Crystallography Open Database
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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 140
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4131915 | CIF | C55 H88 B2 Ca N12 | P -1 | 11.864; 12.059; 20.598 96.07; 95.89; 99.03 | 2873 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
| 4131916 | CIF | C62 H110 B2 Ca2 N12 O3 | P -1 | 11.6278; 15.9075; 19.5703 79.691; 80.461; 80.899 | 3481.3 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
| 4131917 | CIF | C30 H53 B Ca N6 O | P 1 21/n 1 | 22.2039; 12.3521; 27.028 90; 101.36; 90 | 7267.6 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
| 4131918 | CIF | C55 H108 Ca2 O6 | P 1 21 1 | 12.3787; 19.6198; 12.7078 90; 111.5; 90 | 2871.6 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
| 4131919 | CIF | C52.5 H105.5 Ca2 O5 | P 1 21/n 1 | 13.0501; 19.3522; 22.1731 90; 92.027; 90 | 5596.3 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
| 4131920 | CIF | C8 H24 Ca Ga2 | C m c 21 | 7.388; 19.802; 9.63 90; 90; 90 | 1408.8 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
| 4131921 | CIF | C27 H19 N2 P | C 1 2 1 | 15.317; 8.924; 16.982 90; 111.376; 90 | 2161.6 | Hashimoto, Naoki; Umano, Rika; Ochi, Yusuke; Shimahara, Kiyoka; Nakamura, Jun; Mori, Shigeki; Ohta, Hidetoshi; Watanabe, Yutaka; Hayashi, Minoru Synthesis and Photophysical Properties of λ<sup>5</sup>-Phosphinines as a Tunable Fluorophore. Journal of the American Chemical Society, 2018, 140, 2046-2049 |
| 4131922 | CIF | C19 H13 N2 P | C 1 2 1 | 15.138; 9.219; 28.143 90; 100.742; 90 | 3859 | Hashimoto, Naoki; Umano, Rika; Ochi, Yusuke; Shimahara, Kiyoka; Nakamura, Jun; Mori, Shigeki; Ohta, Hidetoshi; Watanabe, Yutaka; Hayashi, Minoru Synthesis and Photophysical Properties of λ<sup>5</sup>-Phosphinines as a Tunable Fluorophore. Journal of the American Chemical Society, 2018, 140, 2046-2049 |
| 4131923 | CIF | C21 H21 N O5 | P -1 | 6.4957; 9.6763; 14.8709 97.388; 95.474; 100.439 | 904.82 | Wang, Gang-Wei; Bower, John F. Modular Access to Azepines by Directed Carbonylative C-C Bond Activation of Aminocyclopropanes. Journal of the American Chemical Society, 2018, 140, 2743-2747 |
| 4131924 | CIF | C276 H288 Cl6 N6 Ni18 O36 S30 | P -1 | 18.052; 23.231; 26.344 70.236; 77.675; 86.573 | 10156 | Wang, Shentang; Gao, Xiaohui; Hang, Xinxin; Zhu, Xiaofei; Han, Haitao; Li, Xiaokun; Liao, Wuping; Chen, Wei Calixarene-Based {Ni<sub>18</sub>} Coordination Wheel: Highly Efficient Electrocatalyst for the Glucose Oxidation and Template for the Homogenous Cluster Fabrication. Journal of the American Chemical Society, 2018, 140, 6271-6277 |
| 4131925 | CIF | C10 H20 Cl2 Cu N16 O8 | C 1 2/c 1 | 15.0672; 9.0113; 17.5426 90; 97.696; 90 | 2360.39 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131926 | CIF | C8 H20 Cl2 Cu N20 O6 | P 1 21/n 1 | 13.1028; 10.7288; 16.2265 90; 95.036; 90 | 2272.3 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131927 | CIF | C8 H16 Cl2 Cu N16 O6 | P 1 21/n 1 | 7.6403; 10.0072; 13.623 90; 90.4; 90 | 1041.56 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131928 | CIF | C10 H16 Cl2 Cu N16 O6 | C 1 2/c 1 | 14.6638; 8.9883; 16.3538 90; 90.324; 90 | 2155.44 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131929 | CIF | C10 H16 Cl2 Cu N16 O6 | P -1 | 6.7837; 8.182; 10.1959 108.068; 101.188; 90.137 | 526.6 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131930 | CIF | C6 H12 Cl2 Cu N12 O6 | C 1 2/m 1 | 13.5622; 15.5713; 7.7338 90; 91.559; 90 | 1632.6 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131931 | CIF | C12 H20 Cl2 Cu N16 O6 | P 1 21/n 1 | 10.7286; 6.8178; 15.5263 90; 100.469; 90 | 1116.77 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131932 | CIF | C4 H14 Cl2 Cu N10 O8 | P -1 | 6.5617; 7.526; 9.0097 111.762; 98.711; 104.197 | 385.81 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131933 | CIF | C8 H16 Cl2 Cu N16 O6 | P -1 | 7.2932; 10.9456; 12.417 93.041; 96.845; 91.156 | 982.43 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131934 | CIF | C15 H24 Cl2 Cu N24 O6 | P -3 c 1 | 10.9642; 10.9642; 14.3772 90; 90; 120 | 1496.78 | Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209 |
| 4131935 | CIF | C57 H72 Ce N9 | R -3 c :H | 18.626; 18.626; 55.983 90; 90; 120 | 16820 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131936 | CIF | C36 H72 Ce N9 | P -1 | 10.0315; 11.8803; 17.842 82.423; 85.788; 89.638 | 2102.09 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131937 | CIF | C39 H84 Ce N9 | P 1 21/c 1 | 13.2861; 19.9413; 18.6655 90; 109.946; 90 | 4648.6 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131938 | CIF | C48 H96 Ce N9 | C 1 2/c 1 | 24.249; 13.9439; 18.4167 90; 115.072; 90 | 5640.4 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131939 | CIF | C42 H96 Ce N9 Si3 | P 1 21/c 1 | 12.8493; 10.7028; 39.41 90; 93.013; 90 | 5412.3 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131940 | CIF | C67 H116 Ce I2 Li N6 O2 | P 1 21/n 1 | 20.8203; 15.8035; 20.8531 90; 90.547; 90 | 6861.1 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131941 | CIF | C81 H132 Ce N9 | R 3 c :H | 44.203; 44.203; 26.08 90; 90; 120 | 44131 | Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595 |
| 4131942 | CIF | C20 H22 Cl F3 N2 O | P 21 21 21 | 8.998; 11.5663; 17.6674 90; 90; 90 | 1838.71 | Ye, Ke-Yin; Pombar, Gisselle; Fu, Niankai; Sauer, Gregory S.; Keresztes, Ivan; Lin, Song Anodically Coupled Electrolysis for the Heterodifunctionalization of Alkenes. Journal of the American Chemical Society, 2018, 140, 2438-2441 |
| 4131943 | CIF | C20 H20 N2 O4 | P 21 21 21 | 9.64769; 11.43518; 15.03401 90; 90; 90 | 1658.6 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131944 | CIF | C23 H26 N2 O7 | P -1 | 8.161; 10.276; 13.734 102.45; 97.861; 112.29 | 1009.7 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131945 | CIF | C24 H26 N2 O7 | P -1 | 6.8694; 10.0331; 15.3665 81.1902; 88.6152; 89.8076 | 1046.28 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131946 | CIF | C20 H16 Br3 N4 Ru | P -1 | 7.2777; 8.2938; 9.0157 77.686; 83.158; 69.733 | 498.14 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131947 | CIF | C22 H24 N2 O5 | P 1 21/n 1 | 8.7314; 18.821; 11.6512 90; 102.367; 90 | 1870.26 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131948 | CIF | C49.5 H55 N4 O12.5 S2 | C 1 2 1 | 45.773; 7.9396; 13.4558 90; 97.262; 90 | 4850.87 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131949 | CIF | C23 H26 N2 O6 | P 1 21/n 1 | 12.0865; 13.2673; 13.6282 90; 115.234; 90 | 1976.81 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131950 | CIF | C24 H30 N2 O6 | P 1 21/n 1 | 10.9813; 8.0063; 24.4059 90; 98.934; 90 | 2119.72 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131951 | CIF | C21 H20 N2 O5 | P -1 | 7.2219; 9.354; 13.497 84.894; 85.225; 68.613 | 844.3 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131952 | CIF | C24 H28 N2 O6 | P -1 | 7.9625; 10.842; 12.972 74.54; 74.559; 87.974 | 1039.6 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131953 | CIF | C24 H26 N2 O7 | A e a 2 | 13.6713; 37.374; 8.2094 90; 90; 90 | 4194.6 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131954 | CIF | C21 H20.18 N2 O5.09 | P 21 21 21 | 7.84898; 14.47011; 15.52093 90; 90; 90 | 1762.8 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131955 | CIF | C22 H24 Cl2 N2 O4 | P -1 | 7.3663; 11.4058; 12.1822 85.2854; 81.2598; 85.079 | 1005.43 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131956 | CIF | C23 H27 Cl3 N2 O6 | P 1 21/n 1 | 11.221; 7.2383; 29.137 90; 96.855; 90 | 2349.6 | Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400 |
| 4131957 | CIF | C170 H142 Cl4 N8 O18.66667 | C 1 2 1 | 47.826; 21.1891; 27.0097 90; 94.628; 90 | 27282 | Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772 |
| 4131958 | CIF | C52 H40 O4 | P 21 21 21 | 6.5343; 17.9861; 32.523 90; 90; 90 | 3822.3 | Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772 |
| 4131959 | CIF | C30 H16 | P 21 21 21 | 5.146; 18.162; 20.254 90; 90; 90 | 1892.97 | Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772 |
| 4131960 | CIF | C171.33333 H144.66667 Cl6.66667 N8 O24 | C 1 2 1 | 47.641; 21.1704; 27.0403 90; 94.904; 90 | 27172 | Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772 |
| 4131961 | CIF | C12 H13 N3 O6 S | P 1 21/c 1 | 7.4332; 8.2644; 22.734 90; 96.542; 90 | 1387.5 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131962 | CIF | C27 H30 N4 O11 S2 | P -1 | 10.817; 11.154; 13.163 92.607; 112.415; 92.17 | 1464 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131963 | CIF | C16 H15 N5 O5 S | P -1 | 7.0021; 9.7512; 13.0986 70.369; 88.781; 82.494 | 834.91 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131964 | CIF | C12 H13 N3 O5 S | P 1 21/n 1 | 7.3537; 14.8454; 12.3215 90; 94.038; 90 | 1341.78 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131965 | CIF | C18 H21 N5 O8 S2 | P b c a | 10.4132; 13.5716; 29.547 90; 90; 90 | 4175.69 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131966 | CIF | C12 H14 N4 O8 S | P 1 21/c 1 | 7.017; 17.287; 12.578 90; 94.34; 90 | 1521.4 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131967 | CIF | C18 H23 N5 O6 S2 | I 1 2/a 1 | 11.6451; 8.0014; 22.6883 90; 91.37; 90 | 2113.4 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131968 | CIF | C16 H26 N5 O8 S2 | P -1 | 9.9888; 10.2796; 12.3288 68.939; 79.698; 69.115 | 1101.9 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131969 | CIF | C16 H17 N7 O10 S2 | P -1 | 7.7154; 11.5739; 12.5866 68.866; 83.563; 82.184 | 1036.19 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131970 | CIF | C58 H64 N4 O13 S4 | C 1 2/c 1 | 26.738; 7.081; 30.146 90; 90.53; 90 | 5707.4 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131971 | CIF | C26 H26 N4 O12 S2 | P -1 | 6.0303; 9.721; 12.4638 98.012; 94.549; 97.848 | 713.12 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131972 | CIF | C20 H23 N3 O5 S | P 1 21/n 1 | 14.5751; 7.3814; 18.0511 90; 92.517; 90 | 1940.15 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131973 | CIF | C26 H28 N2 O8 S2 | P 1 21/n 1 | 5.7205; 20.45; 11.7153 90; 102.871; 90 | 1336.1 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131974 | CIF | C24 H22 N4 O12 S2 | P 1 21/n 1 | 12.9855; 7.3929; 13.8095 90; 100.742; 90 | 1302.49 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131975 | CIF | C24 H26 N2 O9 S2 | P -1 | 7.7042; 12.1758; 13.3268 84.238; 89.648; 83.067 | 1234.68 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131976 | CIF | C24 H26 N2 O11 S2 | P 1 21/c 1 | 12.9248; 7.3758; 26.709 90; 91.338; 90 | 2545.49 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131977 | CIF | C28 H32 N2 O8 S2 | C 1 2/c 1 | 21.8681; 5.6881; 23.3203 90; 101.161; 90 | 2845.9 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131978 | CIF | C10 H12 N O4 S | P 1 21/c 1 | 8.124; 5.7011; 23.0661 90; 93.074; 90 | 1066.79 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131979 | CIF | C10 H12 N O3 S | P 1 21/n 1 | 8.8901; 7.0512; 16.8721 90; 95.229; 90 | 1053.24 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131980 | CIF | C10 H11 N2 O5 S | I 1 2/a 1 | 17.884; 6.712; 19.8456 90; 112.723; 90 | 2197.3 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131981 | CIF | C28 H32 N2 O8 S2 | C 1 2/c 1 | 27.044; 6.9584; 15.834 90; 118.16; 90 | 2627 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131982 | CIF | C28 H32 N2 O6 S2 | C 1 2/c 1 | 15.3959; 7.2509; 23.9608 90; 92.573; 90 | 2672.1 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131983 | CIF | C30 H36 N2 O6 S2 | P 1 21/n 1 | 19.9706; 7.039; 21.9707 90; 113.547; 90 | 2831.3 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131984 | CIF | C28 H32 N4 O11 S2 | P -1 | 10.6823; 11.4435; 13.2985 87.212; 70.525; 81.733 | 1516.7 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131985 | CIF | C10 H11 Cl N O3 S | P 1 21/n 1 | 5.9637; 15.7025; 11.9733 90; 95.124; 90 | 1116.76 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131986 | CIF | C9 H9 Cl N O4 S | P 1 21/c 1 | 8.1551; 5.7169; 22.5197 90; 94.011; 90 | 1047.34 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131987 | CIF | C21 H21 Cl3 N3 O6 S2 | P -1 | 10.1766; 10.7552; 12.5205 95.045; 109.245; 102.571 | 1243.69 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131988 | CIF | C12 H11 Cl2 N3 O5 S | C 1 2/c 1 | 22.1231; 7.2432; 19.3126 90; 100.197; 90 | 3045.81 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131989 | CIF | C13 H14 Cl N3 O5 S | P 1 21/c 1 | 7.2666; 14.9473; 15.224 90; 99.744; 90 | 1629.7 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131990 | CIF | C12 H12 Cl N3 O6 S | P -1 | 7.4388; 8.519; 12.2969 90.408; 107.029; 94.769 | 742.12 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131991 | CIF | C12 H12 Cl N3 O5 S | P c c n | 21.7735; 14.1989; 9.4343 90; 90; 90 | 2916.71 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131992 | CIF | C12 H11 Cl N4 O7 S | P -1 | 7.3874; 9.6593; 11.6166 74.226; 82.828; 72.285 | 759.08 | Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145 |
| 4131993 | CIF | C54 H45 B F15 Fe N4 O | P -1 | 13.052; 15.755; 24.071 90.625; 91.925; 91.633 | 4944.7 | Abucayon, Erwin G.; Khade, Rahul L.; Powell, Douglas R.; Zhang, Yong; Richter-Addo, George B Lewis Acid Activation of the Ferrous Heme-NO Fragment toward the N-N Coupling Reaction with NO To Generate N<sub>2</sub>O. Journal of the American Chemical Society, 2018, 140, 4204-4207 |
| 4131994 | CIF | C12 H7 F3 N2 | P 1 21/n 1 | 8.722; 14.03; 8.981 90; 111.139; 90 | 1025 | Kobayashi, Kensuke; Horiuchi, Sachio; Ishibashi, Shoji; Murakami, Youichi; Kumai, Reiji Field-Induced Antipolar-Polar Structural Transformation and Giant Electrostriction in Organic Crystal. Journal of the American Chemical Society, 2018, 140, 3842-3845 |
| 4131995 | CIF | C12 H7 F3 N2 | A e a 2 | 14.047; 14.609; 10.026 90; 90; 90 | 2057.5 | Kobayashi, Kensuke; Horiuchi, Sachio; Ishibashi, Shoji; Murakami, Youichi; Kumai, Reiji Field-Induced Antipolar-Polar Structural Transformation and Giant Electrostriction in Organic Crystal. Journal of the American Chemical Society, 2018, 140, 3842-3845 |
| 4131996 | CIF | C10 H6 N S2 | P -1 | 9.431; 9.479; 10.55 77.104; 86.491; 75.335 | 889.4 | Bates, Demetris; Robertson, Craig M.; Leitch, Alicea A.; Dube, Paul A.; Oakley, Richard T. Magnetic Bistability in Naphtho-1,3,2-dithiazolyl: Solid State Interconversion of a Thiazyl π-Radical and Its N-N σ-Bonded Dimer. Journal of the American Chemical Society, 2018, 140, 3846-3849 |
| 4131997 | CIF | C10 H12 Cu F6 N10 O Si | C 1 2/c 1 | 16.3598; 11.2335; 21.3117 90; 91.676; 90 | 3914.9 | Bao, Zongbi; Xie, Danyan; Chang, Ganggang; Wu, Hui; Li, Liangying; Zhou, Wei; Wang, Hailong; Zhang, Zhiguo; Xing, Huabin; Yang, Qiwei; Zaworotko, Michael J.; Ren, Qilong; Chen, Banglin Fine Tuning and Specific Binding Sites with a Porous Hydrogen-Bonded Metal-Complex Framework for Gas Selective Separations. Journal of the American Chemical Society, 2018, 140, 4596-4603 |
| 4131998 | CIF | C20 H24 Cu2 F12 N20 O2 Si2 | C m c m | 16.9982; 11.0287; 21.318 90; 90; 90 | 3996.4 | Bao, Zongbi; Xie, Danyan; Chang, Ganggang; Wu, Hui; Li, Liangying; Zhou, Wei; Wang, Hailong; Zhang, Zhiguo; Xing, Huabin; Yang, Qiwei; Zaworotko, Michael J.; Ren, Qilong; Chen, Banglin Fine Tuning and Specific Binding Sites with a Porous Hydrogen-Bonded Metal-Complex Framework for Gas Selective Separations. Journal of the American Chemical Society, 2018, 140, 4596-4603 |
| 4131999 | CIF | C32 H38 O2 | P 1 21 1 | 13.24067; 7.76255; 24.8383 90; 91.3423; 90 | 2552.21 | Hao, Wei; Harenberg, Johannes H.; Wu, Xiangyu; MacMillan, Samantha N.; Lin, Song Diastereo- and Enantioselective Formal [3 + 2] Cycloaddition of Cyclopropyl Ketones and Alkenes via Ti-Catalyzed Radical Redox Relay. Journal of the American Chemical Society, 2018, 140, 3514-3517 |
| 4132000 | CIF | C20 H22 O | P 1 21 1 | 5.8408; 16.7324; 7.8935 90; 92.485; 90 | 770.71 | Hao, Wei; Harenberg, Johannes H.; Wu, Xiangyu; MacMillan, Samantha N.; Lin, Song Diastereo- and Enantioselective Formal [3 + 2] Cycloaddition of Cyclopropyl Ketones and Alkenes via Ti-Catalyzed Radical Redox Relay. Journal of the American Chemical Society, 2018, 140, 3514-3517 |
| 4132001 | CIF | C244 H256 N16 O8 Si4 Ti4 | P -1 | 12.843; 20.558; 23.39 72.79; 77.72; 72.76 | 5580.91 | Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L. Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons. Journal of the American Chemical Society, 2018, 140, 4973-4976 |
| 4132002 | CIF | C52 H71 N4 O2 Si Ti | P 1 21/n 1 | 12.8621; 21.1899; 18.839 90; 104.842; 90 | 4963.2 | Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L. Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons. Journal of the American Chemical Society, 2018, 140, 4973-4976 |
| 4132003 | CIF | C46 H66 N4 O2 Si Ti | P 1 21/n 1 | 12.4428; 27.623; 13.2015 90; 92.073; 90 | 4534.5 | Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L. Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons. Journal of the American Chemical Society, 2018, 140, 4973-4976 |
| 4132004 | CIF | C19 H22 O6 | P 1 n 1 | 4.7391; 12.8346; 14.2014 90; 96.2262; 90 | 858.7 | Tao, Daniel J.; Slutskyy, Yuriy; Muuronen, Mikko; Le, Alexander; Kohler, Philipp; Overman, Larry E. Total Synthesis of (-)-Chromodorolide B By a Computationally-Guided Radical Addition/Cyclization/Fragmentation Cascade. Journal of the American Chemical Society, 2018, 140, 3091-3102 |
| 4132005 | CIF | C32 H25 Cl2 F N O3 P Pd S | P 1 21/c 1 | 12.7112; 14.8397; 15.9385 90; 98.6077; 90 | 2972.6 | Chen, Xiao-Yang; Sorensen, Erik J. Pd-Catalyzed, ortho C-H Methylation and Fluorination of Benzaldehydes Using Orthanilic Acids as Transient Directing Groups. Journal of the American Chemical Society, 2018, 140, 2789-2792 |
| 4132006 | CIF | C70 H81.6 Cl4 Fe N10 O15.8 | P 1 21/c 1 | 20.3631; 28.602; 12.6388 90; 94.0855; 90 | 7342.5 | Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433 |
| 4132007 | CIF | C70 H81.6 Cl4 Fe N10 O15.8 | P 1 21/c 1 | 20.1522; 28.5668; 12.54945 90; 94.1381; 90 | 7205.68 | Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433 |
| 4132008 | CIF | C70.78 H83.12 Cl4 N10 O15.78 Zn | P 1 21/c 1 | 20.4333; 28.681; 12.643 90; 94.243; 90 | 7389.1 | Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433 |
| 4132009 | CIF | C70 H81.6 Cl4 Fe N10 O15.8 | P 1 21/c 1 | 20.566; 28.5805; 12.7724 90; 94.822; 90 | 7480.9 | Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433 |
| 4132010 | CIF | C13 H19 Br F6 O2 | P 1 21/n 1 | 7.071; 21.45; 10.258 90; 95.885; 90 | 1547.7 | Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353 |
| 4132011 | CIF | C17 H21 I N2 O7 | P 1 21/c 1 | 18.1478; 6.6216; 17.9704 90; 114.684; 90 | 1962.14 | Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353 |
| 4132012 | CIF | C10 H13 F12 N O3 | P -1 | 9.5076; 9.6913; 9.753 103.771; 91.642; 113.628 | 791.84 | Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353 |
| 4132013 | CIF | C32 H34 N6 O5 | P 1 21/n 1 | 11.8321; 13.4953; 19.2839 90; 105.58; 90 | 2966.1 | An, Peng; Lewandowski, Tracey M.; Erbay, Tuğçe G; Liu, Peng; Lin, Qing Sterically Shielded, Stabilized Nitrile Imine for Rapid Bioorthogonal Protein Labeling in Live Cells. Journal of the American Chemical Society, 2018, 140, 4860-4868 |
| 4132014 | CIF | C22 H18 N6 O | P 1 21/n 1 | 18.7948; 5.1334; 21.0251 90; 116.317; 90 | 1818.28 | An, Peng; Lewandowski, Tracey M.; Erbay, Tuğçe G; Liu, Peng; Lin, Qing Sterically Shielded, Stabilized Nitrile Imine for Rapid Bioorthogonal Protein Labeling in Live Cells. Journal of the American Chemical Society, 2018, 140, 4860-4868 |
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