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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4130771 | CIF | C25 H27 Br O4 | P 1 21/c 1 | 18.1209; 6.9681; 17.8943 90; 102.802; 90 | 2203.3 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130772 | CIF | C19 H28 O3 | P 1 21 1 | 8.6715; 10.3828; 9.4244 90; 100.887; 90 | 833.25 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130773 | CIF | C19 H24 O5 | P 1 21/n 1 | 17.606; 10.2852; 19.9102 90; 116.176; 90 | 3235.61 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130774 | CIF | C19 H22 O5 | P 31 | 15.2396; 15.2396; 6.5378 90; 90; 120 | 1314.95 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130775 | CIF | C19 H26 O3 Si | P 1 21 1 | 10.0283; 6.7122; 14.1747 90; 101.993; 90 | 933.3 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130776 | CIF | C319 H24 O3 | P -1 | 11.1643; 11.8846; 12.7007 75.011; 76.716; 89.935 | 1581.23 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130777 | CIF | C18 H24 O3 | P 1 21/c 1 | 9.13; 7.6658; 21.832 90; 95.398; 90 | 1521.2 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130778 | CIF | C19 H24 O5 | P 1 21/n 1 | 13.798; 7.124; 16.8297 90; 94.256; 90 | 1649.7 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130779 | CIF | C19 H28 O3 | P 1 21/n 1 | 10.3974; 12.7181; 13.2489 90; 112.175; 90 | 1622.4 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130780 | CIF | C17 H22 O2 | P 1 21/c 1 | 21.5194; 10.6148; 12.7272 90; 102.271; 90 | 2840.8 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130781 | CIF | C19 H25 I O5 | P 1 21/c 1 | 9.8414; 24.468; 7.9373 90; 108.333; 90 | 1814.3 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130782 | CIF | C17 H22 O2 | P 1 21/c 1 | 10.931; 9.641; 13.213 90; 92.018; 90 | 1391.6 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130783 | CIF | C18 H26 O3 | P c a 21 | 14.6942; 9.3324; 11.6047 90; 90; 90 | 1591.4 | Cernijenko, Artiom; Risgaard, Rune; Baran, Phil S. 11-Step Total Synthesis of (-)-Maoecrystal V. Journal of the American Chemical Society, 2016, 138, 9425-9428 |
4130784 | CIF | C254 H205 F48 Fe4 N31 O2 Sb8 | P -1 | 22.5576; 25.9536; 26.6117 102.011; 93.562; 100.843 | 14883.3 | Ronson, Tanya K.; Pilgrim, Ben S.; Nitschke, Jonathan R. Pathway-Dependent Post-assembly Modification of an Anthracene-Edged M(II)4L6 Tetrahedron. Journal of the American Chemical Society, 2016, 138, 10417-10420 |
4130785 | CIF | C313 H183 F48 Fe4 N26 Sb8 | P -1 | 21.8874; 27.4261; 30.8088 64.666; 87.269; 79.937 | 16450.7 | Ronson, Tanya K.; Pilgrim, Ben S.; Nitschke, Jonathan R. Pathway-Dependent Post-assembly Modification of an Anthracene-Edged M(II)4L6 Tetrahedron. Journal of the American Chemical Society, 2016, 138, 10417-10420 |
4130786 | CIF | C330 H165 Cl8 Fe4 N51 O32 | R -3 :H | 26.1142; 26.1142; 110.422 90; 90; 120 | 65214 | Ronson, Tanya K.; Pilgrim, Ben S.; Nitschke, Jonathan R. Pathway-Dependent Post-assembly Modification of an Anthracene-Edged M(II)4L6 Tetrahedron. Journal of the American Chemical Society, 2016, 138, 10417-10420 |
4130787 | CIF | C71 H90 Cl2 Fe N4 O3 Si2 | P 1 21/c 1 | 19.251; 16.018; 21.996 90; 92.636; 90 | 6775.6 | Hickox, Hunter P.; Wang, Yuzhong; Xie, Yaoming; Wei, Pingrong; Schaefer, 3rd, Henry F; Robinson, Gregory H. Push-Pull Stabilization of Parent Monochlorosilylenes. Journal of the American Chemical Society, 2016, 138, 9799-9802 |
4130788 | CIF | C1.17 H0.53 O0.24 Zr0.05 | P m -3 n | 41.512; 41.512; 41.512 90; 90; 90 | 71535 | Ji, Pengfei; Manna, Kuntal; Lin, Zekai; Urban, Ania; Greene, Francis X.; Lan, Guangxu; Lin, Wenbin Single-Site Cobalt Catalysts at New Zr8(μ2-O)8(μ2-OH)4 Metal-Organic Framework Nodes for Highly Active Hydrogenation of Alkenes, Imines, Carbonyls, and Heterocycles. Journal of the American Chemical Society, 2016, 138, 12234-12242 |
4130789 | CIF | C2.17 O0.45 Zr0.09 | P m -3 n | 41.616; 41.616; 41.616 90; 90; 90 | 72074 | Ji, Pengfei; Manna, Kuntal; Lin, Zekai; Urban, Ania; Greene, Francis X.; Lan, Guangxu; Lin, Wenbin Single-Site Cobalt Catalysts at New Zr8(μ2-O)8(μ2-OH)4 Metal-Organic Framework Nodes for Highly Active Hydrogenation of Alkenes, Imines, Carbonyls, and Heterocycles. Journal of the American Chemical Society, 2016, 138, 12234-12242 |
4130790 | CIF | C1.25 Hf0.05 O0.26 | P m -3 n | 41.516; 41.516; 41.516 90; 90; 90 | 71556 | Ji, Pengfei; Manna, Kuntal; Lin, Zekai; Urban, Ania; Greene, Francis X.; Lan, Guangxu; Lin, Wenbin Single-Site Cobalt Catalysts at New Zr8(μ2-O)8(μ2-OH)4 Metal-Organic Framework Nodes for Highly Active Hydrogenation of Alkenes, Imines, Carbonyls, and Heterocycles. Journal of the American Chemical Society, 2016, 138, 12234-12242 |
4130791 | CIF | C6 H12 Fe N8 O2 Sr | C 1 2/c 1 | 12.2629; 7.4837; 15.1106 90; 106.601; 90 | 1328.93 | Duyker, Samuel G.; Hill, Joshua A.; Howard, Christopher J.; Goodwin, Andrew L. Guest-Activated Forbidden Tilts in a Molecular Perovskite Analogue. Journal of the American Chemical Society, 2016, 138, 11121-11123 |
4130792 | CIF | C6 H8 Fe N8 Sr | P 1 21/n 1 | 7.4087; 7.5926; 10.7605 90; 90.336; 90 | 605.28 | Duyker, Samuel G.; Hill, Joshua A.; Howard, Christopher J.; Goodwin, Andrew L. Guest-Activated Forbidden Tilts in a Molecular Perovskite Analogue. Journal of the American Chemical Society, 2016, 138, 11121-11123 |
4130793 | CIF | C18 H26 N4 Ni | C 1 2/c 1 | 14.251; 13.1814; 9.2333 90; 98.28; 90 | 1716.38 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
4130794 | CIF | C46 H54 B N4 Ni O | P -1 | 8.96; 14.2611; 16.7826 88.779; 75.985; 73.867 | 1996.3 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
4130795 | CIF | C30 H40 N4 Ni O | P 1 n 1 | 11.5021; 17.8327; 12.9451 90; 90.026; 90 | 2655.2 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
4130796 | CIF | C62 H76 B N4 Ni O3 | P 1 21/c 1 | 18.0244; 12.6029; 23.9084 90; 98.41; 90 | 5372.6 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
4130797 | CIF | C20 H26 F12 N6 Ni P2 | P 1 21/n 1 | 9.2668; 16.5937; 18.2485 90; 92.739; 90 | 2802.9 | Schultz, Jason W.; Fuchigami, Kei; Zheng, Bo; Rath, Nigam P.; Mirica, Liviu M. Isolated Organometallic Nickel(III) and Nickel(IV) Complexes Relevant to Carbon-Carbon Bond Formation Reactions. Journal of the American Chemical Society, 2016, 138, 12928-12934 |
4130798 | CIF | C30 H20 | P 1 c 1 | 5.945; 7.244; 40.577 90; 91.345; 90 | 1747 | Yamaguchi, Yuji; Takubo, Maki; Ogawa, Keisuke; Nakayama, Ken-Ichi; Koganezawa, Tomoyuki; Katagiri, Hiroshi Terazulene Isomers: Polarity Change of OFETs through Molecular Orbital Distribution Contrast. Journal of the American Chemical Society, 2016, 138, 11335-11343 |
4130799 | CIF | C30 H20 | P 1 | 6.0461; 7.3963; 20.9073 81.327; 89.655; 88.536 | 923.95 | Yamaguchi, Yuji; Takubo, Maki; Ogawa, Keisuke; Nakayama, Ken-Ichi; Koganezawa, Tomoyuki; Katagiri, Hiroshi Terazulene Isomers: Polarity Change of OFETs through Molecular Orbital Distribution Contrast. Journal of the American Chemical Society, 2016, 138, 11335-11343 |
4130800 | CIF | C30 H20 | P -1 | 5.917; 7.782; 20.718 81.545; 87.448; 89.023 | 942.6 | Yamaguchi, Yuji; Takubo, Maki; Ogawa, Keisuke; Nakayama, Ken-Ichi; Koganezawa, Tomoyuki; Katagiri, Hiroshi Terazulene Isomers: Polarity Change of OFETs through Molecular Orbital Distribution Contrast. Journal of the American Chemical Society, 2016, 138, 11335-11343 |
4130801 | CIF | C18 H18 O3 S | P -1 | 6.1119; 10.41; 13.6296 76.812; 81.978; 82.825 | 832.15 | Li, Yuanyuan; Qiu, Dachuan; Gu, Rongrong; Wang, Junli; Shi, Jiarong; Li, Yang Aryne 1,2,3-Trifunctionalization with Aryl Allyl Sulfoxides. Journal of the American Chemical Society, 2016, 138, 10814-10817 |
4130802 | CIF | C19 H27 Au I P | P 1 21 1 | 8.5059; 10.5556; 11.4816 90; 93.9911; 90 | 1028.37 | Rekhroukh, Feriel; Estevez, Laura; Mallet-Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier β-Hydride Elimination at Low-Coordinate Gold(III) Centers. Journal of the American Chemical Society, 2016, 138, 11920-11929 |
4130803 | CIF | C17 H23 Au I P | P b c a | 8.2625; 13.7282; 32.2865 90; 90; 90 | 3662.2 | Rekhroukh, Feriel; Estevez, Laura; Mallet-Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier β-Hydride Elimination at Low-Coordinate Gold(III) Centers. Journal of the American Chemical Society, 2016, 138, 11920-11929 |
4130804 | CIF | C19 H22 N2 O | F d d 2 | 17.6684; 50.2977; 7.4226 90; 90; 90 | 6596.3 | McCreanor, Niall G.; Stanton, Steven; Bower, John F. Capture-Collapse Heterocyclization: 1,3-Diazepanes by C-N Reductive Elimination from Rhodacyclopentanones. Journal of the American Chemical Society, 2016, 138, 11465-11468 |
4130805 | CIF | C22 H24 N2 O4 | P -1 | 9.614; 10.268; 10.553 67.181; 83.169; 84.093 | 951.6 | McCreanor, Niall G.; Stanton, Steven; Bower, John F. Capture-Collapse Heterocyclization: 1,3-Diazepanes by C-N Reductive Elimination from Rhodacyclopentanones. Journal of the American Chemical Society, 2016, 138, 11465-11468 |
4130806 | CIF | C18 H18 N2 O2 S | C 1 2/c 1 | 16.4142; 10.5216; 19.1349 90; 101.713; 90 | 3235.85 | McCreanor, Niall G.; Stanton, Steven; Bower, John F. Capture-Collapse Heterocyclization: 1,3-Diazepanes by C-N Reductive Elimination from Rhodacyclopentanones. Journal of the American Chemical Society, 2016, 138, 11465-11468 |
4130807 | CIF | C41 H42.18 Cl1.12 Co N4 P | P 1 21/n 1 | 12.2774; 18.0919; 16.3936 90; 94.5253; 90 | 3630 | Tokmic, Kenan; Markus, Charles R.; Zhu, Lingyang; Fout, Alison R. Well-Defined Cobalt(I) Dihydrogen Catalyst: Experimental Evidence for a Co(I)/Co(III) Redox Process in Olefin Hydrogenation. Journal of the American Chemical Society, 2016, 138, 11907-11913 |
4130808 | CIF | C41 H42 Co N6 P | P 1 21/n 1 | 7.8946; 16.5851; 27.3473 90; 94.4478; 90 | 3569.9 | Tokmic, Kenan; Markus, Charles R.; Zhu, Lingyang; Fout, Alison R. Well-Defined Cobalt(I) Dihydrogen Catalyst: Experimental Evidence for a Co(I)/Co(III) Redox Process in Olefin Hydrogenation. Journal of the American Chemical Society, 2016, 138, 11907-11913 |
4130809 | CIF | C6 H19 B10 N O | P 1 21/n 1 | 6.782; 16.6525; 12.2196 90; 100.039; 90 | 1358.9 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
4130810 | CIF | C12 H30 B10 N2 O2 | C 1 2/c 1 | 29.8616; 6.6361; 20.4917 90; 99.0968; 90 | 4009.66 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
4130811 | CIF | C10 H25 B10 N O2 | P 1 21/n 1 | 8.0349; 18.023; 12.072 90; 96.799; 90 | 1735.9 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
4130812 | CIF | C10 H21 B10 N O2 S | C 1 2/c 1 | 24.2592; 7.3926; 19.8972 90; 98.5493; 90 | 3528.7 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
4130813 | CIF | C10 H21 B10 N O3 S | C 1 2/c 1 | 25.0743; 7.4905; 19.9945 90; 101.104; 90 | 3685 | Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Transition Metal Catalyzed Direct Amination of the Cage B(4)-H Bond in o-Carboranes: Synthesis of Tertiary, Secondary, and Primary o-Carboranyl Amines. Journal of the American Chemical Society, 2016, 138, 12727-12730 |
4130814 | CIF | C60 H48 Cl4 O8 | P 1 21 1 | 14.713; 11.1639; 16.1379 90; 103.704; 90 | 2575.3 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
4130815 | CIF | C60 H48 Cl4 O8 | P 1 21 1 | 14.7006; 11.1469; 16.1292 90; 103.773; 90 | 2567 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
4130816 | CIF | C47 H34 Cl2 O8 | C 1 2/c 1 | 29.664; 11.951; 26.712 90; 105.51; 90 | 9125 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
4130817 | CIF | C60 H48 Cl4 O8 | C 1 2/c 1 | 43.667; 14.9611; 31.555 90; 133.563; 90 | 14938 | Xiong, Jia-Bin; Feng, Hai-Tao; Sun, Jian-Ping; Xie, Wen-Zhao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song The Fixed Propeller-Like Conformation of Tetraphenylethylene that Reveals Aggregation-Induced Emission Effect, Chiral Recognition, and Enhanced Chiroptical Property. Journal of the American Chemical Society, 2016, 138, 11469-11472 |
4130818 | CIF | C22 H23 Cl N O2 S2 | P 21 n b | 9.4658; 11.3757; 19.3517 90; 90; 90 | 2083.79 | Kennemur, Jennifer L.; Kortman, Gregory D.; Hull, Kami L. Rhodium-Catalyzed Regiodivergent Hydrothiolation of Allyl Amines and Imines. Journal of the American Chemical Society, 2016, 138, 11914-11919 |
4130819 | CIF | C17 H17 Br N4 O2 | P 1 21 1 | 10.587; 5.476; 15.006 90; 98.981; 90 | 859.3 | Momiyama, Norie; Tabuse, Hideaki; Noda, Hirofumi; Yamanaka, Masahiro; Fujinami, Takeshi; Yamanishi, Katsunori; Izumiseki, Atsuto; Funayama, Kosuke; Egawa, Fuyuki; Okada, Shino; Adachi, Hiroaki; Terada, Masahiro Molecular Design of a Chiral Brønsted Acid with Two Different Acidic Sites: Regio-, Diastereo-, and Enantioselective Hetero-Diels-Alder Reaction of Azopyridinecarboxylate with Amidodienes Catalyzed by Chiral Carboxylic Acid-Monophosphoric Acid. Journal of the American Chemical Society, 2016, 138, 11353-11359 |
4130820 | CIF | C26 H22 Br F3 N4 O4 | P 21 21 21 | 6.7967; 15.8; 23.896 90; 90; 90 | 2566.1 | Momiyama, Norie; Tabuse, Hideaki; Noda, Hirofumi; Yamanaka, Masahiro; Fujinami, Takeshi; Yamanishi, Katsunori; Izumiseki, Atsuto; Funayama, Kosuke; Egawa, Fuyuki; Okada, Shino; Adachi, Hiroaki; Terada, Masahiro Molecular Design of a Chiral Brønsted Acid with Two Different Acidic Sites: Regio-, Diastereo-, and Enantioselective Hetero-Diels-Alder Reaction of Azopyridinecarboxylate with Amidodienes Catalyzed by Chiral Carboxylic Acid-Monophosphoric Acid. Journal of the American Chemical Society, 2016, 138, 11353-11359 |
4130821 | CIF | C65 H63 O8 P Si | P 21 21 21 | 9.777; 14.488; 38.079 90; 90; 90 | 5393.9 | Momiyama, Norie; Tabuse, Hideaki; Noda, Hirofumi; Yamanaka, Masahiro; Fujinami, Takeshi; Yamanishi, Katsunori; Izumiseki, Atsuto; Funayama, Kosuke; Egawa, Fuyuki; Okada, Shino; Adachi, Hiroaki; Terada, Masahiro Molecular Design of a Chiral Brønsted Acid with Two Different Acidic Sites: Regio-, Diastereo-, and Enantioselective Hetero-Diels-Alder Reaction of Azopyridinecarboxylate with Amidodienes Catalyzed by Chiral Carboxylic Acid-Monophosphoric Acid. Journal of the American Chemical Society, 2016, 138, 11353-11359 |
4130822 | CIF | C208 H234 Au44 S26 | P -1 | 19.097; 24.0131; 29.8101 88.62; 89.464; 71.411 | 12953.3 | Liao, Lingwen; Zhuang, Shengli; Yao, Chuanhao; Yan, Nan; Chen, Jishi; Wang, Chengming; Xia, Nan; Liu, Xu; Li, Man-Bo; Li, Lingling; Bao, Xiaoli; Wu, Zhikun Structure of Chiral Au44(2,4-DMBT)26 Nanocluster with an 18-Electron Shell Closure. Journal of the American Chemical Society, 2016, 138, 10425-10428 |
4130823 | CIF | C14 H18 F7 N O2 | P 1 21/c 1 | 14.135; 12.502; 9.632 90; 100.507; 90 | 1673.6 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
4130824 | CIF | C13 H10 F7 N O2 | P 43 21 2 | 13.3576; 13.3576; 16.362 90; 90; 90 | 2919.4 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
4130825 | CIF | C32 H41 B2 F8 Fe N7 O4 | P b c a | 16.8624; 18.8653; 22.9188 90; 90; 90 | 7290.8 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
4130826 | CIF | C17 H26 B2 F8 Fe N4 O4 | P 1 21 1 | 8.4516; 13.5668; 11.368 90; 97.205; 90 | 1293.2 | Lu, Deng-Fu; Zhu, Cheng-Liang; Sears, Jeffrey D.; Xu, Hao Iron(II)-Catalyzed Intermolecular Aminofluorination of Unfunctionalized Olefins Using Fluoride Ion. Journal of the American Chemical Society, 2016, 138, 11360-11367 |
4130827 | CIF | C36 H28 B2 F20 N2 O3 S2 | C 1 2 1 | 18.608; 10.59; 20.591 90; 98.67; 90 | 4011.3 | Li, Songlei; Li, Gen; Meng, Wei; Du, Haifeng A Frustrated Lewis Pair Catalyzed Asymmetric Transfer Hydrogenation of Imines Using Ammonia Borane. Journal of the American Chemical Society, 2016, 138, 12956-12962 |
4130828 | CIF | C31 H38 N2 O11 S | P 1 21/c 1 | 14.4739; 16.2599; 14.1217 90; 110.575; 90 | 3111.5 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
4130829 | CIF | C22 H27 N O4 | P 1 c 1 | 9.5745; 17.2047; 12.0212 90; 103.504; 90 | 1925.5 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
4130830 | CIF | C25 H35 N O6 | C 1 2/c 1 | 23.9341; 11.7122; 16.9699 90; 109.488; 90 | 4484.5 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
4130831 | CIF | C22 H27 N O4 | P 1 21/n 1 | 6.7056; 19.1395; 14.5164 90; 98.255; 90 | 1843.8 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
4130832 | CIF | C23 H29 N O5 | P 1 c 1 | 6.7971; 17.5258; 8.2107 90; 91.635; 90 | 977.7 | Kou, Kevin G. M.; Li, Beryl X.; Lee, Jack C.; Gallego, Gary M.; Lebold, Terry P.; DiPasquale, Antonio G.; Sarpong, Richmond Syntheses of Denudatine Diterpenoid Alkaloids: Cochlearenine, N-Ethyl-1α-hydroxy-17-veratroyldictyzine, and Paniculamine. Journal of the American Chemical Society, 2016, 138, 10830-10833 |
4130833 | CIF | C67.5 H55.5 Cl8.5 N5 O3.25 Rh | I 4 | 25.0036; 25.0036; 23.9683 90; 90; 90 | 14984.5 | Nakamura, Munechika; Kishimoto, Kazuki; Kobori, Yasuhiro; Abe, Tomoka; Yoza, Kenji; Kobayashi, Kenji Self-Assembled Molecular Gear: A 4:1 Complex of Rh(III)Cl Tetraarylporphyrin and Tetra(p-pyridyl)cavitand. Journal of the American Chemical Society, 2016, 138, 12564-12577 |
4130834 | CIF | C30 H44 Cl3 Mg N3 O | P 21 21 21 | 7.9066; 17.551; 22.4279 90; 90; 90 | 3112.3 | Rosen, Tomer; Goldberg, Israel; Venditto, Vincenzo; Kol, Moshe Tailor-Made Stereoblock Copolymers of Poly(lactic acid) by a Truly Living Polymerization Catalyst. Journal of the American Chemical Society, 2016, 138, 12041-12044 |
4130835 | CIF | C40 H53 Cl Hf Si2 Sn | P n m a | 31.894; 15.394; 7.9405 90; 90; 90 | 3898.6 | Kuwabara, Takuya; Nakada, Marisa; Hamada, Jumpei; Guo, Jing Dong; Nagase, Shigeru; Saito, Masaichi (η(4)-Butadiene)Sn(0) Complexes: A New Approach for Zero-Valent p-Block Elements Utilizing a Butadiene as a 4π-Electron Donor. Journal of the American Chemical Society, 2016, 138, 11378-11382 |
4130836 | CIF | C42 H58 Hf O Si2 Sn | P 21 21 21 | 8.0406; 15.0059; 33.2314 90; 90; 90 | 4009.6 | Kuwabara, Takuya; Nakada, Marisa; Hamada, Jumpei; Guo, Jing Dong; Nagase, Shigeru; Saito, Masaichi (η(4)-Butadiene)Sn(0) Complexes: A New Approach for Zero-Valent p-Block Elements Utilizing a Butadiene as a 4π-Electron Donor. Journal of the American Chemical Society, 2016, 138, 11378-11382 |
4130837 | CIF | C40 H64 N2 Si2 | P -1 | 9.229; 10.253; 11.671 89.69; 77.64; 64.1 | 965.5 | Mohapatra, Chandrajeet; Kundu, Subrata; Paesch, Alexander N.; Herbst-Irmer, Regine; Stalke, Dietmar; Andrada, Diego M.; Frenking, Gernot; Roesky, Herbert W. The Structure of the Carbene Stabilized Si2H2 May Be Equally Well Described with Coordinate Bonds as with Classical Double Bonds. Journal of the American Chemical Society, 2016, 138, 10429-10432 |
4130838 | CIF | C16 H23 N O | P 1 21 1 | 6.3276; 15.14; 14.425 90; 94.901; 90 | 1376.9 | Guo, Wusheng; Martínez-Rodríguez, Luis; Kuniyil, Rositha; Martin, Eddy; Escudero-Adán, Eduardo C; Maseras, Feliu; Kleij, Arjan W. Stereoselective and Versatile Preparation of Tri- and Tetrasubstituted Allylic Amine Scaffolds under Mild Conditions. Journal of the American Chemical Society, 2016, 138, 11970-11978 |
4130839 | CIF | C17 H19 N O | C 1 2/c 1 | 30.582; 12.1062; 7.4499 90; 97.785; 90 | 2732.8 | Guo, Wusheng; Martínez-Rodríguez, Luis; Kuniyil, Rositha; Martin, Eddy; Escudero-Adán, Eduardo C; Maseras, Feliu; Kleij, Arjan W. Stereoselective and Versatile Preparation of Tri- and Tetrasubstituted Allylic Amine Scaffolds under Mild Conditions. Journal of the American Chemical Society, 2016, 138, 11970-11978 |
4130840 | CIF | C47.5 H75 N6 P3 Si3 | P 1 21/c 1 | 21.4117; 21.3974; 25.7847 90; 114.123; 90 | 10781.7 | Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred Pnictogen-Silicon Analogues of Benzene. Journal of the American Chemical Society, 2016, 138, 10433-10436 |
4130841 | CIF | C48.5 H73 As3 N6 Si3 | F d d d :2 | 21.5579; 21.7446; 46.7236 90; 90; 90 | 21902.5 | Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred Pnictogen-Silicon Analogues of Benzene. Journal of the American Chemical Society, 2016, 138, 10433-10436 |
4130842 | CIF | C42 H46 As2 D12 N4 Si2 | P -1 | 9.29; 9.9536; 12.5142 69.954; 77.338; 86.516 | 1060.5 | Seitz, Andreas E.; Eckhardt, Maria; Erlebach, Andreas; Peresypkina, Eugenia V.; Sierka, Marek; Scheer, Manfred Pnictogen-Silicon Analogues of Benzene. Journal of the American Chemical Society, 2016, 138, 10433-10436 |
4130843 | CIF | C8 H6 O4 | P -1 | 5.0374; 5.3641; 7.0068 72.004; 76.098; 87.219 | 174.73 | Karothu, Durga Prasad; Weston, James; Desta, Israel Tilahun; Naumov, Panče Shape-Memory and Self-Healing Effects in Mechanosalient Molecular Crystals. Journal of the American Chemical Society, 2016, 138, 13298-13306 |
4130844 | CIF | C8 H6 O4 | P -1 | 3.7793; 6.4791; 7.404 82.942; 81.006; 88.982 | 177.71 | Karothu, Durga Prasad; Weston, James; Desta, Israel Tilahun; Naumov, Panče Shape-Memory and Self-Healing Effects in Mechanosalient Molecular Crystals. Journal of the American Chemical Society, 2016, 138, 13298-13306 |
4130845 | CIF | C8 H6 O4 | P -1 | 5.0384; 5.3623; 7.006 71.993; 76.093; 87.198 | 174.67 | Karothu, Durga Prasad; Weston, James; Desta, Israel Tilahun; Naumov, Panče Shape-Memory and Self-Healing Effects in Mechanosalient Molecular Crystals. Journal of the American Chemical Society, 2016, 138, 13298-13306 |
4130846 | CIF | C36.5 H21 Cl O | P 1 21 1 | 15.0088; 10.2881; 16.7851 90; 105.568; 90 | 2496.7 | Sako, Makoto; Takeuchi, Yoshiki; Tsujihara, Tetsuya; Kodera, Junpei; Kawano, Tomikazu; Takizawa, Shinobu; Sasai, Hiroaki Efficient Enantioselective Synthesis of Oxahelicenes Using Redox/Acid Cooperative Catalysts. Journal of the American Chemical Society, 2016, 138, 11481-11484 |
4130847 | CIF | C24 H17 N O6 | P 1 21/c 1 | 7.417; 10.589; 25.5745 90; 93.439; 90 | 2005 | Liu, Chong; Zeng, Chenjie; Luo, Tian-Yi; Merg, Andrea D.; Jin, Rongchao; Rosi, Nathaniel L. Establishing Porosity Gradients within Metal-Organic Frameworks Using Partial Postsynthetic Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 12045-12048 |
4130848 | CIF | C16 H10 Br N O4 | P -1 | 3.9365; 12.261; 15.859 111.241; 91.027; 91.753 | 712.8 | Liu, Chong; Zeng, Chenjie; Luo, Tian-Yi; Merg, Andrea D.; Jin, Rongchao; Rosi, Nathaniel L. Establishing Porosity Gradients within Metal-Organic Frameworks Using Partial Postsynthetic Ligand Exchange. Journal of the American Chemical Society, 2016, 138, 12045-12048 |
4130849 | CIF | C13 H15 B N2 | C 1 2/c 1 | 22.7448; 6.433; 16.2309 90; 105.714; 90 | 2286.1 | Gellrich, Urs; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Reversible Aromaticity Transfer in a Bora-Cycle: Boron-Ligand Cooperation. Journal of the American Chemical Society, 2016, 138, 13307-13313 |
4130850 | CIF | C20 H19 B N2 O2 | P 1 21/c 1 | 11.76794; 11.3623; 13.01027 90; 104.026; 90 | 1687.75 | Gellrich, Urs; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David Reversible Aromaticity Transfer in a Bora-Cycle: Boron-Ligand Cooperation. Journal of the American Chemical Society, 2016, 138, 13307-13313 |
4130851 | CIF | C33 H30 Cu F5 N2 | C 1 2/c 1 | 8.4885; 22.9762; 15.9265 90; 99.651; 90 | 3062.2 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130852 | CIF | C14 H15 Cl N2 O3 | P -1 | 6.9147; 7.9421; 13.3691 97.113; 101.828; 99.78 | 698.52 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130853 | CIF | C8 H12 N2 O2 S | P 1 21/c 1 | 10.0597; 10.189; 19.756 90; 95.22; 90 | 2016.56 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130854 | CIF | C12 H14 N2 O2 S | P 1 21/c 1 | 6.1687; 22.867; 8.7061 90; 94.893; 90 | 1223.6 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130855 | CIF | C32 H42 Br Cu N3 O0.5 S | P b c n | 16.3196; 19.5049; 20.4967 90; 90; 90 | 6524.3 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130856 | CIF | C32 H34 Cu F4 N3 O2 | P -1 | 9.9952; 11.0255; 16.6818 107.292; 93.899; 113.654 | 1570.52 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130857 | CIF | C12 H13 F4 N O3 | P 1 21/c 1 | 13.3949; 5.0875; 19.3422 90; 102.165; 90 | 1288.51 | Xie, Weilong; Yoon, Jung Hee; Chang, Sukbok (NHC)Cu-Catalyzed Mild C-H Amidation of (Hetero)arenes with Deprotectable Carbamates: Scope and Mechanistic Studies. Journal of the American Chemical Society, 2016, 138, 12605-12614 |
4130858 | CIF | C11 H17 N5 O2 | C 1 2 1 | 28.274; 4.8094; 10.6249 90; 107.141; 90 | 1380.6 | Krishnan, Baiju P.; Rai, Rishika; Asokan, Aromal; Sureshan, Kana M. Crystal-to-Crystal Synthesis of Triazole-Linked Pseudo-proteins via Topochemical Azide-Alkyne Cycloaddition Reaction. Journal of the American Chemical Society, 2016, 138, 14824-14827 |
4130859 | CIF | C20 H19 Br O2 | P 1 21 1 | 5.4275; 18.9357; 16.5145 90; 91.1186; 90 | 1696.9 | Erickson, Lucas W.; Lucas, Erika L.; Tollefson, Emily J.; Jarvo, Elizabeth R. Nickel-Catalyzed Cross-Electrophile Coupling of Alkyl Fluorides: Stereospecific Synthesis of Vinylcyclopropanes. Journal of the American Chemical Society, 2016, 138, 14006-14011 |
4130860 | CIF | C14 H18 O4 S | P 21 21 21 | 5.355; 8.9629; 28.7336 90; 90; 90 | 1379.11 | Erickson, Lucas W.; Lucas, Erika L.; Tollefson, Emily J.; Jarvo, Elizabeth R. Nickel-Catalyzed Cross-Electrophile Coupling of Alkyl Fluorides: Stereospecific Synthesis of Vinylcyclopropanes. Journal of the American Chemical Society, 2016, 138, 14006-14011 |
4130861 | CIF | C20 H22 O4 S | P 1 21 1 | 5.7195; 14.2673; 11.2806 90; 90.5948; 90 | 920.47 | Erickson, Lucas W.; Lucas, Erika L.; Tollefson, Emily J.; Jarvo, Elizabeth R. Nickel-Catalyzed Cross-Electrophile Coupling of Alkyl Fluorides: Stereospecific Synthesis of Vinylcyclopropanes. Journal of the American Chemical Society, 2016, 138, 14006-14011 |
4130862 | CIF | C51 H56 N10 O11 Zn | P 1 21/c 1 | 11.1579; 41.517; 12.1931 90; 104.766; 90 | 5461.8 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
4130863 | CIF | C51 H56 Mn N10 O11 | P 1 21/c 1 | 11.2462; 41.9047; 12.0982 90; 104.024; 90 | 5531.6 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
4130864 | CIF | C51 H56 Fe N10 O11 | P 1 21/c 1 | 11.134; 41.701; 12.1981 90; 104.828; 90 | 5475 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
4130865 | CIF | C51 H56 N10 Ni O11 | P 1 21/c 1 | 11.1373; 41.835; 12.177 90; 104.831; 90 | 5484.6 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
4130866 | CIF | C25 H27 N5 O5 | P 1 21/c 1 | 10.3389; 7.9833; 28.328 90; 93.658; 90 | 2333.39 | Sevov, Christo S.; Fisher, Sydney L.; Thompson, Levi T.; Sanford, Melanie S. Mechanism-Based Development of a Low-Potential, Soluble, and Cyclable Multielectron Anolyte for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society, 2016, 138, 15378-15384 |
4130867 | CIF | C57 H44 O6 | C 1 2/c 1 | 23.676; 19.0674; 19.8863 90; 104.224; 90 | 8702.2 | Xu, Feng; Hershey, Kyle W.; Holmes, Russell J.; Hoye, Thomas R. Blue-Emitting Arylalkynyl Naphthalene Derivatives via a Hexadehydro-Diels-Alder Cascade Reaction. Journal of the American Chemical Society, 2016, 138, 12739-12742 |
4130868 | CIF | C60 H68 N28 O34 | P 21 21 21 | 16.931; 18.21; 25.511 90; 90; 90 | 7865 | Lazar, Alexandra I.; Biedermann, Frank; Mustafina, Kamila R.; Assaf, Khaleel I.; Hennig, Andreas; Nau, Werner M. Nanomolar Binding of Steroids to Cucurbit[n]urils: Selectivity and Applications. Journal of the American Chemical Society, 2016, 138, 13022-13029 |
4130869 | CIF | C28 H14 B2 N2 O8 S2 | P 1 n 1 | 7.2433; 20.504; 27.708 90; 90; 90 | 4115.1 | Carrillo, Josue Ayuso; Turner, Michael L.; Ingleson, Michael J. A General Protocol for the Polycondensation of Thienyl N-Methyliminodiacetic Acid Boronate Esters To Form High Molecular Weight Copolymers. Journal of the American Chemical Society, 2016, 138, 13361-13368 |
4130870 | CIF | C44 H69 B2 N3 O8 S2 | P -1 | 8.286; 10.6177; 28.689 82.158; 83.815; 69.036 | 2330.15 | Carrillo, Josue Ayuso; Turner, Michael L.; Ingleson, Michael J. A General Protocol for the Polycondensation of Thienyl N-Methyliminodiacetic Acid Boronate Esters To Form High Molecular Weight Copolymers. Journal of the American Chemical Society, 2016, 138, 13361-13368 |
4130871 | CIF | C54 H68 B4 Cl4 O8 | P 1 21/n 1 | 6.7782; 34.87; 12.1646 90; 100.344; 90 | 2828.4 | Huang, Ze-Ao; Chen, Chen; Yang, Xiao-Di; Fan, Xiang-Bing; Zhou, Wen; Tung, Chen-Ho; Wu, Li-Zhu; Cong, Huan Synthesis of Oligoparaphenylene-Derived Nanohoops Employing an Anthracene Photodimerization-Cycloreversion Strategy. Journal of the American Chemical Society, 2016, 138, 11144-11147 |
4130872 | CIF | C100 H64 | P -1 | 16.5652; 17.2511; 19.2794 68.221; 79.126; 74.271 | 4900.6 | Huang, Ze-Ao; Chen, Chen; Yang, Xiao-Di; Fan, Xiang-Bing; Zhou, Wen; Tung, Chen-Ho; Wu, Li-Zhu; Cong, Huan Synthesis of Oligoparaphenylene-Derived Nanohoops Employing an Anthracene Photodimerization-Cycloreversion Strategy. Journal of the American Chemical Society, 2016, 138, 11144-11147 |
4130873 | CIF | C52 H47 N4 O Rh S2 | P 1 21/n 1 | 11.6759; 23.0296; 16.4573 90; 92.66; 90 | 4420.5 | Huang, Xiaoqiang; Webster, Richard D.; Harms, Klaus; Meggers, Eric Asymmetric Catalysis with Organic Azides and Diazo Compounds Initiated by Photoinduced Electron Transfer. Journal of the American Chemical Society, 2016, 138, 12636-12642 |
4130874 | CIF | C22 H21 Br N2 O3 | P 21 21 21 | 9.8543; 13.1873; 15.4684 90; 90; 90 | 2010.14 | Huang, Xiaoqiang; Webster, Richard D.; Harms, Klaus; Meggers, Eric Asymmetric Catalysis with Organic Azides and Diazo Compounds Initiated by Photoinduced Electron Transfer. Journal of the American Chemical Society, 2016, 138, 12636-12642 |
4130875 | CIF | C32 H40 Cl2 Ir2 N4 O5 | C 1 c 1 | 33.1646; 16.8051; 16.116 90; 102.709; 90 | 8761.9 | Sharninghausen, Liam S.; Sinha, Shashi Bhushan; Shopov, Dimitar Y.; Choi, Bonnie; Mercado, Brandon Q.; Roy, Xavier; Balcells, David; Brudvig, Gary W.; Crabtree, Robert H. High Oxidation State Iridium Mono-μ-oxo Dimers Related to Water Oxidation Catalysis. Journal of the American Chemical Society, 2016, 138, 15917-15926 |
4130876 | CIF | C32 H40 Cl2 Ir2 N4 O5 | C 1 2/c 1 | 22.2543; 8.3385; 18.2152 90; 98.991; 90 | 3338.6 | Sharninghausen, Liam S.; Sinha, Shashi Bhushan; Shopov, Dimitar Y.; Choi, Bonnie; Mercado, Brandon Q.; Roy, Xavier; Balcells, David; Brudvig, Gary W.; Crabtree, Robert H. High Oxidation State Iridium Mono-μ-oxo Dimers Related to Water Oxidation Catalysis. Journal of the American Chemical Society, 2016, 138, 15917-15926 |
4130877 | CIF | C32 H40 Cl2 Ir2 N4 O5 | P -1 | 10.8298; 12.6652; 15.9733 69.833; 89.721; 67.888 | 1885.6 | Sharninghausen, Liam S.; Sinha, Shashi Bhushan; Shopov, Dimitar Y.; Choi, Bonnie; Mercado, Brandon Q.; Roy, Xavier; Balcells, David; Brudvig, Gary W.; Crabtree, Robert H. High Oxidation State Iridium Mono-μ-oxo Dimers Related to Water Oxidation Catalysis. Journal of the American Chemical Society, 2016, 138, 15917-15926 |
4130878 | CIF | C38 H36 Au F2 N | P 1 21/c 1 | 17.69275; 12.14541; 15.50402 90; 114.032; 90 | 3042.8 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130879 | CIF | C34.83 H39.33 Au Cl2.33 F N | I 41/a :2 | 31.0475; 31.0475; 41.4313 90; 90; 90 | 39937.6 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130880 | CIF | C12 H9 Au F3 N | P b c a | 7.45956; 16.6803; 16.8248 90; 90; 90 | 2093.47 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130881 | CIF | C15.5 H17 Au Cl F2 N O3 | C 1 2/c 1 | 13.7561; 16.1; 14.8396 90; 101.209; 90 | 3223.88 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130882 | CIF | C47 H58 Au N | P 1 21/a 1 | 18.8532; 10.5063; 19.8505 90; 93.844; 90 | 3923.1 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130883 | CIF | C24 H15 Au F11 N O3 | P n a 21 | 21.1376; 16.4885; 7.53055 90; 90; 90 | 2624.6 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130884 | CIF | C20 H12 Au Br F7 N | P -1 | 9.0882; 9.6379; 13.1489 76.8345; 74.7697; 64.6373 | 995.36 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130885 | CIF | C12 H9 Au Cl2 F N | P b c a | 7.8063; 17.0746; 17.892 90; 90; 90 | 2384.81 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130886 | CIF | C20 H12 Au F8 N | P n a 21 | 15.4933; 26.3923; 4.40199 90; 90; 90 | 1799.99 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130887 | CIF | C26 H14 Au F10 N | P 1 21/c 1 | 7.3719; 18.1864; 17.5332 90; 93.3304; 90 | 2346.68 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130888 | CIF | C15 H16 Au Cl2 N O3 | P -1 | 7.4578; 11.0845; 19.2172 84.5978; 89.4342; 87.8411 | 1580.4 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130889 | CIF | C19 H12 Au F6 N | P 1 21/n 1 | 10.2954; 9.799; 17.9311 90; 104.827; 90 | 1748.74 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130890 | CIF | C13 H12 Au F2 N | P 1 21/c 1 | 7.5121; 18.0598; 17.0484 90; 99.554; 90 | 2280.82 | Kumar, Roopender; Linden, Anthony; Nevado, Cristina Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids. Journal of the American Chemical Society, 2016, 138, 13790-13793 |
4130891 | CIF | C71 H106 Ge N2 Si2 | R -3 :H | 37.7343; 37.7343; 25.323 90; 90; 120 | 31226 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
4130892 | CIF | C83 H117 Ge N2 Si2 | P -1 | 15.9617; 16.6009; 17.9948 114.148; 112.883; 96.575 | 3790.4 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
4130893 | CIF | C77 H108 Ge N2 Si2 | P -1 | 11.4319; 14.6466; 21.5014 100.512; 92.045; 95.265 | 3519.7 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
4130894 | CIF | C76.25 H115 Ge N2 Si2 | P 1 21/n 1 | 12.6352; 23.8472; 25.5287 90; 101.535; 90 | 7536.8 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
4130895 | CIF | C74.5 H107 Ge N3 Si2 | P 1 21/n 1 | 12.7844; 22.7467; 23.418 90; 94.49; 90 | 6789.1 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
4130896 | CIF | C81 H127 Ge N3 Si2 | P 1 21/n 1 | 13.255; 25.4218; 23.768 90; 101.111; 90 | 7858.9 | Nieder, David; Huch, Volker; Yildiz, Cem B.; Scheschkewitz, David Regiodiscriminating Reactivity of Isolable NHC-Coordinated Disilenyl Germylene and Its Cyclic Isomer. Journal of the American Chemical Society, 2016, 138, 13996-14005 |
4130897 | CIF | C146 H112 Cl18 N8 O8 | I -4 | 28.178; 28.178; 8.7335 90; 90; 90 | 6934 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
4130898 | CIF | C16 H7 N O3 | P -1 | 7.2916; 8.7529; 9.7443 88.49; 69.51; 67.04 | 532 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
4130899 | CIF | C176.75 H189 Cl4.5 N8 O8 Zn | C 1 2/c 1 | 29.19; 28.114; 42.68 90; 102.19; 90 | 34236 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
4130900 | CIF | C21 H21 Cl2 N3 O2 | P 1 21 1 | 7.1366; 12.004; 11.688 90; 102.43; 90 | 977.8 | Zhylitskaya, Halina; Cybińska, Joanna; Chmielewski, Piotr; Lis, Tadeusz; Stępień, Marcin Bandgap Engineering in π-Extended Pyrroles. A Modular Approach to Electron-Deficient Chromophores with Multi-Redox Activity. Journal of the American Chemical Society, 2016, 138, 11390-11398 |
4130901 | CIF | C18 H12 Br F2 N O2 | P 1 21 1 | 7.2467; 12.0275; 9.5303 90; 109.102; 90 | 784.92 | Huang, Yinhua; Hayashi, Tamio Rhodium-Catalyzed Asymmetric Arylation/Defluorination of 1-(Trifluoromethyl)alkenes Forming Enantioenriched 1,1-Difluoroalkenes. Journal of the American Chemical Society, 2016, 138, 12340-12343 |
4130902 | CIF | C108 H156 K2 O16 Si2 | P 1 21/c 1 | 14.2971; 31.786; 13.0756 90; 94.512; 90 | 5923.8 | Rudebusch, Gabriel E.; Espejo, Guzmán L; Zafra, José L; Peña-Alvarez, Miriam; Spisak, Sarah N.; Fukuda, Kotaro; Wei, Zheng; Nakano, Masayoshi; Petrukhina, Marina A.; Casado, Juan; Haley, Michael M. A Biradical Balancing Act: Redox Amphoterism in a Diindenoanthracene Derivative Results from Quinoidal Acceptor and Aromatic Donor Motifs. Journal of the American Chemical Society, 2016, 138, 12648-12654 |
4130903 | CIF | C88 H120 K2 O8 Si2 | P -1 | 9.169; 15.4719; 17.6353 66.24; 84.584; 81.803 | 2264.45 | Rudebusch, Gabriel E.; Espejo, Guzmán L; Zafra, José L; Peña-Alvarez, Miriam; Spisak, Sarah N.; Fukuda, Kotaro; Wei, Zheng; Nakano, Masayoshi; Petrukhina, Marina A.; Casado, Juan; Haley, Michael M. A Biradical Balancing Act: Redox Amphoterism in a Diindenoanthracene Derivative Results from Quinoidal Acceptor and Aromatic Donor Motifs. Journal of the American Chemical Society, 2016, 138, 12648-12654 |
4130904 | CIF | C88 H116 K O8 Si2 | P -1 | 11.5995; 12.1738; 17.0652 78.478; 82.51; 72.257 | 2242.66 | Rudebusch, Gabriel E.; Espejo, Guzmán L; Zafra, José L; Peña-Alvarez, Miriam; Spisak, Sarah N.; Fukuda, Kotaro; Wei, Zheng; Nakano, Masayoshi; Petrukhina, Marina A.; Casado, Juan; Haley, Michael M. A Biradical Balancing Act: Redox Amphoterism in a Diindenoanthracene Derivative Results from Quinoidal Acceptor and Aromatic Donor Motifs. Journal of the American Chemical Society, 2016, 138, 12648-12654 |
4130905 | CIF | C24 H15 B F5 N | P 1 21/c 1 | 13.8288; 8.7441; 17.122 90; 111.064; 90 | 1932.05 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130906 | CIF | C24 H10 B F10 N | P 1 21/n 1 | 9.7376; 16.5554; 12.6822 90; 101.085; 90 | 2006.35 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130907 | CIF | C60 H28 B2 F36 N2 | P -1 | 8.8041; 16.8557; 20.7579 78.709; 79.587; 82.468 | 2956.43 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130908 | CIF | C27 H32 B N | P b c n | 31.316; 8.2742; 16.832 90; 90; 90 | 4361.4 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130909 | CIF | C42 H56 B N | P 1 21/c 1 | 11.275; 18.5252; 17.7958 90; 98.066; 90 | 3680.3 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130910 | CIF | C24 H20 B N | P 1 21/c 1 | 12.4542; 15.7598; 9.765 90; 107.055; 90 | 1832.35 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130911 | CIF | C30 H14 B F18 N | P -1 | 10.8184; 11.8123; 12.9256 76.622; 67.526; 70.094 | 1425.35 | Yang, Deng-Tao; Mellerup, Soren K.; Peng, Jin-Bao; Wang, Xiang; Li, Quan-Song; Wang, Suning Substituent Directed Phototransformations of BN-Heterocycles: Elimination vs Isomerization via Selective B-C Bond Cleavage. Journal of the American Chemical Society, 2016, 138, 11513-11516 |
4130912 | CIF | C30 H18 Cl2 In3 N9 O17 Zn2 | P 63/m m c | 13.81; 13.81; 18.33 90; 90; 120 | 3027 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130913 | CIF | C30 H18 Cl2 In3 N9 Ni2 O17 | P 63/m m c | 13.8618; 13.8618; 18.5079 90; 90; 120 | 3079.8 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130914 | CIF | C30 H18 Fe4 Mg N9 O19 | P 63/m m c | 13.857; 13.857; 17.925 90; 90; 120 | 2981 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130915 | CIF | C30 H18 Cl3 In5 N9 O16 | P 63/m m c | 13.873; 13.873; 18.455 90; 90; 120 | 3076 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130916 | CIF | C30 H18 Cl3 In3 Mn2 N9 O16 | P 63/m m c | 14.0529; 14.0529; 18.4071 90; 90; 120 | 3148.1 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130917 | CIF | C30 H18 Cl2 Co2 In3 N9 O17 | P 63/m m c | 13.905; 13.905; 18.4663 90; 90; 120 | 3092.1 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130918 | CIF | C30 H18 Cl3 Co2 In3 N12 O16 | P 63/m m c | 13.9818; 13.9818; 18.3209 90; 90; 120 | 3101.73 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130920 | CIF | C30 H24 Cl2 Co2 In3 N15 O17 | P 63/m m c | 14.1065; 14.1065; 18.2678 90; 90; 120 | 3148.2 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130921 | CIF | C30 H16 Cl2 Co2 In3 N9 O20 | P 63/m m c | 13.893; 13.893; 18.368 90; 90; 120 | 3070 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130922 | CIF | C30 H6 Cl2 Co2 In3 N12 O20 | P 63/m m c | 13.9738; 13.9738; 18.373 90; 90; 120 | 3107 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130923 | CIF | C30 H6 Cl2 Co2 In3 N9 O23 | P 63/m m c | 13.804; 13.804; 18.435 90; 90; 120 | 3042.2 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130924 | CIF | C42 H6 Cl4 Co2 In3 N9 O16 | P -3 1 c | 13.8392; 13.8392; 23.269 90; 90; 120 | 3859.5 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130925 | CIF | C30 H18 Ag3 In3 N9 O13 | P 63/m m c | 15.727; 15.727; 16.957 90; 90; 120 | 3632.2 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130926 | CIF | C30 H6 Cu3 Fe3 N9 O20 | P 63/m m c | 15.7672; 15.7672; 16.6814 90; 90; 120 | 3591.5 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130927 | CIF | C21 H9 Ag In3 N3 O16 | P -6 2 c | 13.636; 13.636; 14.9222 90; 90; 120 | 2402.9 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130928 | CIF | C21 H9 Cu Mg3 N3 O16 | P -6 2 c | 13.1696; 13.1696; 14.7973 90; 90; 120 | 2222.6 | Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society, 2016, 138, 15102-15105 |
4130929 | CIF | C38 H79 Ce Li N4 O5 Si3 | P -1 | 11.745; 12.572; 18.886 85.344; 78.547; 63 | 2435.1 | Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction. Journal of the American Chemical Society, 2016, 138, 12743-12746 |
4130930 | CIF | C71 H154 Ce2 Li2 N10 O14 Si6 | C 1 2/c 1 | 37.342; 11.365; 22.312 90; 99.875; 90 | 9329 | Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction. Journal of the American Chemical Society, 2016, 138, 12743-12746 |
4130931 | CIF | C30 H72 Ce N4 O Si4 | P 1 21/n 1 | 11.8041; 20.3061; 17.3715 90; 93.916; 90 | 4154.1 | Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas; Hayton, Trevor W. Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction. Journal of the American Chemical Society, 2016, 138, 12743-12746 |
4130932 | CIF | C65 H68 B D4 F24 P2 Rh | P 1 21/n 1 | 19.0579; 17.9828; 19.5453 90; 91.7138; 90 | 6695.46 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
4130933 | CIF | C65 H68 B D4 F24 P2 Rh | P 1 21/n 1 | 19.0579; 17.9828; 19.5453 90; 91.7138; 90 | 6695.46 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
4130934 | CIF | C65 H64 B D8 F24 P2 Rh | P 1 21/n 1 | 19.0579; 17.9828; 19.5453 90; 91.7138; 90 | 6695.46 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
4130935 | CIF | C65 H72 B F24 P2 Rh | P 1 21/c 1 | 19.1; 18.289; 27.926 90; 134.55; 90 | 6952 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
4130936 | CIF | C65 H70 B F24 P2 Rh | P -1 | 12.8281; 13.1804; 19.8019 93.895; 91.116; 94.19 | 3330.4 | Chadwick, F. Mark; Krämer, Tobias; Gutmann, Torsten; Rees, Nicholas H.; Thompson, Amber L.; Edwards, Alison J.; Buntkowsky, Gerd; Macgregor, Stuart A.; Weller, Andrew S. Selective C-H Activation at a Molecular Rhodium Sigma-Alkane Complex by Solid/Gas Single-Crystal to Single-Crystal H/D Exchange. Journal of the American Chemical Society, 2016, 138, 13369-13378 |
4130937 | CIF | C51 H34 F3 N2 O3 P Pd S | P 21 21 21 | 12.5207; 18.3664; 20.2423 90; 90; 90 | 4654.9 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
4130938 | CIF | C22.5 H17 Br Cl N2 | P 41 21 2 | 9.591; 9.591; 43.0251 90; 90; 90 | 3957.76 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
4130939 | CIF | C25 H17 Br0.5 N P0.5 Pd0.5 | P 1 | 11.1433; 11.3328; 20.944 85.41; 76.594; 63.661 | 2304.95 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
4130940 | CIF | C51 H38 Cl2 Cu F6 N4 P | P 21 21 21 | 13.455; 14.1052; 23.7803 90; 90; 90 | 4513.2 | Ramírez-López, Pedro; Ros, Abel; Romero-Arenas, Antonio; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M Synthesis of IAN-type N,N-Ligands via Dynamic Kinetic Asymmetric Buchwald-Hartwig Amination. Journal of the American Chemical Society, 2016, 138, 12053-12056 |
4130941 | CIF | C7 H18 Cl4 Cu N2 | P n a 21 | 14.2729; 7.7016; 12.3179 90; 90; 90 | 1354.03 | Su, Lebin; Dong, Jianyu; Liu, Long; Sun, Mengli; Qiu, Renhua; Zhou, Yongbo; Yin, Shuang-Feng Copper Catalysis for Selective Heterocoupling of Terminal Alkynes. Journal of the American Chemical Society, 2016, 138, 12348-12351 |
4130942 | CIF | C14 H10 F6 I2 O7 S2 | P 1 21/n 1 | 21.9618; 9.3625; 22.1686 90; 108.081; 90 | 4333.2 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
4130943 | CIF | C10 H7 F4 I O4 | P -1 | 4.1971; 10.0492; 14.9871 108.6; 93.4806; 93.8251 | 595.52 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
4130944 | CIF | C10 H9 B F5 I O4 | P -1 | 5.4807; 9.086; 14.021 78.903; 81.424; 89.698 | 677.3 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
4130945 | CIF | C10 H9 F2 I O4 | P 1 21/n 1 | 4.7135; 14.0456; 17.2837 90; 97.432; 90 | 1134.64 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
4130946 | CIF | C10 H11 B F3 I O4 | P 1 21/n 1 | 9.655; 8.3949; 16.7646 90; 94.564; 90 | 1354.51 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
4130947 | CIF | C9 H8 F3 I O5 S | P 1 21/c 1 | 10.4843; 18.257; 7.1821 90; 105.714; 90 | 1323.4 | Izquierdo, Susana; Essafi, Stéphanie; Del Rosal, Iker; Vidossich, Pietro; Pleixats, Roser; Vallribera, Adelina; Ujaque, Gregori; Lledós, Agustí; Shafir, Alexandr Acid Activation in Phenyliodine Dicarboxylates: Direct Observation, Structures, and Implications. Journal of the American Chemical Society, 2016, 138, 12747-12750 |
4130948 | CIF | C26 H49 N2 Si2 Ti | P 1 21/n 1 | 10.013; 10.1635; 27.9932 90; 96.198; 90 | 2832.1 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130949 | CIF | C26 H49 Cl N2 Si2 Ti | P 1 21/n 1 | 9.354; 34.1029; 9.8695 90; 112.423; 90 | 2910.32 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130950 | CIF | C35 H57 Cr N O3 Si3 Ti | P 1 21/n 1 | 16.947; 25.011; 18.486 90; 103.507; 90 | 7619 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130951 | CIF | C39 H55 Cl Cr O3 Si2 Ti | P -1 | 9.1532; 12.5803; 17.0067 83.424; 81.854; 87.114 | 1924.6 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130952 | CIF | C40 H52 Cr2 O6 Si2 Ti | P -1 | 11.3506; 11.4109; 19.1965 90.264; 92.62; 111.119 | 2316.33 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130953 | CIF | C37 H57 Cr O3 Si2 Ti | P -1 | 10.3627; 12.2002; 17.5696 70.851; 86.046; 65.795 | 1908.34 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130954 | CIF | C37 H57 Cl Cr O3 Si2 Zr | C 1 2/c 1 | 39.623; 12.6771; 17.4694 90; 108.997; 90 | 8297 | Pappas, Iraklis; Chirik, Paul J. Catalytic Proton Coupled Electron Transfer from Metal Hydrides to Titanocene Amides, Hydrazides and Imides: Determination of Thermodynamic Parameters Relevant to Nitrogen Fixation. Journal of the American Chemical Society, 2016, 138, 13379-13389 |
4130955 | CIF | C29 H33 Cu N5 O7 | R 3 2 :H | 18.3847; 18.3847; 48.568 90; 90; 120 | 14216.5 | Benson, Oguarabau; da Silva, Ivan; Argent, Stephen P.; Cabot, Rafel; Savage, Mathew; Godfrey, Harry G. W.; Yan, Yong; Parker, Stewart F.; Manuel, Pascal; Lennox, Matthew J.; Mitra, Tamoghna; Easun, Timothy L.; Lewis, William; Blake, Alexander J.; Besley, Elena; Yang, Sihai; Schröder, Martin Amides Do Not Always Work: Observation of Guest Binding in an Amide-Functionalized Porous Metal-Organic Framework. Journal of the American Chemical Society, 2016, 138, 14828-14831 |
4130956 | CIF | C22 H15 N O | P -1 | 8.8713; 9.1631; 11.2812 83.142; 78.687; 71.594 | 851.58 | Pearson, Ryan M.; Lim, Chern-Hooi; McCarthy, Blaine G.; Musgrave, Charles B.; Miyake, Garret M. Organocatalyzed Atom Transfer Radical Polymerization Using N-Aryl Phenoxazines as Photoredox Catalysts. Journal of the American Chemical Society, 2016, 138, 11399-11407 |
4130957 | CIF | C22 H15 N S | P 1 21/n 1 | 14.79; 6.904; 17.265 90; 113.094; 90 | 1621.7 | Pearson, Ryan M.; Lim, Chern-Hooi; McCarthy, Blaine G.; Musgrave, Charles B.; Miyake, Garret M. Organocatalyzed Atom Transfer Radical Polymerization Using N-Aryl Phenoxazines as Photoredox Catalysts. Journal of the American Chemical Society, 2016, 138, 11399-11407 |
4130958 | CIF | C60 H89 K N2 Ni O7 S | P -1 | 12.668; 13.37; 20.68 80.951; 88.335; 62.771 | 3072 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Reactivity of a Nickel Sulfide with Carbon Monoxide and Nitric Oxide. Journal of the American Chemical Society, 2016, 138, 12352-12355 |
4130959 | CIF | C35 H53 N3 Ni O | C 1 2/c 1 | 16.8321; 9.37; 22.5816 90; 106.526; 90 | 3414.4 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Reactivity of a Nickel Sulfide with Carbon Monoxide and Nitric Oxide. Journal of the American Chemical Society, 2016, 138, 12352-12355 |
4130960 | CIF | C13 H26 Cl2 K N O7 S2 | P 1 21/n 1 | 9.4771; 14.0478; 16.771 90; 98.978; 90 | 2205.4 | Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W. Reactivity of a Nickel Sulfide with Carbon Monoxide and Nitric Oxide. Journal of the American Chemical Society, 2016, 138, 12352-12355 |
4130961 | CIF | C21 H19 N O7 S | P 1 21/c 1 | 8.8855; 17.9963; 13.146 90; 105.177; 90 | 2028.8 | Shen, Tao; Zhang, Yiqun; Liang, Yu-Feng; Jiao, Ning Direct Tryptophols Synthesis from 2-Vinylanilines and Alkynes via C≡C Triple Bond Cleavage and Dioxygen Activation. Journal of the American Chemical Society, 2016, 138, 13147-13150 |
4130962 | CIF | C21 H21 N O7 S | P 1 21/n 1 | 11.7697; 14.8198; 13.0749 90; 107.482; 90 | 2175.25 | Shen, Tao; Zhang, Yiqun; Liang, Yu-Feng; Jiao, Ning Direct Tryptophols Synthesis from 2-Vinylanilines and Alkynes via C≡C Triple Bond Cleavage and Dioxygen Activation. Journal of the American Chemical Society, 2016, 138, 13147-13150 |
4130963 | CIF | C91.5 H91.5 N0 | C 1 2/c 1 | 47.8736; 19.1675; 16.5421 90; 97.306; 90 | 15056.1 | Lu, Xuefeng; Lee, Sangsu; Kim, Jun Oh; Gopalakrishna, Tullimilli Y.; Phan, Hoa; Herng, Tun Seng; Lim, Zhenglong; Zeng, Zebing; Ding, Jun; Kim, Dongho; Wu, Jishan Stable 3,6-Linked Fluorenyl Radical Oligomers with Intramolecular Antiferromagnetic Coupling and Polyradical Characters. Journal of the American Chemical Society, 2016, 138, 13048-13058 |
4130964 | CIF | C102 H96 | C 1 2/c 1 | 53.095; 10.224; 35.66 90; 109.528; 90 | 18244 | Lu, Xuefeng; Lee, Sangsu; Kim, Jun Oh; Gopalakrishna, Tullimilli Y.; Phan, Hoa; Herng, Tun Seng; Lim, Zhenglong; Zeng, Zebing; Ding, Jun; Kim, Dongho; Wu, Jishan Stable 3,6-Linked Fluorenyl Radical Oligomers with Intramolecular Antiferromagnetic Coupling and Polyradical Characters. Journal of the American Chemical Society, 2016, 138, 13048-13058 |
4130965 | CIF | C30 H46 B2 Cl4 F N O7 S | C 1 2/m 1 | 33.5416; 7.4594; 15.8608 90; 106.7; 90 | 3801 | Davis, Holly J.; Mihai, Madalina T.; Phipps, Robert J. Ion Pair-Directed Regiocontrol in Transition-Metal Catalysis: A Meta-Selective C-H Borylation of Aromatic Quaternary Ammonium Salts. Journal of the American Chemical Society, 2016, 138, 12759-12762 |
4130966 | CIF | C94 H68 O32 Zr6 | F d -3 m :2 | 44.856; 44.856; 44.856 90; 90; 90 | 90253 | Alezi, Dalal; Spanopoulos, Ioannis; Tsangarakis, Constantinos; Shkurenko, Aleksander; Adil, Karim; Belmabkhout, Youssef; O Keeffe, Michael; Eddaoudi, Mohamed; Trikalitis, Pantelis N. Reticular Chemistry at Its Best: Directed Assembly of Hexagonal Building Units into the Awaited Metal-Organic Framework with the Intricate Polybenzene Topology, pbz-MOF. Journal of the American Chemical Society, 2016, 138, 12767-12770 |
4130967 | CIF | C18 H33 Li3 O3 | P -1 | 10.3259; 10.7672; 10.8895 102.936; 115.2; 99.243 | 1021.7 | Guang, Jie; Liu, Qiyong; Hopson, Russell; Kagan, Gerald; Li, Weibin; Monroe, Thomas B.; Williard, Paul G. Conformational Polymorphism of Lithium Pinacolone Enolate. Journal of the American Chemical Society, 2016, 138, 15177-15188 |
4130968 | CIF | C64 H48 B Cl2 F24 Ir N2 O2 | P -1 | 12.6934; 16.405; 17.556 62.79; 82.644; 89.71 | 3218.5 | Park, Yoonsu; Heo, Joon; Baik, Mu-Hyun; Chang, Sukbok Why is the Ir(III)-Mediated Amido Transfer Much Faster Than the Rh(III)-Mediated Reaction? A Combined Experimental and Computational Study. Journal of the American Chemical Society, 2016, 138, 14020-14029 |
4130969 | CIF | C41 H67 N5 O8 | P -1 | 12.826; 16.245; 21.953 89.214; 89.3; 89.609 | 4573 | Shin, Seonho; Lee, Mihye; Guzei, Ilia A.; Kang, Young Kee; Choi, Soo Hyuk 12/10-Helical β-Peptide with Dynamic Folding Propensity: Coexistence of Right- and Left-Handed Helices in an Enantiomeric Foldamer. Journal of the American Chemical Society, 2016, 138, 13390-13395 |
4130970 | CIF | C44.5 H76.5 N6 O7 | P 21 21 21 | 9.727; 17.75; 25.98 90; 90; 90 | 4485.6 | Shin, Seonho; Lee, Mihye; Guzei, Ilia A.; Kang, Young Kee; Choi, Soo Hyuk 12/10-Helical β-Peptide with Dynamic Folding Propensity: Coexistence of Right- and Left-Handed Helices in an Enantiomeric Foldamer. Journal of the American Chemical Society, 2016, 138, 13390-13395 |
4130971 | CIF | C44 H74 N6 O7 | P 1 21 1 | 11.5874; 23.587; 16.789 90; 93.663; 90 | 4579.3 | Shin, Seonho; Lee, Mihye; Guzei, Ilia A.; Kang, Young Kee; Choi, Soo Hyuk 12/10-Helical β-Peptide with Dynamic Folding Propensity: Coexistence of Right- and Left-Handed Helices in an Enantiomeric Foldamer. Journal of the American Chemical Society, 2016, 138, 13390-13395 |
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