
| 4120698 | CIF | C38 H95 K N5 O6.5 S Si6 U | P 1 21/c 1 | 11.2243; 16.4779; 32.1639 90; 91.774; 90 | 5946 | Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society, 2014, 136, 96-99 |
| 4120699 | CIF | C30 H78 K N3 O7 Si6 U | P -1 | 11.0235; 12.7783; 18.3992 91.254; 93.268; 106.365 | 2480.7 | Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society, 2014, 136, 96-99 |
| 4120700 | CIF | C41 H79 N3 O2 Si6 U | P -1 | 11.7031; 12.7108; 17.4991 90.802; 92.647; 96.274 | 2584.26 | Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society, 2014, 136, 96-99 |
| 4120701 | CIF | C78 H110 K2 O16 | P -1 | 12.4741; 12.5528; 12.8731 87.589; 67.196; 86.878 | 1854.94 | Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society, 2014, 136, 96-99 |
| 4120702 | CIF | C53 H102 Li N4 O8 Si6 U | P n a 21 | 15.8489; 34.478; 11.8844 90; 90; 90 | 6494.1 | Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society, 2014, 136, 96-99 |
| 4120703 | CIF | C13 H19 N3 O2 | P b c a | 17.919; 15.3943; 9.6893 90; 90; 90 | 2672.8 | Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society, 2014, 136, 495-505 |
| 4120704 | CIF | C42 H31 N3 O3 | I 41/a :2 | 27.8949; 27.8949; 16.4272 90; 90; 90 | 12782.4 | Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society, 2014, 136, 495-505 |
| 4120705 | CIF | C47 H30 N6 O8 | P -1 | 9.882; 10.053; 21.2051 81.036; 78.409; 62.916 | 1832.33 | Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society, 2014, 136, 495-505 |
| 4120706 | CIF | C14 H20 N2 O2 | P -1 | 8.4734; 8.5039; 19.304 79.287; 79.415; 89.781 | 1342.8 | Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society, 2014, 136, 495-505 |
| 4121401 | CIF | C211 H152 Dy F9 N40 O45 S3 Zn16 | P 4 | 30.4975; 30.4975; 13.3192 90; 90; 90 | 12388.2 | Trivedi, Evan R.; Eliseeva, Svetlana V.; Jankolovits, Joseph; Olmstead, Marilyn M.; Petoud, Stéphane; Pecoraro, Vincent L. Highly emitting near-infrared lanthanide "encapsulated sandwich" metallacrown complexes with excitation shifted toward lower energy. Journal of the American Chemical Society, 2014, 136, 1526-1534 |
| 4121402 | CIF | C21 H23 Cl Ir N O | P 1 21/c 1 | 7.2221; 14.9351; 17.0443 90; 93.767; 90 | 1834.47 | Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society, 2014, 136, 3981-3994 |
| 4121403 | CIF | C23 H27 Cl5 Ir N O2 | P -1 | 9.1491; 10.4209; 14.3917 75.867; 87.839; 74.111 | 1279.14 | Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society, 2014, 136, 3981-3994 |
| 4121404 | CIF | C54 H37 B Cl2 F24 Ir N O | P -1 | 12.814; 13.721; 18.1145 106.177; 110.323; 98.016 | 2767.98 | Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society, 2014, 136, 3981-3994 |
| 4121405 | CIF | C62 H39 B Cl F30 Ir N2 O | P 1 21/n 1 | 13.1858; 20.15; 24.1403 90; 100.181; 90 | 6312.9 | Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society, 2014, 136, 3981-3994 |
| 4121407 | CIF | C27 H33 N4 O9 | P 21 21 21 | 6.1661; 15.0421; 29.201 90; 90; 90 | 2708.4 | Parker, Matthew F. L.; Osuna, Sílvia; Bollot, Guillaume; Vaddypally, Shivaiah; Zdilla, Michael J.; Houk, K. N.; Schafmeister, Christian E. Acceleration of an Aromatic Claisen Rearrangement via a Designed Spiroligozyme Catalyst that Mimics the Ketosteroid Isomerase Catalytic Dyad. Journal of the American Chemical Society, 2014, 136, 3817-3827 |
| 4121408 | CIF | C37.9 H29.1 N3.3 O9.3 Zn2 | P -1 | 13.0126; 13.1146; 13.9071 84.956; 69.273; 84.608 | 2206.08 | Aggarwal, Himanshu; Bhatt, Prashant M.; Bezuidenhout, Charl X.; Barbour, Leonard J. Direct evidence for single-crystal to single-crystal switching of degree of interpenetration in a metal-organic framework. Journal of the American Chemical Society, 2014, 136, 3776-3779 |
| 4121409 | CIF | C52.2 H32.8 N3.4 O12.4 Zn3 | C 1 2 1 | 17.0963; 19.9054; 14.0678 90; 95.978; 90 | 4761.36 | Aggarwal, Himanshu; Bhatt, Prashant M.; Bezuidenhout, Charl X.; Barbour, Leonard J. Direct evidence for single-crystal to single-crystal switching of degree of interpenetration in a metal-organic framework. Journal of the American Chemical Society, 2014, 136, 3776-3779 |
| 4121410 | CIF | C51.96 H32.24 N3.32 O12.32 Zn3 | C 1 2 1 | 17.1323; 19.8444; 14.0625 90; 96.159; 90 | 4753.4 | Aggarwal, Himanshu; Bhatt, Prashant M.; Bezuidenhout, Charl X.; Barbour, Leonard J. Direct evidence for single-crystal to single-crystal switching of degree of interpenetration in a metal-organic framework. Journal of the American Chemical Society, 2014, 136, 3776-3779 |
| 4121411 | CIF | C180 H0 B6 N6 O0 S12 | P -1 | 17.574; 20.2877; 21.8764 76.155; 80.617; 86.112 | 7468.4 | Wang, Xiao-Ye; Zhuang, Fang-Dong; Wang, Rui-Bo; Wang, Xin-Chang; Cao, Xiao-Yu; Wang, Jie-Yu; Pei, Jian A Straightforward Strategy toward Large BN-Embedded π-Systems: Synthesis, Structure, and Optoelectronic Properties of Extended BN Heterosuperbenzenes. Journal of the American Chemical Society, 2014, 136, 3764-3767 |
| 4121412 | CIF | F10 Hg O2 Te2 | C 1 2/c 1 | 18.6813; 8.6489; 5.8008 90; 96.215; 90 | 931.74 | Debackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. Noble-Gas Difluoride Complexes of Mercury(II): The Syntheses and Structures of Hg(OTeF5)2·1.5NgF2 (Ng = Xe, Kr) and Hg(OTeF5)2. Journal of the American Chemical Society, 2014, 136, 3888-3903 |
| 4121413 | CIF | F13 Hg O2 Te2 Xe1.5 | P 1 21/n 1 | 9.0574; 17.8943; 9.1285 90; 114.548; 90 | 1345.78 | Debackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. Noble-Gas Difluoride Complexes of Mercury(II): The Syntheses and Structures of Hg(OTeF5)2·1.5NgF2 (Ng = Xe, Kr) and Hg(OTeF5)2. Journal of the American Chemical Society, 2014, 136, 3888-3903 |
| 4121414 | CIF | F13 Hg Kr1.5 O2 Te2 | P 1 21/n 1 | 8.7981; 17.4159; 9.2247 90; 113.783; 90 | 1293.44 | Debackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. Noble-Gas Difluoride Complexes of Mercury(II): The Syntheses and Structures of Hg(OTeF5)2·1.5NgF2 (Ng = Xe, Kr) and Hg(OTeF5)2. Journal of the American Chemical Society, 2014, 136, 3888-3903 |
| 4121415 | CIF | C20 H16 Cl2 N6 | P n m a | 16.288; 19.2991; 5.3395 90; 90; 90 | 1678.44 | Pochorovski, Igor; Milić, Jovana; Kolarski, Dušan; Gropp, Cornelius; Schweizer, W. Bernd; Diederich, François Evaluation of Hydrogen-Bond Acceptors for Redox-Switchable Resorcin[4]arene Cavitands. Journal of the American Chemical Society, 2014, 136, 3852-3858 |
| 4121416 | CIF | C113 H100 Cl2 N10 O12 | P 1 21/n 1 | 18.289; 31.753; 19.041 90; 101.35; 90 | 10841 | Pochorovski, Igor; Milić, Jovana; Kolarski, Dušan; Gropp, Cornelius; Schweizer, W. Bernd; Diederich, François Evaluation of Hydrogen-Bond Acceptors for Redox-Switchable Resorcin[4]arene Cavitands. Journal of the American Chemical Society, 2014, 136, 3852-3858 |
| 4121417 | CIF | C15 H18 Cl N O2 | P 1 21 1 | 10.1012; 9.8645; 14.7218 90; 92.917; 90 | 1465.03 | Wu, Hao; Haeffner, Fredrik; Hoveyda, Amir H. An efficient, practical, and enantioselective method for synthesis of homoallenylamides catalyzed by an aminoalcohol-derived, boron-based catalyst. Journal of the American Chemical Society, 2014, 136, 3780-3783 |
| 4121418 | CIF | C12 H13 N O3 | P 21 21 21 | 5.6723; 12.279; 16.043 90; 90; 90 | 1117.4 | Wu, Hao; Haeffner, Fredrik; Hoveyda, Amir H. An efficient, practical, and enantioselective method for synthesis of homoallenylamides catalyzed by an aminoalcohol-derived, boron-based catalyst. Journal of the American Chemical Society, 2014, 136, 3780-3783 |
| 4121419 | CIF | C39 H36 Cl2 Fe N10 O11 | P -1 | 13.099; 13.355; 14.078 71.968; 69.923; 70.857 | 2130.7 | Costa, José Sánchez; Rodríguez-Jiménez, Santiago; Craig, Gavin A.; Barth, Benjamin; Beavers, Christine M.; Teat, Simon J.; Aromí, Guillem Three-Way Crystal-to-Crystal Reversible Transformation and Controlled Spin Switching by a Nonporous Molecular Material. Journal of the American Chemical Society, 2014, 136, 3869-3874 |
| 4121420 | CIF | C37.25 H35 Cl2 Fe N10 O11.75 | P -1 | 12.708; 13.214; 14.931 71.792; 69.208; 62.66 | 2048.2 | Costa, José Sánchez; Rodríguez-Jiménez, Santiago; Craig, Gavin A.; Barth, Benjamin; Beavers, Christine M.; Teat, Simon J.; Aromí, Guillem Three-Way Crystal-to-Crystal Reversible Transformation and Controlled Spin Switching by a Nonporous Molecular Material. Journal of the American Chemical Society, 2014, 136, 3869-3874 |
| 4121421 | CIF | C40.5 H39 Cl2 Fe N10 O11.5 | P 1 21/n 1 | 14.0569; 21.606; 15.2698 90; 114.946; 90 | 4205 | Costa, José Sánchez; Rodríguez-Jiménez, Santiago; Craig, Gavin A.; Barth, Benjamin; Beavers, Christine M.; Teat, Simon J.; Aromí, Guillem Three-Way Crystal-to-Crystal Reversible Transformation and Controlled Spin Switching by a Nonporous Molecular Material. Journal of the American Chemical Society, 2014, 136, 3869-3874 |
| 4121422 | CIF | C26 H24 F3 N O | C 1 2/c 1 | 14.041; 15.174; 21.268 90; 108.413; 90 | 4299 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121423 | CIF | C25 H22 F3 N O | C 1 2 1 | 32.495; 7.4802; 17.551 90; 105.813; 90 | 4104.7 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121424 | CIF | C26 H24 F3 N O | P -1 | 9.4028; 10.1616; 14.165 107.003; 109.02; 95.887 | 1193.9 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121425 | CIF | C35 H35 F3 N O | C 1 2/c 1 | 25.51; 8.9782; 26.541 90; 112.593; 90 | 5612.3 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121426 | CIF | C36 H30 F3 N O | P -1 | 10.579; 10.658; 13.229 75.671; 76.455; 82.608 | 1401 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121427 | CIF | C20 H18 F3 N O | P 21 21 21 | 5.6284; 15.5917; 18.8291 90; 90; 90 | 1652.4 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121428 | CIF | C36 H30 F3 N O | P 1 21/n 1 | 11.401; 14.913; 15.965 90; 97.817; 90 | 2689.2 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121429 | CIF | C28 H28 F3 N O | P -1 | 9.075; 9.991; 13.562 101.559; 104.089; 97.615 | 1147 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121430 | CIF | C33 H30 F3 N O2 | P 1 21/c 1 | 17.148; 11.3383; 14.3781 90; 96.218; 90 | 2779.1 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121431 | CIF | C26 H24 F3 N O2 | P -1 | 9.687; 9.819; 12.399 83.01; 73.99; 70.346 | 1067 | Mori, Keiji; Kurihara, Kazuki; Yabe, Shinnosuke; Yamanaka, Masahiro; Akiyama, Takahiko Double C(sp(3))-H Bond Functionalization Mediated by Sequential Hydride Shift/Cyclization Process: Diastereoselective Construction of Polyheterocycles. Journal of the American Chemical Society, 2014, 136, 3744-3747 |
| 4121432 | CIF | C26 H38 O4 | P 1 21/c 1 | 28.6041; 8.1727; 22.0769 90; 110.543; 90 | 4832.8 | Horeischi, Fiene; Biber, Nicole; Plietker, Bernd The Total Syntheses of Guttiferone A and 6-epi-Guttiferone A. Journal of the American Chemical Society, 2014, 136, 4026-4030 |
| 4121433 | CIF | C24 H34 O4 | P -1 | 8.6352; 10.1575; 13.0283 79.15; 77.585; 74.196 | 1063.56 | Horeischi, Fiene; Biber, Nicole; Plietker, Bernd The Total Syntheses of Guttiferone A and 6-epi-Guttiferone A. Journal of the American Chemical Society, 2014, 136, 4026-4030 |
| 4121434 | CIF | C192 H177 Cu8 F48 N39.5 O8.25 P8 | P -1 | 18.067; 22.497; 32.866 78.64; 80.51; 82.79 | 12858 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121435 | CIF | C188 H152 Ag Au2 B7 Cu8 F28 N36 | P 4/n :2 | 23.101; 23.101; 46.775 90; 90; 90 | 24962 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121436 | CIF | C180 H124 B8 Br16 Cu8 F32 N37 O0.5 | C 1 2/c 1 | 47.2607; 25.8641; 38.3681 90; 109.894; 90 | 44100.7 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121437 | CIF | C184 H152 Ag8 B8 F32 N32 | R 3 2 :H | 35.408; 35.408; 45.801 90; 90; 120 | 49729 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121438 | CIF | C416 H646 Au3 B0 Cu8 F56 N74 O38 Sb7 | P 1 n 1 | 23.054; 47.6698; 23.0934 90; 90.249; 90 | 25378.9 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121439 | CIF | C228 H214 Cu8 F48 N40 O3 P8 | I 41/a :2 | 22.896; 22.896; 95.642 90; 90; 90 | 50138 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121440 | CIF | C220 H194 Au2 Cu9 F48 K N40 O3 P8 | C 1 2/c 1 | 23.215; 46.98; 22.848 90; 90.171; 90 | 24919 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121441 | CIF | C208 H168 B8 Cu8 F32 N32 | P -4 | 35.492; 35.492; 20.593 90; 90; 90 | 25941 | Meng, Wenjing; League, Aaron B.; Ronson, Tanya K.; Clegg, Jack K.; Isley, 3rd, William C; Semrouni, David; Gagliardi, Laura; Cramer, Christopher J.; Nitschke, Jonathan R. Empirical and Theoretical Insights into the Structural Features and Host-Guest Chemistry of M8L4 Tube Architectures. Journal of the American Chemical Society, 2014, 136, 3972-3980 |
| 4121442 | CIF | C73 H82 Co2 Fe2 N4 S4 | P 1 21/c 1 | 20.2363; 14.4798; 23.167 90; 107.135; 90 | 6487 | Albers, Antonia; Demeshko, Serhiy; Dechert, Sebastian; Saouma, Caroline T.; Mayer, James M.; Meyer, Franc Fast Proton-Coupled Electron Transfer Observed for a High-Fidelity Structural and Functional [2Fe-2S] Rieske Model. Journal of the American Chemical Society, 2014, 136, 3946-3954 |
| 4121443 | CIF | C60 H89 Fe2 N8 O S4 | P 1 21/n 1 | 9.9126; 41.2369; 15.839 90; 108.107; 90 | 6153.8 | Albers, Antonia; Demeshko, Serhiy; Dechert, Sebastian; Saouma, Caroline T.; Mayer, James M.; Meyer, Franc Fast Proton-Coupled Electron Transfer Observed for a High-Fidelity Structural and Functional [2Fe-2S] Rieske Model. Journal of the American Chemical Society, 2014, 136, 3946-3954 |
| 4121444 | CIF | C51 H67 Fe2 N7 O3 S4 | P -1 | 10.2488; 15.4826; 17.6402 73.265; 81.038; 88.624 | 2647.2 | Albers, Antonia; Demeshko, Serhiy; Dechert, Sebastian; Saouma, Caroline T.; Mayer, James M.; Meyer, Franc Fast Proton-Coupled Electron Transfer Observed for a High-Fidelity Structural and Functional [2Fe-2S] Rieske Model. Journal of the American Chemical Society, 2014, 136, 3946-3954 |
| 4121445 | CIF | F30 Mn Na4 U6 | P -3 c 1 | 9.9172; 9.9172; 13.033 90; 90; 120 | 1110.1 | Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; Zur Loye, Hans-Conrad Application of a Mild Hydrothermal Approach Containing an in Situ Reduction Step to the Growth of Single Crystals of the Quaternary U(IV)-Containing Fluorides Na4MU6F30 (M = Mn(2+), Co(2+), Ni(2+), Cu(2+), and Zn(2+)) Crystal Growth, Structures, and Magnetic Properties. Journal of the American Chemical Society, 2014, 136, 3955-3963 |
| 4121446 | CIF | Co F30 Na4 U6 | P -3 c 1 | 9.8882; 9.8882; 13.0152 90; 90; 120 | 1102.09 | Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; Zur Loye, Hans-Conrad Application of a Mild Hydrothermal Approach Containing an in Situ Reduction Step to the Growth of Single Crystals of the Quaternary U(IV)-Containing Fluorides Na4MU6F30 (M = Mn(2+), Co(2+), Ni(2+), Cu(2+), and Zn(2+)) Crystal Growth, Structures, and Magnetic Properties. Journal of the American Chemical Society, 2014, 136, 3955-3963 |
| 4121447 | CIF | F30 Na4 Ni U6 | P -3 c 1 | 9.8623; 9.8623; 13.0147 90; 90; 120 | 1096.28 | Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; Zur Loye, Hans-Conrad Application of a Mild Hydrothermal Approach Containing an in Situ Reduction Step to the Growth of Single Crystals of the Quaternary U(IV)-Containing Fluorides Na4MU6F30 (M = Mn(2+), Co(2+), Ni(2+), Cu(2+), and Zn(2+)) Crystal Growth, Structures, and Magnetic Properties. Journal of the American Chemical Society, 2014, 136, 3955-3963 |
| 4121448 | CIF | Cu F30 Na4 U6 | P -3 c 1 | 9.8826; 9.8826; 13.0106 90; 90; 120 | 1100.45 | Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; Zur Loye, Hans-Conrad Application of a Mild Hydrothermal Approach Containing an in Situ Reduction Step to the Growth of Single Crystals of the Quaternary U(IV)-Containing Fluorides Na4MU6F30 (M = Mn(2+), Co(2+), Ni(2+), Cu(2+), and Zn(2+)) Crystal Growth, Structures, and Magnetic Properties. Journal of the American Chemical Society, 2014, 136, 3955-3963 |
| 4121449 | CIF | F30 Na4 U6 Zn | P -3 c 1 | 9.8783; 9.8783; 13.0455 90; 90; 120 | 1102.44 | Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; Zur Loye, Hans-Conrad Application of a Mild Hydrothermal Approach Containing an in Situ Reduction Step to the Growth of Single Crystals of the Quaternary U(IV)-Containing Fluorides Na4MU6F30 (M = Mn(2+), Co(2+), Ni(2+), Cu(2+), and Zn(2+)) Crystal Growth, Structures, and Magnetic Properties. Journal of the American Chemical Society, 2014, 136, 3955-3963 |
| 4121450 | CIF | C53 H73 O2 P | P -1 | 15.647; 17.5051; 18.3972 89.321; 71.715; 69.433 | 4452.1 | Lee, Hong Geun; Milner, Phillip J.; Buchwald, Stephen L. Pd-catalyzed nucleophilic fluorination of aryl bromides. Journal of the American Chemical Society, 2014, 136, 3792-3795 |
| 4121451 | CIF | C17 H16 Cl N O3 | P 21 21 21 | 6.5811; 7.0763; 33.062 90; 90; 90 | 1539.7 | Teng, Huai-Long; Yao, Lu; Wang, Chun-Jiang Cu(I)-Catalyzed Regio- and Stereoselective [6 + 3] Cycloaddition of Azomethine Ylides with Tropone: An Efficient Asymmetric Access to Bridged Azabicyclo[4.3.1]decadienes. Journal of the American Chemical Society, 2014, 136, 4075-4080 |
| 4121452 | CIF | C17 H17 Cl N2 O3 | P b c n | 23.505; 15.5207; 20.919 90; 90; 90 | 7631.5 | Teng, Huai-Long; Yao, Lu; Wang, Chun-Jiang Cu(I)-Catalyzed Regio- and Stereoselective [6 + 3] Cycloaddition of Azomethine Ylides with Tropone: An Efficient Asymmetric Access to Bridged Azabicyclo[4.3.1]decadienes. Journal of the American Chemical Society, 2014, 136, 4075-4080 |
| 4121453 | CIF | C46 H34 N4 | P -1 | 10.5501; 10.8464; 14.8158 97.7821; 96.6675; 101.584 | 1627.5 | Shima, Kentaro; Mutoh, Katsuya; Kobayashi, Yoichi; Abe, Jiro Enhancing the versatility and functionality of fast photochromic bridged imidazole dimers by flipping imidazole rings. Journal of the American Chemical Society, 2014, 136, 3796-3799 |
| 4121454 | CIF | C46 H34 N4 | P 1 21/c 1 | 13.309; 13.381; 18.906 90; 98.895; 90 | 3326.4 | Shima, Kentaro; Mutoh, Katsuya; Kobayashi, Yoichi; Abe, Jiro Enhancing the versatility and functionality of fast photochromic bridged imidazole dimers by flipping imidazole rings. Journal of the American Chemical Society, 2014, 136, 3796-3799 |
| 4121455 | CIF | C22 H23 N O3 | P 21 21 21 | 4.9531; 12.3326; 29.4659 90; 90; 90 | 1799.91 | Cong, Huan; Fu, Gregory C. Catalytic enantioselective cyclization/cross-coupling with alkyl electrophiles. Journal of the American Chemical Society, 2014, 136, 3788-3791 |
| 4121456 | CIF | C29 H35 Br O4 | P 21 21 21 | 7.5438; 10.6784; 32.488 90; 90; 90 | 2617.1 | Oblak, E. Zachary; Vanheyst, Michael D.; Li, Jin; Wiemer, Andrew J.; Wright, Dennis L. Cyclopropene cycloadditions with annulated furans: total synthesis of (+)- and (-)-frondosin B and (+)-frondosin a. Journal of the American Chemical Society, 2014, 136, 4309-4315 |
| 4121457 | CIF | C11 H10 Br2 O3 | P 1 21 1 | 7.0876; 8.3046; 10.113 90; 109.547; 90 | 560.9 | Oblak, E. Zachary; Vanheyst, Michael D.; Li, Jin; Wiemer, Andrew J.; Wright, Dennis L. Cyclopropene cycloadditions with annulated furans: total synthesis of (+)- and (-)-frondosin B and (+)-frondosin a. Journal of the American Chemical Society, 2014, 136, 4309-4315 |
| 4121458 | CIF | C25 H34 O4 Si | P -1 | 9.68701; 10.1076; 13.631 100.102; 104.084; 109.826 | 1168.12 | Oblak, E. Zachary; Vanheyst, Michael D.; Li, Jin; Wiemer, Andrew J.; Wright, Dennis L. Cyclopropene cycloadditions with annulated furans: total synthesis of (+)- and (-)-frondosin B and (+)-frondosin a. Journal of the American Chemical Society, 2014, 136, 4309-4315 |
| 4121459 | CIF | C24 H12 O32 Zr6 | P n -3 | 17.8348; 17.8348; 17.8348 90; 90; 90 | 5672.9 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121460 | CIF | C48 H24 O81.17 Zr12 | P -1 | 17.809; 17.831; 17.812 90.031; 90.182; 89.999 | 5656 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121461 | CIF | C39.17 H16 N14.5 O38.92 Zr6 | F d d 2 | 39.222; 26.018; 27.887 90; 90; 90 | 28458 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121462 | CIF | C4 H2.04 D1.01 O5.78 Zr | P n -3 :2 | 17.8736; 17.8736; 17.8736 90; 90; 90 | 5710 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121463 | CIF | C24 H6 O44.35 Zr6 | F d -3 m | 35.0764; 35.0764; 35.0764 90; 90; 90 | 43156 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121464 | CIF | C24 H12 O34.7 Zr6 | P n -3 | 17.9309; 17.9309; 17.9309 90; 90; 90 | 5765.1 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121465 | CIF | C62 H36 O36 Zr6 | I 4/m | 14.6766; 14.6766; 28.0033 90; 90; 90 | 6032 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121466 | CIF | C84 H24 O49.5 Zr6 | F m -3 | 26.8514; 26.8514; 26.8514 90; 90; 90 | 19359.8 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121467 | CIF | C95 N0.67 O39.67 Zr6 | C 1 2/c 1 | 23.9651; 29.2842; 17.3545 90; 96.301; 90 | 12105.8 | Furukawa, Hiroyasu; Gándara, Felipe; Zhang, Yue-Biao; Jiang, Juncong; Queen, Wendy L.; Hudson, Matthew R.; Yaghi, Omar M. Water adsorption in porous metal-organic frameworks and related materials. Journal of the American Chemical Society, 2014, 136, 4369-4381 |
| 4121468 | CIF | C32 H56 O3 P2 Ru | P -1 | 10.18; 11.332; 14.443 92.58; 99.537; 106.924 | 1564.26 | Bontemps, Sébastien; Vendier, Laure; Sabo-Etienne, Sylviane Ruthenium-catalyzed reduction of carbon dioxide to formaldehyde. Journal of the American Chemical Society, 2014, 136, 4419-4425 |
| 4121469 | CIF | C33 H57 O4 P2 Ru | P 1 21/n 1 | 13.2848; 13.6995; 18.5567 90; 101.855; 90 | 3305.19 | Bontemps, Sébastien; Vendier, Laure; Sabo-Etienne, Sylviane Ruthenium-catalyzed reduction of carbon dioxide to formaldehyde. Journal of the American Chemical Society, 2014, 136, 4419-4425 |
| 4121470 | CIF | C37 H69 B O3 P2 Ru | P -1 | 12.885; 24.182; 27.632 64.995; 81.383; 75.589 | 7547 | Bontemps, Sébastien; Vendier, Laure; Sabo-Etienne, Sylviane Ruthenium-catalyzed reduction of carbon dioxide to formaldehyde. Journal of the American Chemical Society, 2014, 136, 4419-4425 |
| 4121471 | CIF | C18 H26 N2 O5 S | P -1 | 9.2259; 10.2376; 11.1572 69.55; 76.935; 84.815 | 961.76 | Kang, Taek; Kim, Youngchan; Lee, Donggun; Wang, Zhen; Chang, Sukbok Iridium-Catalyzed Intermolecular Amidation of sp(3) C-H Bonds: Late-Stage Functionalization of an Unactivated Methyl Group. Journal of the American Chemical Society, 2014, 136, 4141-4144 |
| 4121472 | CIF | C38 H60 N2 O3 S | P 21 21 21 | 6.062; 12.0849; 48.626 90; 90; 90 | 3562.3 | Kang, Taek; Kim, Youngchan; Lee, Donggun; Wang, Zhen; Chang, Sukbok Iridium-Catalyzed Intermolecular Amidation of sp(3) C-H Bonds: Late-Stage Functionalization of an Unactivated Methyl Group. Journal of the American Chemical Society, 2014, 136, 4141-4144 |
| 4121473 | CIF | C38 H60 N2 O3 S | P 21 21 21 | 7.3922; 13.9405; 34.054 90; 90; 90 | 3509.3 | Kang, Taek; Kim, Youngchan; Lee, Donggun; Wang, Zhen; Chang, Sukbok Iridium-Catalyzed Intermolecular Amidation of sp(3) C-H Bonds: Late-Stage Functionalization of an Unactivated Methyl Group. Journal of the American Chemical Society, 2014, 136, 4141-4144 |
| 4121474 | CIF | C23 H30 N2 O5 S | P 1 21 1 | 9.0914; 10.2457; 11.6359 90; 92.762; 90 | 1082.6 | Kang, Taek; Kim, Youngchan; Lee, Donggun; Wang, Zhen; Chang, Sukbok Iridium-Catalyzed Intermolecular Amidation of sp(3) C-H Bonds: Late-Stage Functionalization of an Unactivated Methyl Group. Journal of the American Chemical Society, 2014, 136, 4141-4144 |
| 4121475 | CIF | C16 H26 N2 O3 S | P 1 21/c 1 | 13.1014; 12.7136; 10.5927 90; 95.941; 90 | 1754.9 | Kang, Taek; Kim, Youngchan; Lee, Donggun; Wang, Zhen; Chang, Sukbok Iridium-Catalyzed Intermolecular Amidation of sp(3) C-H Bonds: Late-Stage Functionalization of an Unactivated Methyl Group. Journal of the American Chemical Society, 2014, 136, 4141-4144 |
| 4121476 | CIF | C21 H17 Br F N O | P 1 21 1 | 5.0571; 21.8253; 15.7019 90; 92.918; 90 | 1730.81 | Talbot, Eric P. A.; Fernandes, Talita de A; McKenna, Jeffrey M.; Toste, F. Dean Asymmetric palladium-catalyzed directed intermolecular fluoroarylation of styrenes. Journal of the American Chemical Society, 2014, 136, 4101-4104 |
| 4121477 | CIF | C23 H46 Co N P2 Si | P 1 21/n 1 | 14.0952; 10.4443; 18.2567 90; 99.535; 90 | 2650.5 | Obligacion, Jennifer V.; Semproni, Scott P.; Chirik, Paul J. Cobalt-catalyzed C-h borylation. Journal of the American Chemical Society, 2014, 136, 4133-4136 |
| 4121478 | CIF | C25 H49 B Co N O2 P2 | P b c n | 11.0403; 33.7265; 8.0786 90; 90; 90 | 3008.07 | Obligacion, Jennifer V.; Semproni, Scott P.; Chirik, Paul J. Cobalt-catalyzed C-h borylation. Journal of the American Chemical Society, 2014, 136, 4133-4136 |
| 4121479 | CIF | C46 H46 Cl3 N5 O11 U | P -1 | 9.0834; 14.4022; 18.6785 68.213; 88.702; 88.899 | 2268.26 | Ho, I-Ting; Zhang, Zhan; Ishida, Masatoshi; Lynch, Vincent M.; Cha, Won-Young; Sung, Young Mo; Kim, Dongho; Sessler, Jonathan L. A Hybrid Macrocycle with a Pyridine Subunit Displays Aromatic Character upon Uranyl Cation Complexation. Journal of the American Chemical Society, 2014, 136, 4281-4286 |
| 4121480 | CIF | C48 H0 N9 O4 S0 | I 1 2/a 1 | 14.1607; 21.6697; 16.7388 90; 106.766; 90 | 4918.1 | Ho, I-Ting; Zhang, Zhan; Ishida, Masatoshi; Lynch, Vincent M.; Cha, Won-Young; Sung, Young Mo; Kim, Dongho; Sessler, Jonathan L. A Hybrid Macrocycle with a Pyridine Subunit Displays Aromatic Character upon Uranyl Cation Complexation. Journal of the American Chemical Society, 2014, 136, 4281-4286 |
| 4121481 | CIF | C27 H30 F N3 O3 Pd S | P 1 21/c 1 | 10.0069; 15.8048; 16.6019 90; 100.695; 90 | 2580.1 | Pérez-Temprano, Mónica H; Racowski, Joy M.; Kampf, Jeff W.; Sanford, Melanie S. Competition between sp(3)-C-N vs sp(3)-C-F Reductive Elimination from Pd(IV) Complexes. Journal of the American Chemical Society, 2014, 136, 4097-4100 |
| 4121482 | CIF | C27 H27 N3 O2 Pd S | P -1 | 8.1341; 11.4864; 13.8266 83.636; 76.609; 73.151 | 1201.44 | Pérez-Temprano, Mónica H; Racowski, Joy M.; Kampf, Jeff W.; Sanford, Melanie S. Competition between sp(3)-C-N vs sp(3)-C-F Reductive Elimination from Pd(IV) Complexes. Journal of the American Chemical Society, 2014, 136, 4097-4100 |
| 4121483 | CIF | C28 H30 Cl2 F N3 O2 Pd S | P -1 | 8.7508; 13.0966; 13.8038 113.119; 90.846; 107.26 | 1373.82 | Pérez-Temprano, Mónica H; Racowski, Joy M.; Kampf, Jeff W.; Sanford, Melanie S. Competition between sp(3)-C-N vs sp(3)-C-F Reductive Elimination from Pd(IV) Complexes. Journal of the American Chemical Society, 2014, 136, 4097-4100 |
| 4121484 | CIF | C96 H81 Cl2 Ir2 N O11 P4 | P 21 21 21 | 18.4583; 18.8093; 26.944 90; 90; 90 | 9354.6 | Sevov, Christo S.; Zhou, Jianrong Steve; Hartwig, John F. Iridium-Catalyzed, Intermolecular Hydroamination of Unactivated Alkenes with Indoles. Journal of the American Chemical Society, 2014, 136, 3200 |
| 4121485 | CIF | C38 H38 F6 Ir N4 O2 P | P 1 21 1 | 13.3232; 24.2827; 15.9879 90; 109.445; 90 | 4877.4 | Huo, Haohua; Fu, Chen; Harms, Klaus; Meggers, Eric Asymmetric Catalysis with Substitutionally Labile yet Stereochemically Stable Chiral-at-Metal Iridium(III) Complex. Journal of the American Chemical Society, 2014, 136, 2990-2993 |
| 4121486 | CIF | C7 H5 Cl2 N3 | P -1 | 4.0955; 9.3869; 10.9006 92.236; 98.986; 97.468 | 409.66 | Shannon, D. Alexander; Banerjee, Ranjan; Webster, Elizabeth R.; Bak, Daniel W.; Wang, Chu; Weerapana, Eranthie Investigating the proteome reactivity and selectivity of aryl halides. Journal of the American Chemical Society, 2014, 136, 3330-3333 |
| 4121487 | CIF | C20 H19 I O6 | P -1 | 8.8558; 10.4095; 11.3264 89.959; 68.696; 68.458 | 894.15 | Qi, Chao; Qin, Tian; Suzuki, Daisuke; Porco, Jr, John A Total synthesis and stereochemical assignment of (±)-sorbiterrin a. Journal of the American Chemical Society, 2014, 136, 3374-3377 |
| 4121488 | CIF | C20 H20 O6 | P 1 21/n 1 | 10.0191; 10.3912; 15.5553 90; 98.703; 90 | 1600.82 | Qi, Chao; Qin, Tian; Suzuki, Daisuke; Porco, Jr, John A Total synthesis and stereochemical assignment of (±)-sorbiterrin a. Journal of the American Chemical Society, 2014, 136, 3374-3377 |
| 4121489 | CIF | C54 H80 Cr N6 | P 1 2/c 1 | 25.87; 8.298; 24.8 90; 107.769; 90 | 5070 | Shen, Jingmei; Yap, Glenn P. A.; Theopold, Klaus H. Chromium mediated reductive coupling of isonitrile forms unusual heterocycles. Journal of the American Chemical Society, 2014, 136, 3382-3384 |
| 4121490 | CIF | C96 H143 Cr2 N10 O0.5 | P b c n | 21.584; 25.618; 32.868 90; 90; 90 | 18174 | Shen, Jingmei; Yap, Glenn P. A.; Theopold, Klaus H. Chromium mediated reductive coupling of isonitrile forms unusual heterocycles. Journal of the American Chemical Society, 2014, 136, 3382-3384 |
| 4121491 | CIF | C102 H158 Cr2 N10 O2 | C 1 2/c 1 | 29.418; 13.005; 27.439 90; 112.616; 90 | 9690 | Shen, Jingmei; Yap, Glenn P. A.; Theopold, Klaus H. Chromium mediated reductive coupling of isonitrile forms unusual heterocycles. Journal of the American Chemical Society, 2014, 136, 3382-3384 |
| 4121492 | CIF | C80 H116 Cr2 N8 | P 1 21/c 1 | 12.724; 15.622; 37.4 90; 99.11; 90 | 7340.4 | Shen, Jingmei; Yap, Glenn P. A.; Theopold, Klaus H. Chromium mediated reductive coupling of isonitrile forms unusual heterocycles. Journal of the American Chemical Society, 2014, 136, 3382-3384 |
| 4121493 | CIF | C42 H68 N6 | P 1 21/c 1 | 13.796; 9.955; 18.18 90; 129.66; 90 | 1922.2 | Shen, Jingmei; Yap, Glenn P. A.; Theopold, Klaus H. Chromium mediated reductive coupling of isonitrile forms unusual heterocycles. Journal of the American Chemical Society, 2014, 136, 3382-3384 |
| 4121494 | CIF | C23 H20 F N3 O4 S | P -1 | 8.9759; 11.1688; 12.3629 68.596; 69.139; 77.785 | 1073.5 | Shang, Ming; Sun, Shang-Zheng; Dai, Hui-Xiong; Yu, Jin-Quan Cu(II)-Mediated C-H Amidation and Amination of Arenes: Exceptional Compatibility with Heterocycles. Journal of the American Chemical Society, 2014, 136, 3354-3357 |
| 4121495 | CIF | C22 H19 Br N O P | I 4 | 27.175; 27.175; 5.2579 90; 90; 90 | 3882.9 | Mszar, Nicholas W.; Haeffner, Fredrik; Hoveyda, Amir H. NHC-Cu-Catalyzed Addition of Propargylboron Reagents to Phosphinoylimines. Enantioselective Synthesis of Trimethylsilyl-Substituted Homoallenylamides and Application to the Synthesis of S-(-)-Cyclooroidin. Journal of the American Chemical Society, 2014, 136, 3362-3365 |
| 4121496 | CIF | C25 H27 Br N O P Si | P 1 21 1 | 19.8739; 10.2459; 24.6435 90; 96.599; 90 | 4984.8 | Mszar, Nicholas W.; Haeffner, Fredrik; Hoveyda, Amir H. NHC-Cu-Catalyzed Addition of Propargylboron Reagents to Phosphinoylimines. Enantioselective Synthesis of Trimethylsilyl-Substituted Homoallenylamides and Application to the Synthesis of S-(-)-Cyclooroidin. Journal of the American Chemical Society, 2014, 136, 3362-3365 |
| 4121497 | CIF | C22 H20 N O P | P 1 21 1 | 5.3586; 15.5598; 21.571 90; 94.462; 90 | 1793.1 | Mszar, Nicholas W.; Haeffner, Fredrik; Hoveyda, Amir H. NHC-Cu-Catalyzed Addition of Propargylboron Reagents to Phosphinoylimines. Enantioselective Synthesis of Trimethylsilyl-Substituted Homoallenylamides and Application to the Synthesis of S-(-)-Cyclooroidin. Journal of the American Chemical Society, 2014, 136, 3362-3365 |
| 4121498 | CIF | C39 H60 Cl N4 P3 Th | P -1 | 11.5293; 12.2573; 16.7699 94.757; 101.488; 115.104 | 2065.3 | Ward, Ashleigh L.; Lukens, Wayne W.; Lu, Connie C.; Arnold, John Photochemical route to actinide-transition metal bonds: synthesis, characterization and reactivity of a series of thorium and uranium heterobimetallic complexes. Journal of the American Chemical Society, 2014, 136, 3647-3654 |
| 4121499 | CIF | C39 H60 Cl N4 P3 U | P -1 | 13.5354; 16.0795; 33.6127 95.019; 97.555; 106.033 | 6910.9 | Ward, Ashleigh L.; Lukens, Wayne W.; Lu, Connie C.; Arnold, John Photochemical route to actinide-transition metal bonds: synthesis, characterization and reactivity of a series of thorium and uranium heterobimetallic complexes. Journal of the American Chemical Society, 2014, 136, 3647-3654 |
| 4121500 | CIF | C46.5 H64 Co N4 O4 P3 Th | P -1 | 11.2506; 15.9358; 29.701 82.195; 83.056; 83.218 | 5208.9 | Ward, Ashleigh L.; Lukens, Wayne W.; Lu, Connie C.; Arnold, John Photochemical route to actinide-transition metal bonds: synthesis, characterization and reactivity of a series of thorium and uranium heterobimetallic complexes. Journal of the American Chemical Society, 2014, 136, 3647-3654 |
| 4121501 | CIF | C43 H60 Co N4 O4 P3 U | P n a 21 | 23.0608; 14.0118; 14.0919 90; 90; 90 | 4553.4 | Ward, Ashleigh L.; Lukens, Wayne W.; Lu, Connie C.; Arnold, John Photochemical route to actinide-transition metal bonds: synthesis, characterization and reactivity of a series of thorium and uranium heterobimetallic complexes. Journal of the American Chemical Society, 2014, 136, 3647-3654 |
| 4121502 | CIF | C42 H60 Co N4 O3 P3 Th | P -1 | 11.0757; 14.0911; 18.714 80.318; 74.876; 89.511 | 2777.4 | Ward, Ashleigh L.; Lukens, Wayne W.; Lu, Connie C.; Arnold, John Photochemical route to actinide-transition metal bonds: synthesis, characterization and reactivity of a series of thorium and uranium heterobimetallic complexes. Journal of the American Chemical Society, 2014, 136, 3647-3654 |
| 4121503 | CIF | C52.5 H72 Co N4 O3 P3 U | P -1 | 14.0553; 18.7308; 22.2945 73.83; 89.024; 80.541 | 5558 | Ward, Ashleigh L.; Lukens, Wayne W.; Lu, Connie C.; Arnold, John Photochemical route to actinide-transition metal bonds: synthesis, characterization and reactivity of a series of thorium and uranium heterobimetallic complexes. Journal of the American Chemical Society, 2014, 136, 3647-3654 |
| 4121504 | CIF | C74 H10 O4 Ru2 | P 1 21/c 1 | 15.408; 13.224; 20.014 90; 104.28; 90 | 3952 | Bowles, Faye L.; Olmstead, Marilyn M.; Balch, Alan L. Preparation and Crystallographic Characterization of C60{η(1)-Ru(CO)2(η(5)-C5H5)}2: A Locally Crowded Organometallic Fullerene Without the Usual η(2)-Bonding. Journal of the American Chemical Society, 2014, 136, 3338-3341 |
| 4121505 | CIF | C26 H25 Br3 O4 | P 1 21 1 | 9.4299; 10.1574; 12.4173 90; 91.865; 90 | 1188.74 | Morisaki, Yasuhiro; Gon, Masayuki; Sasamori, Takahiro; Tokitoh, Norihiro; Chujo, Yoshiki Planar chiral tetrasubstituted [2.2]paracyclophane: optical resolution and functionalization. Journal of the American Chemical Society, 2014, 136, 3350-3353 |
| 4121506 | CIF | C72 H68 O4 | C 1 2/c 1 | 31.272; 20.035; 9.3941 90; 94.822; 90 | 5864.9 | Morisaki, Yasuhiro; Gon, Masayuki; Sasamori, Takahiro; Tokitoh, Norihiro; Chujo, Yoshiki Planar chiral tetrasubstituted [2.2]paracyclophane: optical resolution and functionalization. Journal of the American Chemical Society, 2014, 136, 3350-3353 |
| 4121507 | CIF | C27 H26 Br3 Cl3 O4 | P 1 21 1 | 6.4145; 14.2125; 15.8067 90; 100.228; 90 | 1418.14 | Morisaki, Yasuhiro; Gon, Masayuki; Sasamori, Takahiro; Tokitoh, Norihiro; Chujo, Yoshiki Planar chiral tetrasubstituted [2.2]paracyclophane: optical resolution and functionalization. Journal of the American Chemical Society, 2014, 136, 3350-3353 |
| 4121508 | CIF | C31 H27 N7 | C 1 2/c 1 | 16.706; 10.6702; 14.0656 90; 97.273; 90 | 2487.11 | Stadler, Adrian-Mihail; Lehn, Jean-Marie P Coupled Nanomechanical Motions: Metal-Ion-Effected, pH-Modulated, Simultaneous Extension/Contraction Motions of Double-Domain Helical/Linear Molecular Strands. Journal of the American Chemical Society, 2014, 136, 3400-3409 |
| 4121509 | CIF | C40 H31 F12 N11 O12 Pb2 S4 | P -1 | 11.7399; 15.2644; 16.1523 92.087; 108.693; 104.202 | 2637.1 | Stadler, Adrian-Mihail; Lehn, Jean-Marie P Coupled Nanomechanical Motions: Metal-Ion-Effected, pH-Modulated, Simultaneous Extension/Contraction Motions of Double-Domain Helical/Linear Molecular Strands. Journal of the American Chemical Society, 2014, 136, 3400-3409 |
| 4121510 | CIF | C55 H57 F18 N25 O19 Pb3 S6 | P 1 21/c 1 | 17.9002; 17.2758; 28.6959 90; 106.539; 90 | 8506.78 | Stadler, Adrian-Mihail; Lehn, Jean-Marie P Coupled Nanomechanical Motions: Metal-Ion-Effected, pH-Modulated, Simultaneous Extension/Contraction Motions of Double-Domain Helical/Linear Molecular Strands. Journal of the American Chemical Society, 2014, 136, 3400-3409 |
| 4121511 | CIF | C32 H29.5 F12 N12.5 O12.5 Pb2 S4 | P -1 | 13.7212; 16.5853; 21.4884 97.914; 99.687; 91.271 | 4769.33 | Stadler, Adrian-Mihail; Lehn, Jean-Marie P Coupled Nanomechanical Motions: Metal-Ion-Effected, pH-Modulated, Simultaneous Extension/Contraction Motions of Double-Domain Helical/Linear Molecular Strands. Journal of the American Chemical Society, 2014, 136, 3400-3409 |
| 4121512 | CIF | C79 H30 Cl3 O Si | P -1 | 10.003; 15.818; 17.837 113.04; 92.89; 105.44 | 2465.12 | Abe, Yoko; Tanaka, Hideyuki; Guo, Yunlong; Matsuo, Yutaka; Nakamura, Eiichi Mobility of long-lived fullerene radical in solid state and nonlinear temperature dependence. Journal of the American Chemical Society, 2014, 136, 3366-3369 |
| 4121516 | CIF | C36 H36 F6 I N2 O6 Rh S2 | P -1 | 9.2666; 14.3505; 14.8731 82.2; 88.838; 87.538 | 1957.51 | Xie, Fang; Qi, Zisong; Yu, Songjie; Li, Xingwei Rh(III)- and Ir(III)-Catalyzed C-H Alkynylation of Arenes under Chelation Assistance. Journal of the American Chemical Society, 2014, 136, 4780-4787 |
| 4121517 | CIF | C56 H54 B2 Cl2 F8 N4 O2 P2 Pt S2 | P -1 | 10.8806; 13.5311; 20.3845 83.2982; 80.3787; 68.0669 | 2739.92 | McGuirk, C. Michael; Stern, Charlotte L.; Mirkin, Chad A. Small molecule regulation of self-association and catalytic activity in a supramolecular coordination complex. Journal of the American Chemical Society, 2014, 136, 4689-4696 |
| 4121518 | CIF | C23 H38 O5 Si | P 21 21 21 | 8.6924; 8.9976; 29.0972 90; 90; 90 | 2275.7 | Abbasov, Mikail E.; Hudson, Brandi M.; Tantillo, Dean J.; Romo, Daniel Acylammonium salts as dienophiles in diels-alder/lactonization organocascades. Journal of the American Chemical Society, 2014, 136, 4492-4495 |
| 4121519 | CIF | C30 H46 Br N O5 Si | P 1 | 13.4034; 13.4037; 17.8225 89.539; 89.62; 87.393 | 3198.4 | Abbasov, Mikail E.; Hudson, Brandi M.; Tantillo, Dean J.; Romo, Daniel Acylammonium salts as dienophiles in diels-alder/lactonization organocascades. Journal of the American Chemical Society, 2014, 136, 4492-4495 |
| 4121520 | CIF | C20 H34 O5 Si | P 1 21 1 | 16.6474; 34.4793; 19.1312 90; 95.85; 90 | 10923.9 | Abbasov, Mikail E.; Hudson, Brandi M.; Tantillo, Dean J.; Romo, Daniel Acylammonium salts as dienophiles in diels-alder/lactonization organocascades. Journal of the American Chemical Society, 2014, 136, 4492-4495 |
| 4121521 | CIF | C39 H24 Co3 N5 O13 | P -4 c 2 | 17.5207; 17.5207; 15.1261 90; 90; 90 | 4643.3 | Zeng, Ming-Hua; Yin, Zheng; Tan, Yan-Xi; Zhang, Wei-Xiong; He, Yan-Ping; Kurmoo, Mohamedally Nanoporous Cobalt(II) MOF Exhibiting Four Magnetic Ground States and Changes in Gas Sorption upon Post-Synthetic Modification. Journal of the American Chemical Society, 2014, 136, 4680-4688 |
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