Crystallography Open Database
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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 138
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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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 |
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