Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4127971 | CIF | C55 H84 Al N4 P | P 1 21/c 1 | 14.2095; 18.7653; 20.5344 90; 109.719; 90 | 5154.3 | Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Stephan, Douglas W. Phosphaaluminirenes: Synthons for Main Group Heterocycles. Journal of the American Chemical Society, 2019, 141, 16971-16982 |
| 4127972 | CIF | C40 H56.25 Al N2 P Se | P n m a | 19.903; 18.583; 10.166 90; 90; 90 | 3760 | Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Stephan, Douglas W. Phosphaaluminirenes: Synthons for Main Group Heterocycles. Journal of the American Chemical Society, 2019, 141, 16971-16982 |
| 4127973 | CIF | C53 H66 Al N2 O P | P n m a | 20.879; 20.184; 10.7723 90; 90; 90 | 4539.7 | Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Stephan, Douglas W. Phosphaaluminirenes: Synthons for Main Group Heterocycles. Journal of the American Chemical Society, 2019, 141, 16971-16982 |
| 4127974 | CIF | C55 H68 Al N2 O P | P n a 21 | 33.78; 12.772; 22.14 90; 90; 90 | 9552 | Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Stephan, Douglas W. Phosphaaluminirenes: Synthons for Main Group Heterocycles. Journal of the American Chemical Society, 2019, 141, 16971-16982 |
| 4127975 | CIF | C56.5 H72 Al N4 P | P 1 21/c 1 | 27.6729; 11.0531; 33.7785 90; 103.962; 90 | 10026.6 | Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Stephan, Douglas W. Phosphaaluminirenes: Synthons for Main Group Heterocycles. Journal of the American Chemical Society, 2019, 141, 16971-16982 |
| 4127976 | CIF | H80 O110 Zr25 | C m c m | 31.6822; 23.4638; 27.1118 90; 90; 90 | 20154.5 | Sommers, James A.; Hutchison, Danielle C.; Martin, Nicolas P.; Kozma, Karoly; Keszler, Douglas A.; Nyman, May Peroxide-Promoted Disassembly Reassembly of Zr-Polyoxocations. Journal of the American Chemical Society, 2019, 141, 16894-16902 |
| 4127977 | CIF | Cl6 H36 O49 Zr4 | P 1 21/n 1 | 10.4563; 21.6794; 17.1366 90; 90.832; 90 | 3884.22 | Sommers, James A.; Hutchison, Danielle C.; Martin, Nicolas P.; Kozma, Karoly; Keszler, Douglas A.; Nyman, May Peroxide-Promoted Disassembly Reassembly of Zr-Polyoxocations. Journal of the American Chemical Society, 2019, 141, 16894-16902 |
| 4127978 | CIF | Cl24.02 H96 O168.11 Zr12 | I 4/m | 16.7157; 16.7157; 27.2185 90; 90; 90 | 7605.2 | Sommers, James A.; Hutchison, Danielle C.; Martin, Nicolas P.; Kozma, Karoly; Keszler, Douglas A.; Nyman, May Peroxide-Promoted Disassembly Reassembly of Zr-Polyoxocations. Journal of the American Chemical Society, 2019, 141, 16894-16902 |
| 4127979 | CIF | C32 H24 F N O2 S | P 21 21 21 | 10.4082; 13.6167; 18.5933 90; 90; 90 | 2635.14 | Hong, Feng-Lin; Wang, Ze-Shu; Wei, Dong-Dong; Zhai, Tong-Yi; Deng, Guo-Cheng; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu Generation of Donor/Donor Copper Carbenes through Copper-Catalyzed Diyne Cyclization: Enantioselective and Divergent Synthesis of Chiral Polycyclic Pyrroles. Journal of the American Chemical Society, 2019, 141, 16961-16970 |
| 4127980 | CIF | C24 H18 Br N O3 S | P 21 21 21 | 5.477; 17.2742; 22.007 90; 90; 90 | 2082.1 | Hong, Feng-Lin; Wang, Ze-Shu; Wei, Dong-Dong; Zhai, Tong-Yi; Deng, Guo-Cheng; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu Generation of Donor/Donor Copper Carbenes through Copper-Catalyzed Diyne Cyclization: Enantioselective and Divergent Synthesis of Chiral Polycyclic Pyrroles. Journal of the American Chemical Society, 2019, 141, 16961-16970 |
| 4127981 | CIF | C61.5 H80 Co2 F3 K N6 O16.5 S | C 1 2/c 1 | 30.9242; 13.3451; 16.9298 90; 108.846; 90 | 6612.1 | Sakata, Yoko; Tamiya, Munehiro; Okada, Masahiro; Akine, Shigehisa Switching of <i>Recognition First</i> and <i>Reaction First</i> Mechanisms in Host-Guest Binding Associated with Chemical Reactions. Journal of the American Chemical Society, 2019, 141, 15597-15604 |
| 4127982 | CIF | C64 H76 Co2 F6 N8 O14 S2 | P -1 | 10.137; 11.5336; 16.1693 72.752; 71.808; 70.2 | 1650.9 | Sakata, Yoko; Tamiya, Munehiro; Okada, Masahiro; Akine, Shigehisa Switching of <i>Recognition First</i> and <i>Reaction First</i> Mechanisms in Host-Guest Binding Associated with Chemical Reactions. Journal of the American Chemical Society, 2019, 141, 15597-15604 |
| 4127983 | CIF | C57 H68 Co2 F3 N6 Na O15 S | C 1 2/c 1 | 20.5672; 15.4382; 19.5237 90; 106.945; 90 | 5930 | Sakata, Yoko; Tamiya, Munehiro; Okada, Masahiro; Akine, Shigehisa Switching of <i>Recognition First</i> and <i>Reaction First</i> Mechanisms in Host-Guest Binding Associated with Chemical Reactions. Journal of the American Chemical Society, 2019, 141, 15597-15604 |
| 4127984 | CIF | C22 H41 Cl N2 O3 S | C 1 c 1 | 12.1658; 14.5252; 14.8017 90; 109.073; 90 | 2472.03 | Mihai, Madalina T.; Williams, Benjamin D.; Phipps, Robert J. <i>Para</i>-Selective C-H Borylation of Common Arene Building Blocks Enabled by Ion-Pairing with a Bulky Countercation. Journal of the American Chemical Society, 2019, 141, 15477-15482 |
| 4127985 | CIF | C23 H42 Br N O4 S | P 1 n 1 | 8.6478; 23.7341; 12.8671 90; 95.869; 90 | 2627.1 | Mihai, Madalina T.; Williams, Benjamin D.; Phipps, Robert J. <i>Para</i>-Selective C-H Borylation of Common Arene Building Blocks Enabled by Ion-Pairing with a Bulky Countercation. Journal of the American Chemical Society, 2019, 141, 15477-15482 |
| 4127986 | CIF | C23 H43 Cl N2 O3 S | P -1 | 10.0834; 15.2873; 17.347 89.052; 75.296; 87.331 | 2583.6 | Mihai, Madalina T.; Williams, Benjamin D.; Phipps, Robert J. <i>Para</i>-Selective C-H Borylation of Common Arene Building Blocks Enabled by Ion-Pairing with a Bulky Countercation. Journal of the American Chemical Society, 2019, 141, 15477-15482 |
| 4127987 | CIF | C15 H16 O7 | P 1 21/c 1 | 8.0632; 13.0863; 13.1906 90; 101.107; 90 | 1365.77 | Novak, Alexander J. E.; Grigglestone, Claire E.; Trauner, Dirk A Biomimetic Synthesis Elucidates the Origin of Preuisolactone A. Journal of the American Chemical Society, 2019, 141, 15515-15518 |
| 4127988 | CIF | C40 H40 I4 N2 S8 Sn | P 1 | 12.0929; 12.1407; 32.496 84.6775; 82.833; 89.9763 | 4713 | Gao, Yao; Wei, Zitang; Yoo, Pilsun; Shi, Enzheng; Zeller, Matthias; Zhu, Chenhui; Liao, Peilin; Dou, Letian Highly Stable Lead-Free Perovskite Field-Effect Transistors Incorporating Linear π-Conjugated Organic Ligands. Journal of the American Chemical Society, 2019, 141, 15577-15585 |
| 4127989 | CIF | C32 H48 I8 N4 Sn2 | P -1 | 8.6484; 8.6467; 32.461 85.1499; 85.1329; 89.5023 | 2410 | Gao, Yao; Wei, Zitang; Yoo, Pilsun; Shi, Enzheng; Zeller, Matthias; Zhu, Chenhui; Liao, Peilin; Dou, Letian Highly Stable Lead-Free Perovskite Field-Effect Transistors Incorporating Linear π-Conjugated Organic Ligands. Journal of the American Chemical Society, 2019, 141, 15577-15585 |
| 4127990 | CIF | C45 H52 Mo O2 P2 | P -1 | 11.665; 12.561; 13.985 72.96; 81.2; 88.33 | 1935.9 | Buss, Joshua A.; Bailey, Gwendolyn A.; Oppenheim, Julius; VanderVelde, David G.; Goddard, 3rd, William A; Agapie, Theodor CO Coupling Chemistry of a Terminal Mo Carbide: Sequential Addition of Proton, Hydride, and CO Releases Ethenone. Journal of the American Chemical Society, 2019, 141, 15664-15674 |
| 4127991 | CIF | C69 H94 Cl2 Mo2 O2 P4 | P 1 21/n 1 | 13.1011; 13.0037; 19.0467 90; 95.462; 90 | 3230.1 | Buss, Joshua A.; Bailey, Gwendolyn A.; Oppenheim, Julius; VanderVelde, David G.; Goddard, 3rd, William A; Agapie, Theodor CO Coupling Chemistry of a Terminal Mo Carbide: Sequential Addition of Proton, Hydride, and CO Releases Ethenone. Journal of the American Chemical Society, 2019, 141, 15664-15674 |
| 4127992 | CIF | C35.75 H45 Cl Mo O2 P2 | P -1 | 12.469; 12.592; 23.363 91.78; 104.66; 102.92 | 3444 | Buss, Joshua A.; Bailey, Gwendolyn A.; Oppenheim, Julius; VanderVelde, David G.; Goddard, 3rd, William A; Agapie, Theodor CO Coupling Chemistry of a Terminal Mo Carbide: Sequential Addition of Proton, Hydride, and CO Releases Ethenone. Journal of the American Chemical Society, 2019, 141, 15664-15674 |
| 4127993 | CIF | C35.5 H42 Mo O P2 | C 1 2/c 1 | 23.82; 21.933; 13.402 90; 116.5; 90 | 6266 | Buss, Joshua A.; Bailey, Gwendolyn A.; Oppenheim, Julius; VanderVelde, David G.; Goddard, 3rd, William A; Agapie, Theodor CO Coupling Chemistry of a Terminal Mo Carbide: Sequential Addition of Proton, Hydride, and CO Releases Ethenone. Journal of the American Chemical Society, 2019, 141, 15664-15674 |
| 4127994 | CIF | C37 H55 Mo O P2 Si | P -1 | 11.6736; 12.0522; 14.3227 94.987; 105.434; 110.315 | 1785.4 | Buss, Joshua A.; Bailey, Gwendolyn A.; Oppenheim, Julius; VanderVelde, David G.; Goddard, 3rd, William A; Agapie, Theodor CO Coupling Chemistry of a Terminal Mo Carbide: Sequential Addition of Proton, Hydride, and CO Releases Ethenone. Journal of the American Chemical Society, 2019, 141, 15664-15674 |
| 4127995 | CIF | C17 H20 N4 O2 S | P 21 21 21 | 6.8171; 13.2954; 18.339 90; 90; 90 | 1662.2 | Wang, Zhaofeng; Jiang, Liyin; Sarró, Pau; Suero, Marcos G. Catalytic Cleavage of C(<i>sp</i><sup>2</sup>)-C(<i>sp</i><sup>2</sup>) Bonds with Rh-Carbynoids. Journal of the American Chemical Society, 2019, 141, 15509-15514 |
| 4127996 | CIF | C26 H36 F3 I O9 S | P -1 | 9.0628; 9.3343; 18.632 92.924; 100.635; 93.078 | 1543.9 | Wang, Zhaofeng; Jiang, Liyin; Sarró, Pau; Suero, Marcos G. Catalytic Cleavage of C(<i>sp</i><sup>2</sup>)-C(<i>sp</i><sup>2</sup>) Bonds with Rh-Carbynoids. Journal of the American Chemical Society, 2019, 141, 15509-15514 |
| 4127997 | CIF | C19 H26 O5 | P 1 21/c 1 | 11.0815; 18.8668; 8.1309 90; 92.8933; 90 | 1697.78 | Wang, Zhaofeng; Jiang, Liyin; Sarró, Pau; Suero, Marcos G. Catalytic Cleavage of C(<i>sp</i><sup>2</sup>)-C(<i>sp</i><sup>2</sup>) Bonds with Rh-Carbynoids. Journal of the American Chemical Society, 2019, 141, 15509-15514 |
| 4127998 | CIF | C104 H102 O10 S6 | P 1 21/n 1 | 16.975; 12.176; 21.669 90; 104.674; 90 | 4333 | Suginome, Shun; Sato, Hiroshi; Hori, Akihiro; Mishima, Akio; Harada, Yuki; Kusaka, Shinpei; Matsuda, Ryotaro; Pirillo, Jenny; Hijikata, Yuh; Aida, Takuzo One-Step Synthesis of an Adaptive Nanographene MOF: Adsorbed Gas-Dependent Geometrical Diversity. Journal of the American Chemical Society, 2019, 141, 15649-15655 |
| 4127999 | CIF | C117.3 H119.66 N5.06 O10.5 Zn | P -1 | 19.039; 19.244; 19.579 74.73; 71.112; 61.065 | 5890 | Suginome, Shun; Sato, Hiroshi; Hori, Akihiro; Mishima, Akio; Harada, Yuki; Kusaka, Shinpei; Matsuda, Ryotaro; Pirillo, Jenny; Hijikata, Yuh; Aida, Takuzo One-Step Synthesis of an Adaptive Nanographene MOF: Adsorbed Gas-Dependent Geometrical Diversity. Journal of the American Chemical Society, 2019, 141, 15649-15655 |
| 4128000 | CIF | C97 H73 N O7 Zn | P -1 | 14.057; 16.947; 20.427 73.98; 74.49; 80.6 | 4486 | Suginome, Shun; Sato, Hiroshi; Hori, Akihiro; Mishima, Akio; Harada, Yuki; Kusaka, Shinpei; Matsuda, Ryotaro; Pirillo, Jenny; Hijikata, Yuh; Aida, Takuzo One-Step Synthesis of an Adaptive Nanographene MOF: Adsorbed Gas-Dependent Geometrical Diversity. Journal of the American Chemical Society, 2019, 141, 15649-15655 |
| 4128001 | CIF | C92 H64 O4.76 Zn | P -1 | 19.145; 19.421; 20.42 79.032; 63.984; 71.306 | 6452.2 | Suginome, Shun; Sato, Hiroshi; Hori, Akihiro; Mishima, Akio; Harada, Yuki; Kusaka, Shinpei; Matsuda, Ryotaro; Pirillo, Jenny; Hijikata, Yuh; Aida, Takuzo One-Step Synthesis of an Adaptive Nanographene MOF: Adsorbed Gas-Dependent Geometrical Diversity. Journal of the American Chemical Society, 2019, 141, 15649-15655 |
| 4128002 | CIF | C34 H61 Cl N6 Ru | P 1 21/c 1 | 11.8219; 32.0035; 10.6169 90; 115.515; 90 | 3625.1 | Tan, Jin-Fay; Bormann, Carl T.; Perrin, Florian G.; Chadwick, F. Mark; Severin, Kay; Cramer, Nicolai Divergent Synthesis of Densely Substituted Arenes and Pyridines via Cyclotrimerization Reactions of Alkynyl Triazenes. Journal of the American Chemical Society, 2019, 141, 10372-10383 |
| 4128003 | CIF | C34 H58 Cl2 N3 O0.5 Ru2 | P -1 | 9.0428; 11.1213; 18.9745 85.417; 84.226; 66.447 | 1738.7 | Tan, Jin-Fay; Bormann, Carl T.; Perrin, Florian G.; Chadwick, F. Mark; Severin, Kay; Cramer, Nicolai Divergent Synthesis of Densely Substituted Arenes and Pyridines via Cyclotrimerization Reactions of Alkynyl Triazenes. Journal of the American Chemical Society, 2019, 141, 10372-10383 |
| 4128004 | CIF | C22 H38 Cl N3 Ru | P n m a | 17.78429; 12.32688; 10.75495 90; 90; 90 | 2357.75 | Tan, Jin-Fay; Bormann, Carl T.; Perrin, Florian G.; Chadwick, F. Mark; Severin, Kay; Cramer, Nicolai Divergent Synthesis of Densely Substituted Arenes and Pyridines via Cyclotrimerization Reactions of Alkynyl Triazenes. Journal of the American Chemical Society, 2019, 141, 10372-10383 |
| 4128005 | CIF | C20 H14 N2 O2 | P 1 21/n 1 | 14.9596; 5.7704; 18.2738 90; 93.348; 90 | 1574.75 | Soni, Vineet Kumar; Hwang, Ho Seong; Moon, Yu Kyung; Park, Sung-Woo; You, Youngmin; Cho, Eun Jin Generation of N-Centered Radicals via a Photocatalytic Energy Transfer: Remote Double Functionalization of Arenes Facilitated by Singlet Oxygen. Journal of the American Chemical Society, 2019, 141, 10538-10545 |
| 4128006 | CIF | C21 H16 N2 O2 | P 1 21/n 1 | 11.5046; 6.2472; 24.1703 90; 103.232; 90 | 1691.04 | Soni, Vineet Kumar; Hwang, Ho Seong; Moon, Yu Kyung; Park, Sung-Woo; You, Youngmin; Cho, Eun Jin Generation of N-Centered Radicals via a Photocatalytic Energy Transfer: Remote Double Functionalization of Arenes Facilitated by Singlet Oxygen. Journal of the American Chemical Society, 2019, 141, 10538-10545 |
| 4128007 | CIF | C36 H34 Cu F6 N4 O10 S2 | P 1 21/c 1 | 11.3128; 28.029; 12.5915 90; 92.095; 90 | 3989.9 | Tao, Wenjie; Bower, Jamey K.; Moore, Curtis E.; Zhang, Shiyu Dicopper μ-Oxo, μ-Nitrosyl Complex from the Activation of NO or Nitrite at a Dicopper Center. Journal of the American Chemical Society, 2019, 141, 10159-10164 |
| 4128008 | CIF | C103.49 H58.97 B2 Cl0.51 Cu2 F48 N4 O2.74 | P -1 | 12.7591; 18.1984; 24.8985 91.008; 93.058; 93.513 | 5761 | Tao, Wenjie; Bower, Jamey K.; Moore, Curtis E.; Zhang, Shiyu Dicopper μ-Oxo, μ-Nitrosyl Complex from the Activation of NO or Nitrite at a Dicopper Center. Journal of the American Chemical Society, 2019, 141, 10159-10164 |
| 4128009 | CIF | C68 H37 B Cu2 F30 N4 O2 | P -1 | 12.8267; 16.729; 18.0934 102.584; 97.674; 91.056 | 3750.7 | Tao, Wenjie; Bower, Jamey K.; Moore, Curtis E.; Zhang, Shiyu Dicopper μ-Oxo, μ-Nitrosyl Complex from the Activation of NO or Nitrite at a Dicopper Center. Journal of the American Chemical Society, 2019, 141, 10159-10164 |
| 4128010 | CIF | C108 H78 B2 Cu2 F48 N5 O8 | P -1 | 12.6825; 17.1535; 17.278 61.744; 77.29; 85.224 | 3228.8 | Tao, Wenjie; Bower, Jamey K.; Moore, Curtis E.; Zhang, Shiyu Dicopper μ-Oxo, μ-Nitrosyl Complex from the Activation of NO or Nitrite at a Dicopper Center. Journal of the American Chemical Society, 2019, 141, 10159-10164 |
| 4128011 | CIF | C36 H34 Cu2 F6 N5 O12 S2 | C 1 2/m 1 | 35.132; 10.4087; 14.2824 90; 109.398; 90 | 4926.3 | Tao, Wenjie; Bower, Jamey K.; Moore, Curtis E.; Zhang, Shiyu Dicopper μ-Oxo, μ-Nitrosyl Complex from the Activation of NO or Nitrite at a Dicopper Center. Journal of the American Chemical Society, 2019, 141, 10159-10164 |
| 4128012 | CIF | C81 H102 F6 Fe2 N10 O10 S2 | P 1 21/c 1 | 19.6283; 10.3255; 20.5481 90; 98.061; 90 | 4123.4 | Yadav, Vishal; Gordon, Jesse B.; Siegler, Maxime A.; Goldberg, David P. Dioxygen-Derived Nonheme Mononuclear Fe<sup>III</sup>(OH) Complex and Its Reactivity with Carbon Radicals. Journal of the American Chemical Society, 2019, 141, 10148-10153 |
| 4128013 | CIF | C37 H46 F3 Fe N5 O4 S | P -1 | 10.0166; 10.6374; 18.2471 80.928; 79.036; 79.746 | 1862.77 | Yadav, Vishal; Gordon, Jesse B.; Siegler, Maxime A.; Goldberg, David P. Dioxygen-Derived Nonheme Mononuclear Fe<sup>III</sup>(OH) Complex and Its Reactivity with Carbon Radicals. Journal of the American Chemical Society, 2019, 141, 10148-10153 |
| 4128014 | CIF | C11 H12 Cl N O | P b c a | 6.7928; 12.0154; 25.9101 90; 90; 90 | 2114.7 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128015 | CIF | C64.82 H48.65 B Cl1.65 F24 Ir N3 O3 | P 1 21/n 1 | 12.818; 14.861; 35.425 90; 90.91; 90 | 6747 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128016 | CIF | C9 H16 Cl N O | P 1 21/c 1 | 12.123; 8.799; 10.357 90; 111.01; 90 | 1031.3 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128017 | CIF | C13 H15 N O3 | P 1 21/n 1 | 9.81; 8.792; 14.514 90; 99.86; 90 | 1233.3 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128018 | CIF | C18 H18 Cl N O | C 1 2/c 1 | 24.474; 5.415; 23.818 90; 93.99; 90 | 3148.9 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128019 | CIF | C63 H46 B F24 Ir N2 O3 | P -1 | 15.338; 16.668; 17.312 63.37; 73.01; 78.05 | 3768.7 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128020 | CIF | C63 H46 B F24 Ir N2 O3 | P -1 | 13.0708; 13.5823; 20.067 76.785; 80.821; 88.791 | 3423.3 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128021 | CIF | C17 H16 Cl N O | P n a 21 | 16.012; 15.318; 5.595 90; 90; 90 | 1372.3 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128022 | CIF | C64 H47 B F24 Ir N3 O3 | P -1 | 13.756; 15.303; 16.367 75.85; 80.74; 77.93 | 3245 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
| 4128023 | CIF | C20 H15 B F4 N2 O Pd | C 1 2/c 1 | 18.3325; 9.5102; 20.9624 90; 95.6799; 90 | 3636.76 | Jaworski, Jonathan N.; Kozack, Caitlin V.; Tereniak, Stephen J.; Knapp, Spring Melody M.; Landis, Clark R.; Miller, Jeffrey T.; Stahl, Shannon S. Operando Spectroscopic and Kinetic Characterization of Aerobic Allylic C-H Acetoxylation Catalyzed by Pd(OAc)<sub>2</sub>/4,5-Diazafluoren-9-one. Journal of the American Chemical Society, 2019, 141, 10462-10474 |
| 4128024 | CIF | C22 H24 O4 Pd2 | P 21 21 21 | 9.804; 13.105; 16.366 90; 90; 90 | 2102.7 | Jaworski, Jonathan N.; Kozack, Caitlin V.; Tereniak, Stephen J.; Knapp, Spring Melody M.; Landis, Clark R.; Miller, Jeffrey T.; Stahl, Shannon S. Operando Spectroscopic and Kinetic Characterization of Aerobic Allylic C-H Acetoxylation Catalyzed by Pd(OAc)<sub>2</sub>/4,5-Diazafluoren-9-one. Journal of the American Chemical Society, 2019, 141, 10462-10474 |
| 4128025 | CIF | C46 H34 | P 1 21/c 1 | 8.21746; 24.3054; 7.85743 90; 107.053; 90 | 1500.36 | Konishi, Akihito; Horii, Koki; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Yasuda, Makoto Open-Shell and Antiaromatic Character Induced by the Highly Symmetric Geometry of the Planar Heptalene Structure: Synthesis and Characterization of a Nonalternant Isomer of Bisanthene. Journal of the American Chemical Society, 2019, 141, 10165-10170 |
| 4128026 | CIF | C52 H46 B2 F8 | I 1 2/a 1 | 28.2664; 8.0077; 18.2814 90; 90.756; 90 | 4137.6 | Konishi, Akihito; Horii, Koki; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Yasuda, Makoto Open-Shell and Antiaromatic Character Induced by the Highly Symmetric Geometry of the Planar Heptalene Structure: Synthesis and Characterization of a Nonalternant Isomer of Bisanthene. Journal of the American Chemical Society, 2019, 141, 10165-10170 |
| 4128027 | CIF | C46 H36 O2 | P -1 | 8.3096; 13.4671; 13.8293 93.309; 91.851; 91.515 | 1543.58 | Konishi, Akihito; Horii, Koki; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Yasuda, Makoto Open-Shell and Antiaromatic Character Induced by the Highly Symmetric Geometry of the Planar Heptalene Structure: Synthesis and Characterization of a Nonalternant Isomer of Bisanthene. Journal of the American Chemical Society, 2019, 141, 10165-10170 |
| 4128028 | CIF | C29 H30 B N3 O8 | P 1 21/n 1 | 9.4519; 16.7889; 16.9365 90; 101.674; 90 | 2632 | Dennis, David G.; Okumura, Mikiko; Sarlah, David Synthesis of (±)-Idarubicinone via Global Functionalization of Tetracene. Journal of the American Chemical Society, 2019, 141, 10193-10198 |
| 4128029 | CIF | C19 H24 B N3 O4 | P 1 21/n 1 | 15.5798; 13.7634; 17.7218 90; 100.257; 90 | 3739.37 | Dennis, David G.; Okumura, Mikiko; Sarlah, David Synthesis of (±)-Idarubicinone via Global Functionalization of Tetracene. Journal of the American Chemical Society, 2019, 141, 10193-10198 |
| 4128030 | CIF | Hg Li O4 P | P -4 21 m | 4.5946; 4.5946; 8.0512 90; 90; 90 | 169.96 | Wu, Bao-Lin; Hu, Chun-Li; Mao, Fei-Fei; Tang, Ru-Ling; Mao, Jiang-Gao Highly Polarizable Hg<sup>2+</sup> Induced a Strong Second Harmonic Generation Signal and Large Birefringence in LiHgPO<sub>4</sub>. Journal of the American Chemical Society, 2019, 141, 10188-10192 |
| 4128031 | CIF | C56 H30 O16 Zr3 | F m m m | 14.819; 35.924; 45.003 90; 90; 90 | 23958 | Lv, Xiu-Liang; Yuan, Shuai; Xie, Lin-Hua; Darke, Hannah F.; Chen, Ya; He, Tao; Dong, Chen; Wang, Bin; Zhang, Yong-Zheng; Li, Jian-Rong; Zhou, Hong-Cai Ligand Rigidification for Enhancing the Stability of Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10283-10293 |
| 4128032 | CIF | C56 H30 O16 Zr3 | P 6/m m m | 50.5058; 50.5058; 14.8247 90; 90; 120 | 32749.1 | Lv, Xiu-Liang; Yuan, Shuai; Xie, Lin-Hua; Darke, Hannah F.; Chen, Ya; He, Tao; Dong, Chen; Wang, Bin; Zhang, Yong-Zheng; Li, Jian-Rong; Zhou, Hong-Cai Ligand Rigidification for Enhancing the Stability of Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10283-10293 |
| 4128033 | CIF | C168 H90 O24 Zr9 | P -6 2 m | 23.0014; 23.0014; 18.5185 90; 90; 120 | 8484.9 | Lv, Xiu-Liang; Yuan, Shuai; Xie, Lin-Hua; Darke, Hannah F.; Chen, Ya; He, Tao; Dong, Chen; Wang, Bin; Zhang, Yong-Zheng; Li, Jian-Rong; Zhou, Hong-Cai Ligand Rigidification for Enhancing the Stability of Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10283-10293 |
| 4128034 | CIF | C62 H24 O16 Zr3 | P 4/m n c | 22.3176; 22.3176; 38.8607 90; 90; 90 | 19355.6 | Lv, Xiu-Liang; Yuan, Shuai; Xie, Lin-Hua; Darke, Hannah F.; Chen, Ya; He, Tao; Dong, Chen; Wang, Bin; Zhang, Yong-Zheng; Li, Jian-Rong; Zhou, Hong-Cai Ligand Rigidification for Enhancing the Stability of Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10283-10293 |
| 4128035 | CIF | C40 H22 O16 Zr3 | F m m m | 19.721; 31.9499; 34.865 90; 90; 90 | 21968 | Lv, Xiu-Liang; Yuan, Shuai; Xie, Lin-Hua; Darke, Hannah F.; Chen, Ya; He, Tao; Dong, Chen; Wang, Bin; Zhang, Yong-Zheng; Li, Jian-Rong; Zhou, Hong-Cai Ligand Rigidification for Enhancing the Stability of Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10283-10293 |
| 4128036 | CIF | C184 H136 O64 Zr12 | F m m m | 21.1397; 32.4825; 33.8974 90; 90; 90 | 23276.3 | Lv, Xiu-Liang; Yuan, Shuai; Xie, Lin-Hua; Darke, Hannah F.; Chen, Ya; He, Tao; Dong, Chen; Wang, Bin; Zhang, Yong-Zheng; Li, Jian-Rong; Zhou, Hong-Cai Ligand Rigidification for Enhancing the Stability of Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10283-10293 |
| 4128037 | CIF | C101 H174 Au2 Cl3 Cu6 N20 Ni4 O77.5 Pd2 S | P 4/m m m | 35.725; 35.725; 15.2666 90; 90; 90 | 19484.4 | Adam, Rosa; Mon, Marta; Greco, Rossella; Kalinke, Lucas H. G.; Vidal-Moya, Alejandro; Fernandez, Antonio; Winpenny, Richard E. P.; Doménech-Carbó, Antonio; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio; Ferrando-Soria, Jesús Self-Assembly of Catalytically Active Supramolecular Coordination Compounds within Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10350-10360 |
| 4128038 | CIF | C80.75 H139.75 Cu6 N15.25 Ni4 O70.75 Pd2 | P 4/m m m | 35.258; 35.258; 15.119 90; 90; 90 | 18795 | Adam, Rosa; Mon, Marta; Greco, Rossella; Kalinke, Lucas H. G.; Vidal-Moya, Alejandro; Fernandez, Antonio; Winpenny, Richard E. P.; Doménech-Carbó, Antonio; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio; Ferrando-Soria, Jesús Self-Assembly of Catalytically Active Supramolecular Coordination Compounds within Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10350-10360 |
| 4128039 | CIF | C84 H163 Cu6 N16 Ni4 O81 Pd2 | P 4/m m m | 35.7158; 35.7158; 15.1495 90; 90; 90 | 19325 | Adam, Rosa; Mon, Marta; Greco, Rossella; Kalinke, Lucas H. G.; Vidal-Moya, Alejandro; Fernandez, Antonio; Winpenny, Richard E. P.; Doménech-Carbó, Antonio; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio; Ferrando-Soria, Jesús Self-Assembly of Catalytically Active Supramolecular Coordination Compounds within Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10350-10360 |
| 4128040 | CIF | C46 H79 B4 Cu3 F16 N15 O3.25 | P 1 21/c 1 | 18.4103; 23.0536; 15.5199 90; 103.463; 90 | 6406 | Yang, Luming; He, Xin; Dincă, Mircea Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10475-10480 |
| 4128041 | CIF | C46 H71 B3 Cl Cu3 F12 N9 O6 | P -1 | 16.8057; 17.2937; 24.2896 83.698; 80.855; 68.665 | 6481.6 | Yang, Luming; He, Xin; Dincă, Mircea Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 10475-10480 |
| 4128042 | CIF | C10 H10 F N O2 | C 1 2/c 1 | 20.7185; 9.3045; 12.4912 90; 133.858; 90 | 1736.31 | Yu, Jin-Sheng; Espinosa, Miguel; Noda, Hidetoshi; Shibasaki, Masakatsu Traceless Electrophilic Amination for the Synthesis of Unprotected Cyclic β-Amino Acids. Journal of the American Chemical Society, 2019, 141, 10530-10537 |
| 4128043 | CIF | C76 H79 Cl N6 Ni O2 | P -1 | 9.2478; 11.722; 28.7901 93.79; 95.306; 91.105 | 3099.74 | Carvalho, Mary-Ambre; Dekkiche, Hervé; Nagasaki, Mayumi; Kikkawa, Yoshihiro; Ruppert, Romain Coordination-Driven Construction of Porphyrin Nanoribbons at a Highly Oriented Pyrolytic Graphite (HOPG)/Liquid Interface. Journal of the American Chemical Society, 2019, 141, 10137-10141 |
| 4128044 | CIF | C17 H20 I N3 O5 S | P 1 21 1 | 9.7265; 10.2667; 9.8174 90; 102.588; 90 | 956.79 | Trost, Barry M.; Xu, Shiyan; Sharif, Ehesan U. New Catalytic Asymmetric Formation of Oxygen Heterocycles Bearing Nucleoside Bases at the Anomeric Carbon. Journal of the American Chemical Society, 2019, 141, 10199-10204 |
| 4128045 | CIF | C170.68 H116.03 Ce0.5 Co4 N36 O17.67 Zn3 | P -3 c 1 | 21.246; 21.246; 58.2102 90; 90; 120 | 22755.4 | Ube, Hitoshi; Endo, Kenichi; Sato, Hiroyasu; Shionoya, Mitsuhiko Synthesis of Hetero-multinuclear Metal Complexes by Site-Selective Redox Switching and Transmetalation on a Homo-multinuclear Complex. Journal of the American Chemical Society, 2019, 141, 10384-10389 |
| 4128046 | CIF | C16 H14 N6 | P 1 21/c 1 | 7.8714; 19.446; 9.6231 90; 113.622; 90 | 1349.6 | Vailonis, Kristina M.; Gnanasekaran, Karthikeyan; Powers, Xian B.; Gianneschi, Nathan C.; Jenkins, David M. Elucidating the Growth of Metal-Organic Nanotubes Combining Isoreticular Synthesis with Liquid-Cell Transmission Electron Microscopy. Journal of the American Chemical Society, 2019, 141, 10177-10182 |
| 4128047 | CIF | C8 H6 Br Cu N3 | I m m a | 22.374; 6.9783; 13.2425 90; 90; 90 | 2067.6 | Vailonis, Kristina M.; Gnanasekaran, Karthikeyan; Powers, Xian B.; Gianneschi, Nathan C.; Jenkins, David M. Elucidating the Growth of Metal-Organic Nanotubes Combining Isoreticular Synthesis with Liquid-Cell Transmission Electron Microscopy. Journal of the American Chemical Society, 2019, 141, 10177-10182 |
| 4128048 | CIF | C27 H16 N2 | P b c a | 14.8961; 12.6957; 18.6653 90; 90; 90 | 3529.9 | Yen-Pon, Expédite; Champagne, Pier Alexandre; Plougastel, Lucie; Gabillet, Sandra; Thuéry, Pierre; Johnson, Mizuki; Muller, Gilles; Pieters, Grégory; Taran, Frédéric; Houk, K. N.; Audisio, Davide Sydnone-Based Approach to Heterohelicenes through 1,3-Dipolar-Cycloadditions. Journal of the American Chemical Society, 2019, 141, 1435-1440 |
| 4128049 | CIF | C27 H16 N2 | P 1 21/c 1 | 16.6965; 5.8107; 18.3992 90; 104.082; 90 | 1731.4 | Yen-Pon, Expédite; Champagne, Pier Alexandre; Plougastel, Lucie; Gabillet, Sandra; Thuéry, Pierre; Johnson, Mizuki; Muller, Gilles; Pieters, Grégory; Taran, Frédéric; Houk, K. N.; Audisio, Davide Sydnone-Based Approach to Heterohelicenes through 1,3-Dipolar-Cycloadditions. Journal of the American Chemical Society, 2019, 141, 1435-1440 |
| 4128050 | CIF | C21 H14 N2 | P 21 21 21 | 4.9489; 12.6503; 23.4534 90; 90; 90 | 1468.3 | Yen-Pon, Expédite; Champagne, Pier Alexandre; Plougastel, Lucie; Gabillet, Sandra; Thuéry, Pierre; Johnson, Mizuki; Muller, Gilles; Pieters, Grégory; Taran, Frédéric; Houk, K. N.; Audisio, Davide Sydnone-Based Approach to Heterohelicenes through 1,3-Dipolar-Cycloadditions. Journal of the American Chemical Society, 2019, 141, 1435-1440 |
| 4128051 | CIF | C41 H59 F6 K N4 Ni O8 | P 1 21/n 1 | 13.2803; 19.4633; 19.2148 90; 97.5485; 90 | 4923.6 | Kundu, Subrata; Phu, Phan N.; Ghosh, Pokhraj; Kozimor, Stosh A.; Bertke, Jeffery A.; Stieber, S Chantal E; Warren, Timothy H. Nitrosyl Linkage Isomers: NO Coupling to N<sub>2</sub>O at a Mononuclear Site. Journal of the American Chemical Society, 2019, 141, 1415-1419 |
| 4128052 | CIF | C47 H71 F6 K N5 Ni O7 | P 1 21/n 1 | 12.6072; 24.653; 21.555 90; 94.932; 90 | 6674.6 | Kundu, Subrata; Phu, Phan N.; Ghosh, Pokhraj; Kozimor, Stosh A.; Bertke, Jeffery A.; Stieber, S Chantal E; Warren, Timothy H. Nitrosyl Linkage Isomers: NO Coupling to N<sub>2</sub>O at a Mononuclear Site. Journal of the American Chemical Society, 2019, 141, 1415-1419 |
| 4128053 | CIF | C45 H67 F6 K N3 Ni O8 | P 1 21 1 | 18.0758; 13.725; 20.4222 90; 90.014; 90 | 5066.6 | Kundu, Subrata; Phu, Phan N.; Ghosh, Pokhraj; Kozimor, Stosh A.; Bertke, Jeffery A.; Stieber, S Chantal E; Warren, Timothy H. Nitrosyl Linkage Isomers: NO Coupling to N<sub>2</sub>O at a Mononuclear Site. Journal of the American Chemical Society, 2019, 141, 1415-1419 |
| 4128054 | CIF | C47 H71 F6 K N6 Ni O8 | P 1 21/n 1 | 10.5729; 38.111; 13.4355 90; 104.692; 90 | 5236.7 | Kundu, Subrata; Phu, Phan N.; Ghosh, Pokhraj; Kozimor, Stosh A.; Bertke, Jeffery A.; Stieber, S Chantal E; Warren, Timothy H. Nitrosyl Linkage Isomers: NO Coupling to N<sub>2</sub>O at a Mononuclear Site. Journal of the American Chemical Society, 2019, 141, 1415-1419 |
| 4128055 | CIF | C58 H72 F12 N4 Ni2 O2 | P -1 | 11.6731; 13.2679; 20.9329 82.644; 76.384; 65.613 | 2868 | Kundu, Subrata; Phu, Phan N.; Ghosh, Pokhraj; Kozimor, Stosh A.; Bertke, Jeffery A.; Stieber, S Chantal E; Warren, Timothy H. Nitrosyl Linkage Isomers: NO Coupling to N<sub>2</sub>O at a Mononuclear Site. Journal of the American Chemical Society, 2019, 141, 1415-1419 |
| 4128056 | CIF | C29 H35 F6 N3 Ni O | P 1 21/n 1 | 13.5093; 16.6592; 13.9913 90; 109.349; 90 | 2970.9 | Kundu, Subrata; Phu, Phan N.; Ghosh, Pokhraj; Kozimor, Stosh A.; Bertke, Jeffery A.; Stieber, S Chantal E; Warren, Timothy H. Nitrosyl Linkage Isomers: NO Coupling to N<sub>2</sub>O at a Mononuclear Site. Journal of the American Chemical Society, 2019, 141, 1415-1419 |
| 4128057 | CIF | C22 H22 O2 S | P 1 21 1 | 5.6684; 15.2524; 10.6654 90; 92.016; 90 | 921.52 | Yan, Qiaozhi; Xiao, Guiying; Wang, Ying; Zi, Guofu; Zhang, Zhanbin; Hou, Guohua Highly Efficient Enantioselective Synthesis of Chiral Sulfones by Rh-Catalyzed Asymmetric Hydrogenation. Journal of the American Chemical Society, 2019, 141, 1749-1756 |
| 4128058 | CIF | C17 H8 Ca0.07 Co0.5 F6 Mn0.43 O4 | P 65 2 2 | 21.2499; 21.2499; 15.2397 90; 90; 120 | 5959.7 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128059 | CIF | C17 H8 Ca0.21 Co0.27 F6 Mn0.29 O4.33 Zn0.23 | P 65 2 2 | 21.25; 21.25; 15.3379 90; 90; 120 | 5998.1 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128060 | CIF | C17 H8 Co0.1 F6 Mn0.5 O4.15 Zn0.4 | P 65 2 2 | 21.2761; 21.2761; 15.1699 90; 90; 120 | 5947 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128061 | CIF | C17 H0.08 Co0.48 F6 Mn0.35 O4 Zn0.17 | P 65 2 2 | 21.2639; 21.2639; 15.1083 90; 90; 120 | 5916.1 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128062 | CIF | C17 H8 Ca0.21 Co0.12 F6 Mn0.29 O4 Zn0.38 | P 65 2 2 | 21.2824; 21.2824; 15.321 90; 90; 120 | 6009.8 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128063 | CIF | C17 H8 Co0.36 F6 Mn0.49 O4.17 Zn0.14 | P 65 2 2 | 21.2423; 21.2423; 15.1282 90; 90; 120 | 5911.8 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128064 | CIF | C17 H0.08 Co0.44 F6 Mn0.43 O4 Zn0.13 | P 65 2 2 | 21.2819; 21.2819; 15.1237 90; 90; 120 | 5932.1 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128065 | CIF | C17 H8 Ca0.04 Co0.06 F6 Mn0.46 O4.5 Zn0.44 | P 65 2 2 | 21.2232; 21.2232; 15.1771 90; 90; 120 | 5920.3 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128066 | CIF | C17 H8 Ca0.07 Co0.27 F6 Mn0.43 O4.38 Zn0.23 | P 65 2 2 | 21.2716; 21.2716; 15.1756 90; 90; 120 | 5946.7 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128067 | CIF | C17 H8 Ca0.08 Co0.14 F6 Mn0.5 O4.25 Zn0.36 | P 65 2 2 | 21.2398; 21.2398; 15.1793 90; 90; 120 | 5930.4 | Castillo-Blas, Celia; López-Salas, Nieves; Gutiérrez, María C; Puente-Orench, Inés; Gutiérrez-Puebla, Enrique; Ferrer, M. Luisa; Monge, M Ángeles; Gándara, Felipe Encoding Metal-Cation Arrangements in Metal-Organic Frameworks for Programming the Composition of Electrocatalytically Active Multimetal Oxides. Journal of the American Chemical Society, 2019, 141, 1766-1774 |
| 4128068 | CIF | C8 H14 Cl N O4 | P n m a | 12.3345; 8.4335; 9.7578 90; 90; 90 | 1015.04 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128069 | CIF | C10.51 Cl O4 | P m -3 m | 5.1525; 5.1525; 5.1525 90; 90; 90 | 136.79 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128070 | CIF | C7 H12 Cl N O5 | P n a 21 | 12.6094; 9.4862; 8.0894 90; 90; 90 | 967.62 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128071 | CIF | C7 H14 Cl N O4 | P m -3 m | 6.2261; 6.2261; 6.2261 90; 90; 90 | 241.35 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128072 | CIF | C8 H16 Cl N O4 | P 1 21/n 1 | 7.9042; 10.9593; 11.5892 90; 96.337; 90 | 997.77 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128073 | CIF | C7 H14 Cl N O5 | P m -3 m | 6.1928; 6.1928; 6.1928 90; 90; 90 | 237.5 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128074 | CIF | C8 H16 Cl N O4 | P n m a | 11.4473; 8.1623; 11.6646 90; 90; 90 | 1089.9 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128075 | CIF | C8 H14 Cl N O4 | P n m a | 12.6355; 8.692; 9.6224 90; 90; 90 | 1056.81 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128076 | CIF | C7 H14 Cl N O5 | P m -3 m | 6.3172; 6.3172; 6.3172 90; 90; 90 | 252.1 | Yang, Chen-Kai; Chen, Wang-Nan; Ding, Yan-Ting; Wang, Jing; Rao, Yin; Liao, Wei-Qiang; Xie, Yongfa; Zou, Wennan; Xiong, Ren-Gen Directional Intermolecular Interactions for Precise Molecular Design of a High- T<sub>c</sub> Multiaxial Molecular Ferroelectric. Journal of the American Chemical Society, 2019, 141, 1781-1787 |
| 4128077 | CIF | C48 H60 N12 O35 P6 Yb2 | C 1 2/c 1 | 27.533; 11.1178; 24.5325 90; 113.72; 90 | 6875.2 | Nonat, Aline; Bahamyirou, Sylvana; Lecointre, Alexandre; Przybilla, Frédéric; Mély, Yves; Platas-Iglesias, Carlos; Camerel, Franck; Jeannin, Olivier; Charbonnière, Loïc J Molecular Upconversion in Water in Heteropolynuclear Supramolecular Tb/Yb Assemblies. Journal of the American Chemical Society, 2019, 141, 1568-1576 |
| 4128078 | CIF | C14 H10 O S | P b c a | 10.5812; 13.097; 15.615 90; 90; 90 | 2164 | Smith, Ronald A.; Fu, Guanyao; McAteer, Owen; Xu, Mizhi; Gutekunst, Will R. Radical Approach to Thioester-Containing Polymers. Journal of the American Chemical Society, 2019, 141, 1446-1451 |
| 4128079 | CIF | C15 H21 N O5 | P 21 21 21 | 5.9401; 10.656; 23.6934 90; 90; 90 | 1499.74 | Kang, Zhenghui; Wang, Yongheng; Zhang, Dan; Wu, Ruibo; Xu, Xinfang; Hu, Wenhao Asymmetric Counter-Anion-Directed Aminomethylation: Synthesis of Chiral β-Amino Acids via Trapping of an Enol Intermediate. Journal of the American Chemical Society, 2019, 141, 1473-1478 |
| 4128080 | CIF | C15 H17 Ag O11 | P -1 | 8.8042; 10.5315; 10.8818 107.99; 100.432; 104.927 | 889.2 | Kang, Zhenghui; Wang, Yongheng; Zhang, Dan; Wu, Ruibo; Xu, Xinfang; Hu, Wenhao Asymmetric Counter-Anion-Directed Aminomethylation: Synthesis of Chiral β-Amino Acids via Trapping of an Enol Intermediate. Journal of the American Chemical Society, 2019, 141, 1473-1478 |
| 4128081 | CIF | C31 H31 N O3 | P 1 21 1 | 9.6616; 11.6145; 11.4666 90; 96.814; 90 | 1277.63 | Kang, Zhenghui; Wang, Yongheng; Zhang, Dan; Wu, Ruibo; Xu, Xinfang; Hu, Wenhao Asymmetric Counter-Anion-Directed Aminomethylation: Synthesis of Chiral β-Amino Acids via Trapping of an Enol Intermediate. Journal of the American Chemical Society, 2019, 141, 1473-1478 |
| 4128082 | CIF | C38 H55 Ni O P2 | P 1 21/n 1 | 12.1143; 25.5397; 12.3372 90; 114.18; 90 | 3482.2 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128083 | CIF | C47 H62 Br N Ni O P2 | P 1 21/n 1 | 12.0624; 21.708; 16.2095 90; 91.1201; 90 | 4243.7 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128084 | CIF | C43 H59 Br Ni O1.35 P2 | P 1 21/c 1 | 14.4842; 23.5098; 13.0495 90; 115.597; 90 | 4007.5 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128085 | CIF | C43 H64 F3 Ni O2 P2 | P 1 21/c 1 | 11.1268; 24.4126; 16.2109 90; 109.568; 90 | 4149.1 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128086 | CIF | C38 H55 I Ni O P2 | P 65 | 11.6198; 11.6198; 47.0073 90; 90; 120 | 5496.59 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128087 | CIF | C31 H48 Br Ni O P2 | P 1 21/c 1 | 11.1629; 16.8436; 17.3026 90; 105.449; 90 | 3135.8 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128088 | CIF | C67 H108 N2 Ni2 O2 P4 | P 1 21/c 1 | 17.191; 37.515; 23.841 90; 109.287; 90 | 14513 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128089 | CIF | C37 H53 Ni O P2 | P 1 21/n 1 | 12.1524; 25.077; 12.2188 90; 113.495; 90 | 3414.9 | Diccianni, Justin B.; Katigbak, Joseph; Hu, Chunhua; Diao, Tianning Mechanistic Characterization of (Xantphos)Ni(I)-Mediated Alkyl Bromide Activation: Oxidative Addition, Electron Transfer, or Halogen-Atom Abstraction. Journal of the American Chemical Society, 2019, 141, 1788-1796 |
| 4128090 | CIF | C14 H13 Br N2 O2 S | P 1 21/c 1 | 11.1833; 12.89; 10.9328 90; 117.046; 90 | 1403.6 | Liu, Binbin; Ning, Yongquan; Virelli, Matteo; Zanoni, Giuseppe; Anderson, Edward A.; Bi, Xihe Direct Transformation of Terminal Alkynes into Amidines by a Silver-Catalyzed Four-Component Reaction. Journal of the American Chemical Society, 2019, 141, 1593-1598 |
| 4128091 | CIF | C177.45 H243.1 B66 N32.5 O11.35 Zn3 | P -1 | 21.025; 24.479; 25.666 66.64; 70.61; 71.93 | 11193 | Rizzuto, Felix J.; Pröhm, Patrick; Plajer, Alex J.; Greenfield, Jake L.; Nitschke, Jonathan R. Hydrogen-Bond-Assisted Symmetry Breaking in a Network of Chiral Metal-Organic Assemblies. Journal of the American Chemical Society, 2019, 141, 1707-1715 |
| 4128092 | CIF | C110 H106 F12 N18 O22 S4 Zn2 | P 1 21/n 1 | 17.046; 16.504; 21.373 90; 91.51; 90 | 6010.7 | Rizzuto, Felix J.; Pröhm, Patrick; Plajer, Alex J.; Greenfield, Jake L.; Nitschke, Jonathan R. Hydrogen-Bond-Assisted Symmetry Breaking in a Network of Chiral Metal-Organic Assemblies. Journal of the American Chemical Society, 2019, 141, 1707-1715 |
| 4128093 | CIF | C168.5 H156.5 B5.5 F16.5 N31 O25.75 S5.5 Zn3 | P -1 | 22.3184; 24.7127; 25.3074 107.577; 104.677; 111.113 | 11337.5 | Rizzuto, Felix J.; Pröhm, Patrick; Plajer, Alex J.; Greenfield, Jake L.; Nitschke, Jonathan R. Hydrogen-Bond-Assisted Symmetry Breaking in a Network of Chiral Metal-Organic Assemblies. Journal of the American Chemical Society, 2019, 141, 1707-1715 |
| 4128094 | CIF | C168 H161.5 B6 F24 N33.5 O10.5 Zn3 | P 1 21/c 1 | 24.9958; 35.3721; 22.2126 90; 104.784; 90 | 18989.2 | Rizzuto, Felix J.; Pröhm, Patrick; Plajer, Alex J.; Greenfield, Jake L.; Nitschke, Jonathan R. Hydrogen-Bond-Assisted Symmetry Breaking in a Network of Chiral Metal-Organic Assemblies. Journal of the American Chemical Society, 2019, 141, 1707-1715 |
| 4128095 | CIF | C28 H39 N O3 | P 1 21/n 1 | 12.1326; 13.0622; 15.0649 90; 98.628; 90 | 2360.4 | Kim, Daria E.; Zweig, Joshua E.; Newhouse, Timothy R. Total Synthesis of Paspaline A and Emindole PB Enabled by Computational Augmentation of a Transform-Guided Retrosynthetic Strategy. Journal of the American Chemical Society, 2019, 141, 1479-1483 |
| 4128096 | CIF | C18 H28 O3 | P -1 | 7.0924; 10.832; 11.3981 68.891; 74.979; 85.849 | 788.77 | Kim, Daria E.; Zweig, Joshua E.; Newhouse, Timothy R. Total Synthesis of Paspaline A and Emindole PB Enabled by Computational Augmentation of a Transform-Guided Retrosynthetic Strategy. Journal of the American Chemical Society, 2019, 141, 1479-1483 |
| 4128097 | CIF | C28.5 H39 Cl N O2 | P 1 | 11.4162; 13.3892; 18.7283 75.681; 81.697; 89.964 | 2742.85 | Kim, Daria E.; Zweig, Joshua E.; Newhouse, Timothy R. Total Synthesis of Paspaline A and Emindole PB Enabled by Computational Augmentation of a Transform-Guided Retrosynthetic Strategy. Journal of the American Chemical Society, 2019, 141, 1479-1483 |
| 4128098 | CIF | C14 H11 Br O4 | P 21 21 21 | 6.6127; 8.2896; 24.1826 90; 90; 90 | 1325.61 | Trost, Barry M.; Gnanamani, Elumalai; Kalnmals, Christopher A.; Hung, Chao-I Joey; Tracy, Jacob S. Direct Enantio- and Diastereoselective Vinylogous Addition of Butenolides to Chromones Catalyzed by Zn-ProPhenol. Journal of the American Chemical Society, 2019, 141, 1489-1493 |
| 4128099 | CIF | C209 H241 N2 O27 Zn8 | P m -3 | 29.8348; 29.8348; 29.8348 90; 90; 90 | 26556.4 | Zhou, Tian-You; Auer, Bernhard; Lee, Seok J.; Telfer, Shane G. Catalysts Confined in Programmed Framework Pores Enable New Transformations and Tune Reaction Efficiency and Selectivity. Journal of the American Chemical Society, 2019, 141, 1577-1582 |
| 4128100 | CIF | C68 H77 Co2 N4 O6 | I -4 c 2 | 30.049; 30.049; 53.137 90; 90; 90 | 47980 | Li, Bao; Zhao, Yu-Meng; Kirchon, Angelo; Pang, Jian-Dong; Yang, Xin-Yu; Zhuang, Gui-Lin; Zhou, Hong-Cai Unconventional Method for Fabricating Valence Tautomeric Materials: Integrating Redox Center within a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 6822-6826 |
| 4128101 | CIF | C68 H77 Co2 N4 O6 | I -4 c 2 | 30.63; 30.63; 53.381 90; 90; 90 | 50082 | Li, Bao; Zhao, Yu-Meng; Kirchon, Angelo; Pang, Jian-Dong; Yang, Xin-Yu; Zhuang, Gui-Lin; Zhou, Hong-Cai Unconventional Method for Fabricating Valence Tautomeric Materials: Integrating Redox Center within a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 6822-6826 |
| 4128102 | CIF | C68 H77 Co2 N4 O6 | I -4 c 2 | 31.034; 31.034; 53.217 90; 90; 90 | 51254 | Li, Bao; Zhao, Yu-Meng; Kirchon, Angelo; Pang, Jian-Dong; Yang, Xin-Yu; Zhuang, Gui-Lin; Zhou, Hong-Cai Unconventional Method for Fabricating Valence Tautomeric Materials: Integrating Redox Center within a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 6822-6826 |
| 4128103 | CIF | C17 H16 O2 | I 1 2/a 1 | 20.049; 5.46156; 25.6163 90; 107.386; 90 | 2676.81 | Phipps, Erik J. T.; Rovis, Tomislav Rh(III)-Catalyzed C-H Activation-Initiated Directed Cyclopropanation of Allylic Alcohols. Journal of the American Chemical Society, 2019, 141, 6807-6811 |
| 4128104 | CIF | C9 H16 N6 | C 1 2/c 1 | 7.7496; 19.7233; 7.5396 90; 114.514; 90 | 1048.5 | Dale, Harvey J. A.; Hodges, George R.; Lloyd-Jones, Guy C Taming Ambident Triazole Anions: Regioselective Ion Pairing Catalyzes Direct N-Alkylation with Atypical Regioselectivity. Journal of the American Chemical Society, 2019, 141, 7181-7193 |
| 4128105 | CIF | C15 H27 N5 | P n a 21 | 13.4569; 12.842; 9.2876 90; 90; 90 | 1605.02 | Dale, Harvey J. A.; Hodges, George R.; Lloyd-Jones, Guy C Taming Ambident Triazole Anions: Regioselective Ion Pairing Catalyzes Direct N-Alkylation with Atypical Regioselectivity. Journal of the American Chemical Society, 2019, 141, 7181-7193 |
| 4128106 | CIF | C17 H30 N8 | P -1 | 9.6261; 10.341; 10.588 86.497; 82.129; 67.729 | 966.1 | Dale, Harvey J. A.; Hodges, George R.; Lloyd-Jones, Guy C Taming Ambident Triazole Anions: Regioselective Ion Pairing Catalyzes Direct N-Alkylation with Atypical Regioselectivity. Journal of the American Chemical Society, 2019, 141, 7181-7193 |
| 4128107 | CIF | C44 H28 N6 O4 Ru | P -1 | 9.0259; 13.1063; 17.2862 78.761; 76.926; 89.888 | 1951.79 | Elcheikh Mahmoud, Mahmoud; Audi, Hassib; Assoud, Abdeljalil; Ghaddar, Tarek H.; Hmadeh, Mohamad Metal-Organic Framework Photocatalyst Incorporating Bis(4'-(4-carboxyphenyl)-terpyridine)ruthenium(II) for Visible-Light-Driven Carbon Dioxide Reduction. Journal of the American Chemical Society, 2019, 141, 7115-7121 |
| 4128108 | CIF | C288 H192 N36 O72 Ru6 Zr6 | C 1 2/c 1 | 52.5621; 23.1563; 23.8286 90; 95.335; 90 | 28877.2 | Elcheikh Mahmoud, Mahmoud; Audi, Hassib; Assoud, Abdeljalil; Ghaddar, Tarek H.; Hmadeh, Mohamad Metal-Organic Framework Photocatalyst Incorporating Bis(4'-(4-carboxyphenyl)-terpyridine)ruthenium(II) for Visible-Light-Driven Carbon Dioxide Reduction. Journal of the American Chemical Society, 2019, 141, 7115-7121 |
| 4128109 | CIF | C10 H10 I N O | P 21 21 21 | 4.6221; 7.3099; 29.54 90; 90; 90 | 998.1 | Wang, Hao; Park, Yoonsu; Bai, Ziqian; Chang, Sukbok; He, Gang; Chen, Gong Iridium-Catalyzed Enantioselective C(sp<sup>3</sup>)-H Amidation Controlled by Attractive Noncovalent Interactions. Journal of the American Chemical Society, 2019, 141, 7194-7201 |
| 4128110 | CIF | C33 H35 Cl Ir N3 O3 | P 21 21 21 | 14.374; 20.416; 20.775 90; 90; 90 | 6097 | Wang, Hao; Park, Yoonsu; Bai, Ziqian; Chang, Sukbok; He, Gang; Chen, Gong Iridium-Catalyzed Enantioselective C(sp<sup>3</sup>)-H Amidation Controlled by Attractive Noncovalent Interactions. Journal of the American Chemical Society, 2019, 141, 7194-7201 |
| 4128111 | CIF | C100 H92 Cl8 F6 N6 O3 Ru3 S6 | P 1 21/n 1 | 12.6425; 20.1905; 38.4232 90; 93.211; 90 | 9792.4 | Liu, Zhenxing; Xu, Chaofan; Del Pozo, Juan; Torker, Sebastian; Hoveyda, Amir H. Ru-Based Catechothiolate Complexes Bearing an Unsaturated NHC Ligand: Effective Cross-Metathesis Catalysts for Synthesis of ( Z)-α,β-Unsaturated Esters, Carboxylic Acids, and Primary, Secondary, and Weinreb Amides. Journal of the American Chemical Society, 2019, 141, 7137-7146 |
| 4128112 | CIF | C67 H60 Cl4 F4 N4 O3 Ru2 S4 | P 1 21/c 1 | 15.3861; 17.6259; 24.9415 90; 107.801; 90 | 6440.1 | Liu, Zhenxing; Xu, Chaofan; Del Pozo, Juan; Torker, Sebastian; Hoveyda, Amir H. Ru-Based Catechothiolate Complexes Bearing an Unsaturated NHC Ligand: Effective Cross-Metathesis Catalysts for Synthesis of ( Z)-α,β-Unsaturated Esters, Carboxylic Acids, and Primary, Secondary, and Weinreb Amides. Journal of the American Chemical Society, 2019, 141, 7137-7146 |
| 4128113 | CIF | C29 H46 Ca Co N6 O17 | P b c a | 10.7639; 21.7165; 31.819 90; 90; 90 | 7437.8 | Du, Kang; Thorarinsdottir, Agnes E.; Harris, T. David Selective Binding and Quantitation of Calcium with a Cobalt-Based Magnetic Resonance Probe. Journal of the American Chemical Society, 2019, 141, 7163-7172 |
| 4128114 | CIF | C55 H76.36 Co2 N8 O18.1 | I a -3 | 35.066; 35.066; 35.066 90; 90; 90 | 43118 | Du, Kang; Thorarinsdottir, Agnes E.; Harris, T. David Selective Binding and Quantitation of Calcium with a Cobalt-Based Magnetic Resonance Probe. Journal of the American Chemical Society, 2019, 141, 7163-7172 |
| 4128115 | CIF | C52 H72 Co2 N9 Na2 O21 | I a -3 | 34.793; 34.793; 34.793 90; 90; 90 | 42119 | Du, Kang; Thorarinsdottir, Agnes E.; Harris, T. David Selective Binding and Quantitation of Calcium with a Cobalt-Based Magnetic Resonance Probe. Journal of the American Chemical Society, 2019, 141, 7163-7172 |
| 4128116 | CIF | C66 H66 N4 O2 S2 | P -1 | 11.7944; 17.3479; 25.4626 107.716; 94.056; 107.82 | 4646.92 | Chandrabose, Sreelakshmi; Chen, Kai; Barker, Alex J.; Sutton, Joshua J.; Prasad, Shyamal K. K.; Zhu, Jingshuai; Zhou, Jiadong; Gordon, Keith C.; Xie, Zengqi; Zhan, Xiaowei; Hodgkiss, Justin M. High Exciton Diffusion Coefficients in Fused Ring Electron Acceptor Films. Journal of the American Chemical Society, 2019, 141, 6922-6929 |
| 4128117 | CIF | C177.5 H139.5 F4.5 I9 N49.25 O4.5 P4 S1.5 Zn6 | P -1 | 21.166; 21.8072; 35.8636 90.804; 102.438; 104.311 | 15623.8 | McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Post-assembly Modification of Phosphine Cages Controls Host-Guest Behavior. Journal of the American Chemical Society, 2019, 141, 6837-6842 |
| 4128118 | CIF | C196 H180 Fe4 N63 O37.17 P4.67 S4 | R -3 c :H | 42.046; 42.046; 107.4786 90; 90; 120 | 164552 | McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Post-assembly Modification of Phosphine Cages Controls Host-Guest Behavior. Journal of the American Chemical Society, 2019, 141, 6837-6842 |
| 4128119 | CIF | C228.5 H186.75 F13.5 I8.5 N53 Ni5.1 O9 P4 S4.5 | P -1 | 21.1855; 24.1723; 33.8253 89.961; 84.215; 65.895 | 15715.3 | McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Post-assembly Modification of Phosphine Cages Controls Host-Guest Behavior. Journal of the American Chemical Society, 2019, 141, 6837-6842 |
| 4128120 | CIF | C31 H48 Br N O5 | P 21 21 21 | 4.9802; 22.13; 28.504 90; 90; 90 | 3141.5 | Liu, Cui-Ping; Xie, Cheng-Ying; Zhao, Jin-Xin; Ji, Kai-Long; Lei, Xin-Xiang; Sun, Han; Lou, Li-Guang; Yue, Jian-Min Dysoxylactam A: A Macrocyclolipopeptide Reverses P-Glycoprotein-Mediated Multidrug Resistance in Cancer Cells. Journal of the American Chemical Society, 2019, 141, 6812-6816 |
| 4128121 | CIF | C160 H200 Cl26 Li6 N4 O40 P4 Pd4 S8 | P 21 21 2 | 23.055; 23.056; 23.99 90; 90; 90 | 12752 | Liu, Qian; Jordan, Richard F. Sterically Controlled Self-Assembly of a Robust Multinuclear Palladium Catalyst for Ethylene Polymerization. Journal of the American Chemical Society, 2019, 141, 6827-6831 |
| 4128122 | CIF | C15 H9 N2 S2 | P 21 21 21 | 10.779; 14.999; 25.118 90; 90; 90 | 4060.9 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128123 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 10.212; 7.996; 15.782 90; 100.49; 90 | 1267.1 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128124 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 14.762; 10.712; 8.346 90; 97.792; 90 | 1307.6 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128125 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 14.7027; 10.7141; 8.2871 90; 98.771; 90 | 1290.17 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128126 | CIF | C15 H9 N2 S2 | P 21 21 21 | 10.7397; 14.859; 24.974 90; 90; 90 | 3985.4 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128127 | CIF | C15 H9 N2 S2 | P 21 21 21 | 10.7459; 14.8885; 25.019 90; 90; 90 | 4002.8 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128128 | CIF | C15 H9 N2 S2 | P 1 21/n 1 | 13.412; 14.723; 13.429 90; 104.666; 90 | 2565.4 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128129 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 14.672; 10.673; 8.294 90; 98.49; 90 | 1284.6 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128130 | CIF | C15 H9 N2 S2 | P 1 21/n 1 | 13.4489; 14.7539; 13.4604 90; 104.725; 90 | 2583.1 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128131 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 14.788; 10.794; 8.355 90; 97.334; 90 | 1323 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128132 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 10.2054; 7.9074; 15.6084 90; 100.069; 90 | 1240.17 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128133 | CIF | C15 H9 N2 S2 | P 1 21/c 1 | 14.79; 10.719; 8.355 90; 97.001; 90 | 1314.7 | Beldjoudi, Yassine; Arauzo, Ana; Campo, Javier; Gavey, Emma L.; Pilkington, Melanie; Nascimento, Mitchell A.; Rawson, Jeremy M. Structural, Magnetic, and Optical Studies of the Polymorphic 9'-Anthracenyl Dithiadiazolyl Radical. Journal of the American Chemical Society, 2019, 141, 6875-6889 |
| 4128134 | CIF | C64 H132 Al2 Li2 O8 P4 Si4 | P b c n | 22.2409; 16.5648; 22.3829 90; 90; 90 | 8246.2 | Du, Shanshan; Yang, Jimin; Hu, Jingyuan; Chai, Zhengqi; Luo, Gen; Luo, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng Direct Functionalization of White Phosphorus to Cyclotetraphosphanes: Selective Formation of Four P-C Bonds. Journal of the American Chemical Society, 2019, 141, 6843-6847 |
| 4128135 | CIF | C76 H152 Al2 Li2 O10 P4 Si4 | P b c a | 16.4422; 20.0536; 27.5154 90; 90; 90 | 9072.5 | Du, Shanshan; Yang, Jimin; Hu, Jingyuan; Chai, Zhengqi; Luo, Gen; Luo, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng Direct Functionalization of White Phosphorus to Cyclotetraphosphanes: Selective Formation of Four P-C Bonds. Journal of the American Chemical Society, 2019, 141, 6843-6847 |
| 4128136 | CIF | C34 H74 Al2 P4 Si4 | P 21 21 21 | 14.9811; 16.4506; 17.9869 90; 90; 90 | 4432.84 | Du, Shanshan; Yang, Jimin; Hu, Jingyuan; Chai, Zhengqi; Luo, Gen; Luo, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng Direct Functionalization of White Phosphorus to Cyclotetraphosphanes: Selective Formation of Four P-C Bonds. Journal of the American Chemical Society, 2019, 141, 6843-6847 |
| 4128137 | CIF | C16 H32 K O P Si2 | P 1 21/c 1 | 15.9907; 12.3762; 10.9542 90; 95.493; 90 | 2157.9 | Du, Shanshan; Yang, Jimin; Hu, Jingyuan; Chai, Zhengqi; Luo, Gen; Luo, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng Direct Functionalization of White Phosphorus to Cyclotetraphosphanes: Selective Formation of Four P-C Bonds. Journal of the American Chemical Society, 2019, 141, 6843-6847 |
| 4128138 | CIF | C14 H30 I P Si2 | P 1 21/c 1 | 14.5868; 15.2506; 19.9075 90; 104.964; 90 | 4278.39 | Du, Shanshan; Yang, Jimin; Hu, Jingyuan; Chai, Zhengqi; Luo, Gen; Luo, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng Direct Functionalization of White Phosphorus to Cyclotetraphosphanes: Selective Formation of Four P-C Bonds. Journal of the American Chemical Society, 2019, 141, 6843-6847 |
| 4128139 | CIF | C10 H14 Fe N4 | P 31 2 1 | 8.4206; 8.4206; 13.1696 90; 90; 120 | 808.7 | López-Cabrelles, Javier; Romero, Jorge; Abellán, Gonzalo; Giménez-Marqués, Mónica; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Mínguez Espallargas, Guillermo Solvent-Free Synthesis of ZIFs: A Route toward the Elusive Fe(II) Analogue of ZIF-8. Journal of the American Chemical Society, 2019, 141, 7173-7180 |
| 4128140 | CIF | C8 H10 Fe N4 | I -4 3 m | 17.1656; 17.1656; 17.1656 90; 90; 90 | 5057.98 | López-Cabrelles, Javier; Romero, Jorge; Abellán, Gonzalo; Giménez-Marqués, Mónica; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Mínguez Espallargas, Guillermo Solvent-Free Synthesis of ZIFs: A Route toward the Elusive Fe(II) Analogue of ZIF-8. Journal of the American Chemical Society, 2019, 141, 7173-7180 |
| 4128141 | CIF | C16 H14 Fe N4 | P 21 21 21 | 9.2434; 9.3503; 15.9876 90; 90; 90 | 1381.8 | López-Cabrelles, Javier; Romero, Jorge; Abellán, Gonzalo; Giménez-Marqués, Mónica; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Mínguez Espallargas, Guillermo Solvent-Free Synthesis of ZIFs: A Route toward the Elusive Fe(II) Analogue of ZIF-8. Journal of the American Chemical Society, 2019, 141, 7173-7180 |
| 4128142 | CIF | C15 H18 O3 | P 1 21/c 1 | 8.0015; 10.2072; 14.8838 90; 90.669; 90 | 1215.52 | Lee, Chung Whan; Taylor, Buck L. H.; Petrova, Galina P.; Patel, Ashay; Morokuma, Keiji; Houk, K. N.; Stoltz, Brian M. An Unexpected Ireland-Claisen Rearrangement Cascade During the Synthesis of the Tricyclic Core of Curcusone C: Mechanistic Elucidation by Trial-and-Error and Automatic Artificial Force-Induced Reaction (AFIR) Computations. Journal of the American Chemical Society, 2019, 141, 6995-7004 |
| 4128143 | CIF | C22 H26 N2 O4 S | P -1 | 19.3346; 21.5305; 9.9784 90.199; 93.729; 90.81 | 4144.6 | Lee, Chung Whan; Taylor, Buck L. H.; Petrova, Galina P.; Patel, Ashay; Morokuma, Keiji; Houk, K. N.; Stoltz, Brian M. An Unexpected Ireland-Claisen Rearrangement Cascade During the Synthesis of the Tricyclic Core of Curcusone C: Mechanistic Elucidation by Trial-and-Error and Automatic Artificial Force-Induced Reaction (AFIR) Computations. Journal of the American Chemical Society, 2019, 141, 6995-7004 |
| 4128144 | CIF | C29 H38 N2 O3 Si | P 1 21/c 1 | 13.567; 21.132; 10.077 90; 107.266; 90 | 2758.9 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128145 | CIF | C19 H25 N O4 | P 1 21/c 1 | 13.1415; 10.9429; 12.8855 90; 113.53; 90 | 1698.9 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128146 | CIF | C18 H19 Cl N2 O | P 1 21/c 1 | 33.295; 11.0183; 12.8497 90; 99.527; 90 | 4649 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128147 | CIF | C14 H15 N O | P 1 21/n 1 | 13.263; 11.842; 15.897 90; 110.521; 90 | 2338.4 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128148 | CIF | C19 H23 N2 O | P -1 | 8.1557; 11.787; 16.3493 85.937; 89.698; 85.953 | 1563.82 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128149 | CIF | C17 H21 N O2 | C 1 2/c 1 | 23.649; 7.8636; 20.272 90; 126.277; 90 | 3039.2 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128150 | CIF | C25 H26 N2 O3 | P 1 21 1 | 10.91514; 12.1031; 32.0994 90; 95.1628; 90 | 4223.35 | Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun Enantioselective Total Synthesis of (+)-Arboridinine. Journal of the American Chemical Society, 2019, 141, 7147-7154 |
| 4128151 | CIF | C29 H40 N2 O8 S2 | P 1 | 6.1734; 12.3999; 20.4254 97.203; 97.059; 99.727 | 1512.23 | Vanable, Evan P.; Kennemur, Jennifer L.; Joyce, Leo A.; Ruck, Rebecca T.; Schultz, Danielle M.; Hull, Kami L. Rhodium-Catalyzed Asymmetric Hydroamination of Allyl Amines. Journal of the American Chemical Society, 2019, 141, 739-742 |
| 4128152 | CIF | C22 H33 N O6 S | P 1 21 1 | 10.5503; 9.1488; 12.4459 90; 98.766; 90 | 1187.28 | Tan, Dan; Jamieson, Cooper S.; Ohashi, Masao; Tang, Man-Cheng; Houk, K. N.; Tang, Yi Genome-Mined Diels-Alderase Catalyzes Formation of the cis-Octahydrodecalins of Varicidin A and B. Journal of the American Chemical Society, 2019, 141, 769-773 |
| 4128153 | CIF | C13 H21 N O2 | P 1 21/n 1 | 9.7653; 9.7181; 13.3075 90; 98.833; 90 | 1247.9 | Feng, Zhengao; Allred, Tyler K.; Hurlow, Evan E.; Harran, Patrick G. Anomalous Chromophore Disruption Enables an Eight-Step Synthesis and Stereochemical Reassignment of (+)-Marineosin A. Journal of the American Chemical Society, 2019, 141, 2274-2278 |
| 4128154 | CIF | C13 H19 N O | P 1 21/n 1 | 7.7866; 15.2172; 10.1883 90; 112.279; 90 | 1117.09 | Feng, Zhengao; Allred, Tyler K.; Hurlow, Evan E.; Harran, Patrick G. Anomalous Chromophore Disruption Enables an Eight-Step Synthesis and Stereochemical Reassignment of (+)-Marineosin A. Journal of the American Chemical Society, 2019, 141, 2274-2278 |
| 4128155 | CIF | C26.5 H37.5 Cl N3 O2 | C 1 2 1 | 33.1593; 8.7821; 23.3882 90; 129.718; 90 | 5238.9 | Feng, Zhengao; Allred, Tyler K.; Hurlow, Evan E.; Harran, Patrick G. Anomalous Chromophore Disruption Enables an Eight-Step Synthesis and Stereochemical Reassignment of (+)-Marineosin A. Journal of the American Chemical Society, 2019, 141, 2274-2278 |
| 4128156 | CIF | C13 H19 N O | P 1 21/n 1 | 9.422; 9.3471; 12.8767 90; 99.966; 90 | 1116.92 | Feng, Zhengao; Allred, Tyler K.; Hurlow, Evan E.; Harran, Patrick G. Anomalous Chromophore Disruption Enables an Eight-Step Synthesis and Stereochemical Reassignment of (+)-Marineosin A. Journal of the American Chemical Society, 2019, 141, 2274-2278 |
| 4128157 | CIF | C26 H38 Cu N4 O8 | P 1 21/c 1 | 10.609; 7.879; 17.4437 90; 97.679; 90 | 1445 | Feng, Zhengao; Allred, Tyler K.; Hurlow, Evan E.; Harran, Patrick G. Anomalous Chromophore Disruption Enables an Eight-Step Synthesis and Stereochemical Reassignment of (+)-Marineosin A. Journal of the American Chemical Society, 2019, 141, 2274-2278 |
| 4128158 | CIF | C27 H32 Cl2 N2 O | P -1 | 9.9276; 10.7525; 12.9548 99.713; 104.856; 110.259 | 1202.35 | Johnson, Rebecca E.; Ree, Hwisoo; Hartmann, Marco; Lang, Laura; Sawano, Shota; Sarpong, Richmond Total Synthesis of Pentacyclic (-)-Ambiguine P Using Sequential Indole Functionalizations. Journal of the American Chemical Society, 2019, 141, 2233-2237 |
| 4128159 | CIF | C26 H28 N2 O | P 21 21 21 | 9.217; 12.9842; 17.6732 90; 90; 90 | 2115.05 | Johnson, Rebecca E.; Ree, Hwisoo; Hartmann, Marco; Lang, Laura; Sawano, Shota; Sarpong, Richmond Total Synthesis of Pentacyclic (-)-Ambiguine P Using Sequential Indole Functionalizations. Journal of the American Chemical Society, 2019, 141, 2233-2237 |
| 4128160 | CIF | C21 H24 N2 O6 S | P -1 | 8.0296; 10.96; 13.2363 75.163; 73.585; 80.678 | 1075.1 | Wang, Ye; Zhang, Wen-Yun; You, Shu-Li Ketones and Aldehydes as O-Nucleophiles in Iridium-Catalyzed Intramolecular Asymmetric Allylic Substitution Reaction. Journal of the American Chemical Society, 2019, 141, 2228-2232 |
| 4128161 | CIF | C19 H18 F N O3 S | P 1 | 8.2832; 10.1297; 10.7689 79.365; 82.958; 76.332 | 859.95 | Wang, Ye; Zhang, Wen-Yun; You, Shu-Li Ketones and Aldehydes as O-Nucleophiles in Iridium-Catalyzed Intramolecular Asymmetric Allylic Substitution Reaction. Journal of the American Chemical Society, 2019, 141, 2228-2232 |
| 4128162 | CIF | C19 H18 N2 O5 S | P 1 21 1 | 11.9205; 6.7662; 23.36 90; 92.608; 90 | 1882.18 | Wang, Ye; Zhang, Wen-Yun; You, Shu-Li Ketones and Aldehydes as O-Nucleophiles in Iridium-Catalyzed Intramolecular Asymmetric Allylic Substitution Reaction. Journal of the American Chemical Society, 2019, 141, 2228-2232 |
| 4128163 | CIF | C25 H22 F3 N O5 | P 1 21/c 1 | 9.5048; 19.9335; 12.2973 90; 103.258; 90 | 2267.8 | Zhu, Min; Zheng, Chao; Zhang, Xiao; You, Shu-Li Synthesis of Cyclobutane-Fused Angular Tetracyclic Spiroindolines via Visible-Light-Promoted Intramolecular Dearomatization of Indole Derivatives. Journal of the American Chemical Society, 2019, 141, 2636-2644 |
| 4128164 | CIF | C17 H19 N O3 | P -1 | 8.9322; 9.3914; 10.8992 65.743; 71.707; 63.078 | 733.98 | Zhu, Min; Zheng, Chao; Zhang, Xiao; You, Shu-Li Synthesis of Cyclobutane-Fused Angular Tetracyclic Spiroindolines via Visible-Light-Promoted Intramolecular Dearomatization of Indole Derivatives. Journal of the American Chemical Society, 2019, 141, 2636-2644 |
| 4128165 | CIF | C76 H30 F24 N2 O32 Zr6 | P 42/m m c | 23.0084; 23.0084; 18.8119 90; 90; 90 | 9958.8 | Cao, Chen-Chen; Chen, Cheng-Xia; Wei, Zhang-Wen; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Wang, Dawei; Su, Cheng-Yong Catalysis through Dynamic Spacer Installation of Multivariate Functionalities in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 2589-2593 |
| 4128166 | CIF | C78 H33 Cu F24 I N3 O32 Zr6 | P 42/m m c | 22.957; 22.957; 18.806 90; 90; 90 | 9911.2 | Cao, Chen-Chen; Chen, Cheng-Xia; Wei, Zhang-Wen; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Wang, Dawei; Su, Cheng-Yong Catalysis through Dynamic Spacer Installation of Multivariate Functionalities in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 2589-2593 |
| 4128167 | CIF | C96 H43 F24 N3 O32 Zr6 | P 42/m m c | 23.047; 23.047; 18.6989 90; 90; 90 | 9932.2 | Cao, Chen-Chen; Chen, Cheng-Xia; Wei, Zhang-Wen; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Wang, Dawei; Su, Cheng-Yong Catalysis through Dynamic Spacer Installation of Multivariate Functionalities in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 2589-2593 |
| 4128168 | CIF | C98 H46 Cu F24 I N4 O32 Zr6 | P 42/m m c | 23.0903; 23.0903; 18.738 90; 90; 90 | 9990.4 | Cao, Chen-Chen; Chen, Cheng-Xia; Wei, Zhang-Wen; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Wang, Dawei; Su, Cheng-Yong Catalysis through Dynamic Spacer Installation of Multivariate Functionalities in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 2589-2593 |
| 4128169 | CIF | C18 H20 O4 | P 21 21 21 | 7.7102; 12.109; 15.8056 90; 90; 90 | 1475.66 | McLaughlin, Michael F.; Massolo, Elisabetta; Liu, Shubin; Johnson, Jeffrey S. Enantioselective Phenolic α-Oxidation Using H<sub>2</sub>O<sub>2</sub> via an Unusual Double Dearomatization Mechanism. Journal of the American Chemical Society, 2019, 141, 2645-2651 |
| 4128170 | CIF | C80.5 H54 B F21.5 Mn N9 O8 | P -1 | 12.448; 16.428; 19.623 72.87; 78.954; 70.115 | 3587 | Hunt, Camden; Peterson, Madeline; Anderson, Cassidy; Chang, Tieyan; Wu, Guang; Scheiner, Steve; Ménard, Gabriel Switchable Aromaticity in an Isostructural Mn Phthalocyanine Series Isolated in Five Separate Redox States. Journal of the American Chemical Society, 2019, 141, 2604-2613 |
| 4128171 | CIF | C138 H90 B2 F40 Mn N9 O8 | I 41 c d | 45.776; 45.776; 14.458 90; 90; 90 | 30296 | Hunt, Camden; Peterson, Madeline; Anderson, Cassidy; Chang, Tieyan; Wu, Guang; Scheiner, Steve; Ménard, Gabriel Switchable Aromaticity in an Isostructural Mn Phthalocyanine Series Isolated in Five Separate Redox States. Journal of the American Chemical Society, 2019, 141, 2604-2613 |
| 4128172 | CIF | C96 H132 K2 Mn N13 O20 | P -1 | 14.626; 17.578; 19.915 87.379; 70.556; 89.075 | 4823 | Hunt, Camden; Peterson, Madeline; Anderson, Cassidy; Chang, Tieyan; Wu, Guang; Scheiner, Steve; Ménard, Gabriel Switchable Aromaticity in an Isostructural Mn Phthalocyanine Series Isolated in Five Separate Redox States. Journal of the American Chemical Society, 2019, 141, 2604-2613 |
| 4128173 | CIF | C50 H48.5 Cl4 Mn N9 O8 | I 41 | 37.0495; 37.0495; 14.6013 90; 90; 90 | 20042.7 | Hunt, Camden; Peterson, Madeline; Anderson, Cassidy; Chang, Tieyan; Wu, Guang; Scheiner, Steve; Ménard, Gabriel Switchable Aromaticity in an Isostructural Mn Phthalocyanine Series Isolated in Five Separate Redox States. Journal of the American Chemical Society, 2019, 141, 2604-2613 |
| 4128174 | CIF | C70 H92 K Mn N11 O15 | P -1 | 14.123; 15.53; 16.283 78.073; 80.064; 89.083 | 3441.1 | Hunt, Camden; Peterson, Madeline; Anderson, Cassidy; Chang, Tieyan; Wu, Guang; Scheiner, Steve; Ménard, Gabriel Switchable Aromaticity in an Isostructural Mn Phthalocyanine Series Isolated in Five Separate Redox States. Journal of the American Chemical Society, 2019, 141, 2604-2613 |
| 4128175 | CIF | C88 H44 O36 S2 Zr6 | P 6/m m m | 39.403; 39.403; 16.379 90; 90; 120 | 22023 | Kato, Satoshi; Otake, Ken-Ichi; Chen, Haoyuan; Akpinar, Isil; Buru, Cassandra T.; Islamoglu, Timur; Snurr, Randall Q.; Farha, Omar K. Zirconium-Based Metal-Organic Frameworks for the Removal of Protein-Bound Uremic Toxin from Human Serum Albumin. Journal of the American Chemical Society, 2019, 141, 2568-2576 |
| 4128176 | CIF | C88 H44 O36 S2 Zr6 | P 6/m m m | 38.964; 38.964; 16.861 90; 90; 120 | 22169 | Kato, Satoshi; Otake, Ken-Ichi; Chen, Haoyuan; Akpinar, Isil; Buru, Cassandra T.; Islamoglu, Timur; Snurr, Randall Q.; Farha, Omar K. Zirconium-Based Metal-Organic Frameworks for the Removal of Protein-Bound Uremic Toxin from Human Serum Albumin. Journal of the American Chemical Society, 2019, 141, 2568-2576 |
| 4128177 | CIF | C28 H18 Mn N O3 | P b c a | 19.1024; 7.84458; 32.2257 90; 90; 90 | 4829.03 | Hammarback, L. Anders; Robinson, Alan; Lynam, Jason M.; Fairlamb, Ian J. S. Mechanistic Insight into Catalytic Redox-Neutral C-H Bond Activation Involving Manganese(I) Carbonyls: Catalyst Activation, Turnover, and Deactivation Pathways Reveal an Intricate Network of Steps. Journal of the American Chemical Society, 2019, 141, 2316-2328 |
| 4128178 | CIF | C32 H34 Cl2 F4 Ir N3 O2 S | P 41 | 12.3048; 12.3048; 21.882 90; 90; 90 | 3313.1 | Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst. Journal of the American Chemical Society, 2019, 141, 2661-2677 |
| 4128179 | CIF | C32 H32 Cl F5 N2 O2 Ru S | P 32 2 1 | 14.9367; 14.9367; 27.3869 90; 90; 120 | 5291.5 | Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst. Journal of the American Chemical Society, 2019, 141, 2661-2677 |
| 4128180 | CIF | C30 H28 Cl F5 N2 O2 Ru S | P 21 21 21 | 15.605; 16.467; 25.342 90; 90; 90 | 6512.1 | Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst. Journal of the American Chemical Society, 2019, 141, 2661-2677 |
| 4128181 | CIF | C30 H29 F4 N3 O2 Ru S | P 21 21 2 | 17.11; 20.318; 7.9383 90; 90; 90 | 2759.7 | Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst. Journal of the American Chemical Society, 2019, 141, 2661-2677 |
| 4128182 | CIF | C30 H30 Cl F4 N3 O2 Ru S | P 21 21 21 | 15.499; 16.632; 25.507 90; 90; 90 | 6575 | Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst. Journal of the American Chemical Society, 2019, 141, 2661-2677 |
| 4128183 | CIF | C36 H32 Br2 N2 | P c c n | 35.627; 9.1472; 9.3099 90; 90; 90 | 3034 | Su, Lebin; Ren, Tianbing; Dong, Jianyu; Liu, Lixin; Xie, Shimin; Yuan, Lin; Zhou, Yongbo; Yin, Shuang-Feng Cu(I)-Catalyzed 6- endo-dig Cyclization of Terminal Alkynes, 2-Bromoaryl Ketones, and Amides toward 1-Naphthylamines: Applications and Photophysical Properties. Journal of the American Chemical Society, 2019, 141, 2535-2544 |
| 4128184 | CIF | C43 H36 Br2 Cl4 O2 P2 Pd | P -1 | 9.4219; 11.7273; 20.2438 85.146; 82.356; 70.742 | 2090.89 | Palani, Vignesh; Hugelshofer, Cedric L.; Kevlishvili, Ilia; Liu, Peng; Sarpong, Richmond A Short Synthesis of Delavatine A Unveils New Insights into Site-Selective Cross-Coupling of 3,5-Dibromo-2-pyrone. Journal of the American Chemical Society, 2019, 141, 2652-2660 |
| 4128185 | CIF | C45 H40 Br2 O4 P2 Pd | P 1 21/n 1 | 18.1079; 11.4361; 19.9348 90; 95.68; 90 | 4107.9 | Palani, Vignesh; Hugelshofer, Cedric L.; Kevlishvili, Ilia; Liu, Peng; Sarpong, Richmond A Short Synthesis of Delavatine A Unveils New Insights into Site-Selective Cross-Coupling of 3,5-Dibromo-2-pyrone. Journal of the American Chemical Society, 2019, 141, 2652-2660 |
| 4128186 | CIF | C104 H134 Gd N7 O9 | P 1 21/n 1 | 14.41; 26.353; 25.89 90; 100.82; 90 | 9657 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128187 | CIF | C98 H130 Ce N3 O9 | P -1 | 13.8196; 14.4869; 24.637 74.072; 78.911; 74.159 | 4526 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128188 | CIF | C104 H134 N7 Nd O9 | P 1 21/n 1 | 14.4599; 26.1103; 25.9352 90; 100.694; 90 | 9621.8 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128189 | CIF | C104 H134 N7 O9 Sm | P 1 21/n 1 | 14.4338; 26.3116; 25.959 90; 100.947; 90 | 9679.2 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128190 | CIF | C104 H134 Am N7 O9 | P 1 21/n 1 | 14.45; 26.24; 25.935 90; 100.667; 90 | 9664 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128191 | CIF | C104 H134 Cf N7 O9 | P 1 21/n 1 | 14.3744; 26.2457; 25.7763 90; 100.691; 90 | 9555.7 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128192 | CIF | C104 H134 Bk N7 O9 | P 1 21/n 1 | 14.433; 26.291; 25.768 90; 100.908; 90 | 9601 | Galley, Shane S.; Pattenaude, Scott A.; Gaggioli, Carlo Alberto; Qiao, Yusen; Sperling, Joseph M.; Zeller, Matthias; Pakhira, Srimanta; Mendoza-Cortes, Jose L; Schelter, Eric J.; Albrecht-Schmitt, Thomas E; Gagliardi, Laura; Bart, Suzanne C. Synthesis and Characterization of Tris-chelate Complexes for Understanding f-Orbital Bonding in Later Actinides. Journal of the American Chemical Society, 2019, 141, 2356-2366 |
| 4128193 | CIF | C191 H132 Au10 F12 O6 P8 | P 61 | 19.467; 19.467; 92.8172 90; 90; 120 | 30461.9 | Wang, Jia-Qi; Guan, Zong-Jie; Liu, Wen-Di; Yang, Yang; Wang, Quan-Ming Chiroptical Activity Enhancement via Structural Control: The Chiral Synthesis and Reversible Interconversion of Two Intrinsically Chiral Gold Nanoclusters. Journal of the American Chemical Society, 2019, 141, 2384-2390 |
| 4128194 | CIF | C182 H128 Au9 F9 O6 P8 | P 1 21 1 | 17.4001; 35.5243; 30.561 90; 98.414; 90 | 18687.2 | Wang, Jia-Qi; Guan, Zong-Jie; Liu, Wen-Di; Yang, Yang; Wang, Quan-Ming Chiroptical Activity Enhancement via Structural Control: The Chiral Synthesis and Reversible Interconversion of Two Intrinsically Chiral Gold Nanoclusters. Journal of the American Chemical Society, 2019, 141, 2384-2390 |
| 4128195 | CIF | C182 H128 Au9 F9 O6 P8 | P 1 21 1 | 17.3706; 35.3798; 30.3366 90; 98.232; 90 | 18451.8 | Wang, Jia-Qi; Guan, Zong-Jie; Liu, Wen-Di; Yang, Yang; Wang, Quan-Ming Chiroptical Activity Enhancement via Structural Control: The Chiral Synthesis and Reversible Interconversion of Two Intrinsically Chiral Gold Nanoclusters. Journal of the American Chemical Society, 2019, 141, 2384-2390 |
| 4128196 | CIF | C193 H136 Au10 Cl4 F12 O6 P8 | P 65 | 19.362; 19.362; 92.9191 90; 90; 120 | 30167.3 | Wang, Jia-Qi; Guan, Zong-Jie; Liu, Wen-Di; Yang, Yang; Wang, Quan-Ming Chiroptical Activity Enhancement via Structural Control: The Chiral Synthesis and Reversible Interconversion of Two Intrinsically Chiral Gold Nanoclusters. Journal of the American Chemical Society, 2019, 141, 2384-2390 |
| 4128197 | CIF | C76 H118 Ge2 Si8 | P -1 | 11.4109; 11.6276; 16.4067 95.899; 105.824; 106.2 | 1973.2 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128198 | CIF | C60 H118 Ge2 Si8 | P 1 21/c 1 | 9.1996; 22.4437; 17.8293 90; 101.764; 90 | 3603.9 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128199 | CIF | C68 H118 Ge2 Si8 | P -1 | 11.8587; 16.0807; 20.2574 93.649; 90.967; 95.407 | 3837 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128200 | CIF | C76 H118 Ge2 Si8 | C 1 2/c 1 | 24.367; 11.3524; 29.8468 90; 111.303; 90 | 7692.2 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128201 | CIF | C61.5 H121.5 Ge2 Si8 | P -1 | 15.6836; 21.5547; 22.032 86.122; 82.522; 89.579 | 7367.8 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128202 | CIF | C71 H125 Ge2 Si8 | C 1 2/c 1 | 31.226; 11.4284; 45.092 90; 100.488; 90 | 15823 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128203 | CIF | C60 H118 Ge2 O2 Si8 | P -1 | 12.7441; 15.5507; 20.9457 69.667; 75.386; 68.767 | 3589.95 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128204 | CIF | C65 H127 Ge2 Si8 | P -1 | 12.4071; 18.3949; 19.3957 69.422; 72.001; 74.049 | 3872.1 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128205 | CIF | C61 H118 Ge2 O2 Si8 | P 1 21/c 1 | 17.1325; 23.6837; 18.3085 90; 98.113; 90 | 7354.52 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128206 | CIF | C69 H141 Ge2 Si8 | P 1 21/n 1 | 18.2543; 24.2181; 20.2933 90; 106.345; 90 | 8608.8 | Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules. Journal of the American Chemical Society, 2019, 141, 2263-2267 |
| 4128207 | CIF | C9 H30 Br7 N3 Pb2 | C m c 21 | 39.1358; 8.3463; 8.1804 90; 90; 90 | 2672.04 | Li, Lina; Liu, Xitao; Li, Yaobin; Xu, Zhiyun; Wu, Zhenyue; Han, Shiguo; Tao, Kewen; Hong, Maochun; Luo, Junhua; Sun, Zhihua Two-Dimensional Hybrid Perovskite-Type Ferroelectric for Highly Polarization-Sensitive Shortwave Photodetection. Journal of the American Chemical Society, 2019, 141, 2623-2629 |
| 4128208 | CIF | C9 H30 Br7 N3 Pb2 | C m c m | 39.4594; 8.4214; 8.3557 90; 90; 90 | 2776.63 | Li, Lina; Liu, Xitao; Li, Yaobin; Xu, Zhiyun; Wu, Zhenyue; Han, Shiguo; Tao, Kewen; Hong, Maochun; Luo, Junhua; Sun, Zhihua Two-Dimensional Hybrid Perovskite-Type Ferroelectric for Highly Polarization-Sensitive Shortwave Photodetection. Journal of the American Chemical Society, 2019, 141, 2623-2629 |
| 4128209 | CIF | C27 H42 Ir N O2 S | P 1 21/n 1 | 16.3025; 8.4734; 20.1181 90; 101.383; 90 | 2724.4 | Lei, Honghui; Rovis, Tomislav Ir-Catalyzed Intermolecular Branch-Selective Allylic C-H Amidation of Unactivated Terminal Olefins. Journal of the American Chemical Society, 2019, 141, 2268-2273 |
| 4128210 | CIF | C44 H38 Cl O P Pt | P -1 | 11.233; 13.617; 13.798 84.553; 70.61; 81.993 | 1968.7 | Higashi, Takuya; Ando, Hideaki; Kusumoto, Shuhei; Nozaki, Kyoko Metal-Ligand Cooperative C-H Bond Formation by Cyclopentadienone Platinum Complexes. Journal of the American Chemical Society, 2019, 141, 2247-2250 |
| 4128211 | CIF | C44 H37 O P Pt | P 1 21/n 1 | 9.95; 19.942; 17.567 90; 104.988; 90 | 3367.1 | Higashi, Takuya; Ando, Hideaki; Kusumoto, Shuhei; Nozaki, Kyoko Metal-Ligand Cooperative C-H Bond Formation by Cyclopentadienone Platinum Complexes. Journal of the American Chemical Society, 2019, 141, 2247-2250 |
| 4128212 | CIF | C45 H34 F3 O3 P Pt | P 1 21/n 1 | 12.32; 17.797; 17.235 90; 91.204; 90 | 3778.1 | Higashi, Takuya; Ando, Hideaki; Kusumoto, Shuhei; Nozaki, Kyoko Metal-Ligand Cooperative C-H Bond Formation by Cyclopentadienone Platinum Complexes. Journal of the American Chemical Society, 2019, 141, 2247-2250 |
| 4128213 | CIF | C74 H69 B F24 Ir P | P 1 21/c 1 | 17.5592; 20.0983; 20.2944 90; 99.695; 90 | 7059.8 | Moreno, Juan J.; Espada, María F; Campos, Jesús; López-Serrano, Joaquín; Macgregor, Stuart A.; Carmona, Ernesto Base-Promoted, Remote C-H Activation at a Cationic (η<sup>5</sup>-C<sub>5</sub>Me<sub>5</sub>)Ir(III) Center Involving Reversible C-C Bond Formation of Bound C<sub>5</sub>Me<sub>5</sub>. Journal of the American Chemical Society, 2019, 141, 2205-2210 |
| 4128214 | CIF | C66 H54 B Cl F24 Ir P | P 1 21 1 | 12.8963; 19.5146; 13.2343 90; 96.898; 90 | 3306.5 | Moreno, Juan J.; Espada, María F; Campos, Jesús; López-Serrano, Joaquín; Macgregor, Stuart A.; Carmona, Ernesto Base-Promoted, Remote C-H Activation at a Cationic (η<sup>5</sup>-C<sub>5</sub>Me<sub>5</sub>)Ir(III) Center Involving Reversible C-C Bond Formation of Bound C<sub>5</sub>Me<sub>5</sub>. Journal of the American Chemical Society, 2019, 141, 2205-2210 |
| 4128215 | CIF | C75 H71 B Cl2 F24 Ir P | P 1 21/c 1 | 12.4064; 26.1504; 22.9127 90; 99.377; 90 | 7334.3 | Moreno, Juan J.; Espada, María F; Campos, Jesús; López-Serrano, Joaquín; Macgregor, Stuart A.; Carmona, Ernesto Base-Promoted, Remote C-H Activation at a Cationic (η<sup>5</sup>-C<sub>5</sub>Me<sub>5</sub>)Ir(III) Center Involving Reversible C-C Bond Formation of Bound C<sub>5</sub>Me<sub>5</sub>. Journal of the American Chemical Society, 2019, 141, 2205-2210 |
| 4128216 | CIF | C27 H49 N5 O8 Si2 | P 1 21 1 | 10.558; 7.3823; 22.505 90; 100.12; 90 | 1726.8 | Ushimaru, Richiro; Liu, Hung-Wen Biosynthetic Origin of the Atypical Stereochemistry in the Thioheptose Core of Albomycin Nucleoside Antibiotics. Journal of the American Chemical Society, 2019, 141, 2211-2214 |
| 4128217 | CIF | C48 H54 O4 | P 32 | 14.7106; 14.7106; 14.6565 90; 90; 120 | 2746.77 | Pérez-Estrada, Salvador; Rodríguez-Molina, Braulio; Maverick, Emily F.; Khan, Saeed I.; Garcia-Garibay, Miguel A Throwing in a Monkey Wrench to Test and Determine Geared Motion in the Dynamics of a Crystalline One-Dimensional (1D) Columnar Rotor Array. Journal of the American Chemical Society, 2019, 141, 2413-2420 |
| 4128218 | CIF | C48 H53.6 F0.4 O4 | P 32 | 14.758; 14.758; 14.683 90; 90; 120 | 2769.5 | Pérez-Estrada, Salvador; Rodríguez-Molina, Braulio; Maverick, Emily F.; Khan, Saeed I.; Garcia-Garibay, Miguel A Throwing in a Monkey Wrench to Test and Determine Geared Motion in the Dynamics of a Crystalline One-Dimensional (1D) Columnar Rotor Array. Journal of the American Chemical Society, 2019, 141, 2413-2420 |
| 4128219 | CIF | C54 H94 N2 Si4 Ti4 | C 1 2/c 1 | 23.454; 11.71; 23.712 90; 110.676; 90 | 6093 | Shima, Takanori; Luo, Gen; Hu, Shaowei; Luo, Yi; Hou, Zhaomin Experimental and Computational Studies of Dinitrogen Activation and Hydrogenation at a Tetranuclear Titanium Imide/Hydride Framework. Journal of the American Chemical Society, 2019, 141, 2713-2720 |
| 4128220 | CIF | C54 H94 N4 Si4 Ti4 | C 1 2/c 1 | 24.388; 12.082; 21.574 90; 108.838; 90 | 6016.4 | Shima, Takanori; Luo, Gen; Hu, Shaowei; Luo, Yi; Hou, Zhaomin Experimental and Computational Studies of Dinitrogen Activation and Hydrogenation at a Tetranuclear Titanium Imide/Hydride Framework. Journal of the American Chemical Society, 2019, 141, 2713-2720 |
| 4128221 | CIF | C40 H66 N2 O2 Zr | P 43 | 17.2175; 17.2175; 41.838 90; 90; 90 | 12402.6 | Gao, Yanshan; Christianson, Matthew D.; Wang, Yang; Chen, Jiazhen; Marshall, Steve; Klosin, Jerzy; Lohr, Tracy L.; Marks, Tobin J. Unexpected Precatalyst σ-Ligand Effects in Phenoxyimine Zr-Catalyzed Ethylene/1-Octene Copolymerizations. Journal of the American Chemical Society, 2019, 141, 7822-7830 |
| 4128222 | CIF | C25 H48 N4 O Zr | P -1 | 9.5295; 12.293; 13.196 103.64; 98.59; 105.65 | 1408.6 | Gao, Yanshan; Christianson, Matthew D.; Wang, Yang; Chen, Jiazhen; Marshall, Steve; Klosin, Jerzy; Lohr, Tracy L.; Marks, Tobin J. Unexpected Precatalyst σ-Ligand Effects in Phenoxyimine Zr-Catalyzed Ethylene/1-Octene Copolymerizations. Journal of the American Chemical Society, 2019, 141, 7822-7830 |
| 4128223 | CIF | C23.5 H42 Al N O | C 1 2/c 1 | 20.2677; 12.6644; 19.577 90; 100.055; 90 | 4947.8 | Gao, Yanshan; Christianson, Matthew D.; Wang, Yang; Chen, Jiazhen; Marshall, Steve; Klosin, Jerzy; Lohr, Tracy L.; Marks, Tobin J. Unexpected Precatalyst σ-Ligand Effects in Phenoxyimine Zr-Catalyzed Ethylene/1-Octene Copolymerizations. Journal of the American Chemical Society, 2019, 141, 7822-7830 |
| 4128224 | CIF | C42 H72 N4 O2 Zr | C 1 2/c 1 | 22.969; 18.6514; 13.3922 90; 124.639; 90 | 4720.3 | Gao, Yanshan; Christianson, Matthew D.; Wang, Yang; Chen, Jiazhen; Marshall, Steve; Klosin, Jerzy; Lohr, Tracy L.; Marks, Tobin J. Unexpected Precatalyst σ-Ligand Effects in Phenoxyimine Zr-Catalyzed Ethylene/1-Octene Copolymerizations. Journal of the American Chemical Society, 2019, 141, 7822-7830 |
| 4128225 | CIF | C52 H76 Cl2 N2 O2 Zr | C 1 2/c 1 | 34.428; 7.6685; 20.142 90; 102.221; 90 | 5197.2 | Gao, Yanshan; Christianson, Matthew D.; Wang, Yang; Chen, Jiazhen; Marshall, Steve; Klosin, Jerzy; Lohr, Tracy L.; Marks, Tobin J. Unexpected Precatalyst σ-Ligand Effects in Phenoxyimine Zr-Catalyzed Ethylene/1-Octene Copolymerizations. Journal of the American Chemical Society, 2019, 141, 7822-7830 |
| 4128226 | CIF | C16 H18 N2 O3 | P 1 21 1 | 7.1091; 11.7371; 9.2881 90; 110.232; 90 | 727.18 | Zhou, Zhiyao; Gao, Alison X.; Snyder, Scott A. Total Synthesis of (+)-Arborisidine. Journal of the American Chemical Society, 2019, 141, 7715-7720 |
| 4128227 | CIF | C19 H20 N2 O2 | P 1 21/n 1 | 9.1101; 18.432; 18.462 90; 98.345; 90 | 3067.3 | Zhou, Zhiyao; Gao, Alison X.; Snyder, Scott A. Total Synthesis of (+)-Arborisidine. Journal of the American Chemical Society, 2019, 141, 7715-7720 |
| 4128228 | CIF | C21 H21 F3 N2 O3 | C 1 2/c 1 | 15.1133; 21.356; 12.8671 90; 115.83; 90 | 3738.1 | Zhou, Zhiyao; Gao, Alison X.; Snyder, Scott A. Total Synthesis of (+)-Arborisidine. Journal of the American Chemical Society, 2019, 141, 7715-7720 |
| 4128229 | CIF | C18 H20 N2 O | P 1 21 1 | 6.9349; 7.4039; 13.677 90; 91.735; 90 | 701.93 | Zhou, Zhiyao; Gao, Alison X.; Snyder, Scott A. Total Synthesis of (+)-Arborisidine. Journal of the American Chemical Society, 2019, 141, 7715-7720 |
| 4128230 | CIF | C24 H12 Fe3 N3 O16 | P 63/m m c | 12.9009; 12.9009; 18.2641 90; 90; 120 | 2632.5 | Wei, Yong-Sheng; Zhang, Mei; Kitta, Mitsunori; Liu, Zheng; Horike, Satoshi; Xu, Qiang A Single-Crystal Open-Capsule Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 7906-7916 |
| 4128231 | CIF | C44 H20 Fe3 N7 O13 | P 63/m m c | 16.8853; 16.8853; 14.8612 90; 90; 120 | 3669.46 | Wei, Yong-Sheng; Zhang, Mei; Kitta, Mitsunori; Liu, Zheng; Horike, Satoshi; Xu, Qiang A Single-Crystal Open-Capsule Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 7906-7916 |
| 4128232 | CIF | C144 H96 Cu24 O120 | F m -3 m | 26.274; 26.274; 26.274 90; 90; 90 | 18138 | Song, Dahae; Bae, Jinhee; Ji, Hoon; Kim, Min-Bum; Bae, Youn-Sang; Park, Kyo Sung; Moon, Dohyun; Jeong, Nak Cheon Coordinative Reduction of Metal Nodes Enhances the Hydrolytic Stability of a Paddlewheel Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 7853-7864 |
| 4128233 | CIF | C209.6 H146.4 Cu28 N32.8 O96 | F m -3 m | 26.303; 26.303; 26.303 90; 90; 90 | 18198 | Song, Dahae; Bae, Jinhee; Ji, Hoon; Kim, Min-Bum; Bae, Youn-Sang; Park, Kyo Sung; Moon, Dohyun; Jeong, Nak Cheon Coordinative Reduction of Metal Nodes Enhances the Hydrolytic Stability of a Paddlewheel Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 7853-7864 |
| 4128234 | CIF | C87 H75 Mo9 N3 O31 P4 | R -3 c :H | 25.075; 25.075; 57.2801 90; 90; 120 | 31190.1 | Li, Chifeng; Mizuno, Noritaka; Yamaguchi, Kazuya; Suzuki, Kosuke Self-Assembly of Anionic Polyoxometalate-Organic Architectures Based on Lacunary Phosphomolybdates and Pyridyl Ligands. Journal of the American Chemical Society, 2019, 141, 7687-7692 |
| 4128235 | CIF | C63 H15 Mo9 N6 O31 P | P n a 21 | 18.4306; 21.7192; 26.7317 90; 90; 90 | 10700.6 | Li, Chifeng; Mizuno, Noritaka; Yamaguchi, Kazuya; Suzuki, Kosuke Self-Assembly of Anionic Polyoxometalate-Organic Architectures Based on Lacunary Phosphomolybdates and Pyridyl Ligands. Journal of the American Chemical Society, 2019, 141, 7687-7692 |
| 4128236 | CIF | C94 H24 Mo18 N10 O62 P2 | P c c n | 34.5995; 21.4956; 27.1188 90; 90; 90 | 20169.3 | Li, Chifeng; Mizuno, Noritaka; Yamaguchi, Kazuya; Suzuki, Kosuke Self-Assembly of Anionic Polyoxometalate-Organic Architectures Based on Lacunary Phosphomolybdates and Pyridyl Ligands. Journal of the American Chemical Society, 2019, 141, 7687-7692 |
| 4128237 | CIF | C320 H261 Cl0 Mo36 N21 O125 P13 | C 1 2 1 | 38.3334; 33.8624; 42.0755 90; 101.282; 90 | 53561.2 | Li, Chifeng; Mizuno, Noritaka; Yamaguchi, Kazuya; Suzuki, Kosuke Self-Assembly of Anionic Polyoxometalate-Organic Architectures Based on Lacunary Phosphomolybdates and Pyridyl Ligands. Journal of the American Chemical Society, 2019, 141, 7687-7692 |
| 4128238 | CIF | C280 H218 Mo36 N20 O126 P11 | P 1 21/c 1 | 30.0613; 27.2811; 67.4589 90; 98.1644; 90 | 54762.7 | Li, Chifeng; Mizuno, Noritaka; Yamaguchi, Kazuya; Suzuki, Kosuke Self-Assembly of Anionic Polyoxometalate-Organic Architectures Based on Lacunary Phosphomolybdates and Pyridyl Ligands. Journal of the American Chemical Society, 2019, 141, 7687-7692 |
| 4128239 | CIF | C60 H43 F24 N15 Ni2 P4 | C 1 2/c 1 | 21.3407; 15.3842; 21.633 90; 113.749; 90 | 6500.9 | Ma, Xiaozhou; Suturina, Elizaveta A.; Rouzières, Mathieu; Platunov, Mikhail; Wilhelm, Fabrice; Rogalev, Andrei; Clérac, Rodolphe; Dechambenoit, Pierre Using Redox-Active π Bridging Ligand as a Control Switch of Intramolecular Magnetic Interactions. Journal of the American Chemical Society, 2019, 141, 7721-7725 |
| 4128240 | CIF | C62 H54 F18 N12 Ni2 O2 P3 | C 1 2/c 1 | 33.43; 12.9935; 16.4397 90; 114.415; 90 | 6502.4 | Ma, Xiaozhou; Suturina, Elizaveta A.; Rouzières, Mathieu; Platunov, Mikhail; Wilhelm, Fabrice; Rogalev, Andrei; Clérac, Rodolphe; Dechambenoit, Pierre Using Redox-Active π Bridging Ligand as a Control Switch of Intramolecular Magnetic Interactions. Journal of the American Chemical Society, 2019, 141, 7721-7725 |
| 4128241 | CIF | C58 H44 F12 N12 Ni2 O P2 | P 1 21/c 1 | 8.9028; 20.1557; 15.2276 90; 98.903; 90 | 2699.6 | Ma, Xiaozhou; Suturina, Elizaveta A.; Rouzières, Mathieu; Platunov, Mikhail; Wilhelm, Fabrice; Rogalev, Andrei; Clérac, Rodolphe; Dechambenoit, Pierre Using Redox-Active π Bridging Ligand as a Control Switch of Intramolecular Magnetic Interactions. Journal of the American Chemical Society, 2019, 141, 7721-7725 |
| 4128242 | CIF | C39 H16 B Cl F20 | P 1 2/c 1 | 22.2715; 7.77098; 21.1732 90; 108.487; 90 | 3475.37 | Nakajima, Misuzu; Miyamoto, Kazunori; Hirano, Keiichi; Uchiyama, Masanobu Diaryl-λ<sup>3</sup>-chloranes: Versatile Synthesis and Unique Reactivity as Aryl Cation Equivalent. Journal of the American Chemical Society, 2019, 141, 6499-6503 |
| 4128243 | CIF | C73 H12 | P -1 | 13.5363; 15.7638; 17.5101 75.265; 78.398; 86.169 | 3539.2 | Tian, Han-Rui; Chen, Miao-Miao; Wang, Kai; Chen, Zuo-Chang; Fu, Chao-Yong; Zhang, Qianyan; Li, Shu-Hui; Deng, Shun-Liu; Yao, Yang-Rong; Xie, Su-Yuan; Huang, Rong-Bin; Zheng, Lan-Sun An Unconventional Hydrofullerene C<sub>66</sub>H<sub>4</sub> with Symmetric Heptagons Retrieved in Low-Pressure Combustion. Journal of the American Chemical Society, 2019, 141, 6651-6657 |
| 4128244 | CIF | C22 H19 F3 N2 | P 21 21 21 | 10.5145; 12.1928; 29.5112 90; 90; 90 | 3783.37 | Kwon, Yongseok; Li, Junqi; Reid, Jolene P.; Crawford, Jennifer M.; Jacob, Roxane; Sigman, Matthew S.; Toste, F. Dean; Miller, Scott J. Disparate Catalytic Scaffolds for Atroposelective Cyclodehydration. Journal of the American Chemical Society, 2019, 141, 6698-6705 |
| 4128245 | CIF | C50 H42 F24 N14 P4 | P -1 | 11.3484; 13.5641; 16.0193 93.97; 107.494; 110.87 | 2154.1 | Chi, Xiaodong; Cen, Wanglai; Queenan, Jack A.; Long, Lingliang; Lynch, Vincent M.; Khashab, Niveen M.; Sessler, Jonathan L. Azobenzene-Bridged Expanded "Texas-sized" Box: A Dual-Responsive Receptor for Aryl Dianion Encapsulation. Journal of the American Chemical Society, 2019, 141, 6468-6472 |
| 4128246 | CIF | C44 H51 F3 Fe N8 O4 S | P 1 21/c 1 | 13.4584; 13.8392; 22.8632 90; 97.809; 90 | 4218.9 | Drummond, Michael J.; Ford, Courtney L.; Gray, Danielle L.; Popescu, Codrina V.; Fout, Alison R. Radical Rebound Hydroxylation Versus H-Atom Transfer in Non-Heme Iron(III)-Hydroxo Complexes: Reactivity and Structural Differentiation. Journal of the American Chemical Society, 2019, 141, 6639-6650 |
| 4128247 | CIF | C45 H50 F6 Fe N8 O6 S2 | P b c a | 18.2527; 21.281; 24.4192 90; 90; 90 | 9485.3 | Drummond, Michael J.; Ford, Courtney L.; Gray, Danielle L.; Popescu, Codrina V.; Fout, Alison R. Radical Rebound Hydroxylation Versus H-Atom Transfer in Non-Heme Iron(III)-Hydroxo Complexes: Reactivity and Structural Differentiation. Journal of the American Chemical Society, 2019, 141, 6639-6650 |
| 4128248 | CIF | C42 H46.96 Cl0.04 F3 Fe N7 O3.96 S | P 1 21/c 1 | 12.6444; 15.572; 20.5734 90; 97.7; 90 | 4014.3 | Drummond, Michael J.; Ford, Courtney L.; Gray, Danielle L.; Popescu, Codrina V.; Fout, Alison R. Radical Rebound Hydroxylation Versus H-Atom Transfer in Non-Heme Iron(III)-Hydroxo Complexes: Reactivity and Structural Differentiation. Journal of the American Chemical Society, 2019, 141, 6639-6650 |
| 4128249 | CIF | C43 H48 F6 Fe N7 O7 S2 | P m n 21 | 13.5964; 9.6432; 17.6757 90; 90; 90 | 2317.5 | Drummond, Michael J.; Ford, Courtney L.; Gray, Danielle L.; Popescu, Codrina V.; Fout, Alison R. Radical Rebound Hydroxylation Versus H-Atom Transfer in Non-Heme Iron(III)-Hydroxo Complexes: Reactivity and Structural Differentiation. Journal of the American Chemical Society, 2019, 141, 6639-6650 |
| 4128250 | CIF | C42 H49 Cl2 Fe N7 O | C 1 2/m 1 | 24.1058; 14.1272; 13.1675 90; 107.411; 90 | 4278.7 | Drummond, Michael J.; Ford, Courtney L.; Gray, Danielle L.; Popescu, Codrina V.; Fout, Alison R. Radical Rebound Hydroxylation Versus H-Atom Transfer in Non-Heme Iron(III)-Hydroxo Complexes: Reactivity and Structural Differentiation. Journal of the American Chemical Society, 2019, 141, 6639-6650 |
| 4128251 | CIF | C54 H58 F N O19 S | P 61 | 21.1703; 21.1703; 22.7806 90; 90; 120 | 8842 | Lo, Hong-Jay; Krasnova, Larissa; Dey, Supriya; Cheng, Ting; Liu, Haitian; Tsai, Tsung-I; Wu, Kevin Binchia; Wu, Chung-Yi; Wong, Chi-Huey Synthesis of Sialidase-Resistant Oligosaccharide and Antibody Glycoform Containing α2,6-Linked 3F<sup>ax</sup>-Neu5Ac. Journal of the American Chemical Society, 2019, 141, 6484-6488 |
| 4128252 | CIF | C144 H184 F12 N4 O16 P8 Pt4 S4 | P 1 21/n 1 | 14.276; 43.86; 26.515 90; 101.185; 90 | 16287 | Shi, Bingbing; Liu, Yuezhou; Zhu, Huangtianzhi; Vanderlinden, Ryan T.; Shangguan, Liqing; Ni, Ruidong; Acharyya, Koushik; Tang, Jian-Hong; Zhou, Zhixuan; Li, Xiaopeng; Huang, Feihe; Stang, Peter J. Spontaneous Formation of a Cross-Linked Supramolecular Polymer Both in the Solid State and in Solution, Driven by Platinum(II) Metallacycle-Based Host-Guest Interactions. Journal of the American Chemical Society, 2019, 141, 6494-6498 |
| 4128253 | CIF | C36 H37 F12 N7 O2 P2 Ru | P 1 21/c 1 | 8.8554; 8.816; 50.7233 90; 92.385; 90 | 3956.5 | Gonell, Sergio; Massey, Marsha D.; Moseley, Ian P.; Schauer, Cynthia K.; Muckerman, James T.; Miller, Alexander J. M. The Trans Effect in Electrocatalytic CO<sub>2</sub> Reduction: Mechanistic Studies of Asymmetric Ruthenium Pyridyl-Carbene Catalysts. Journal of the American Chemical Society, 2019, 141, 6658-6671 |
| 4128254 | CIF | C32 H28 F12 N6 O2 P2 Ru | P 1 21/n 1 | 13.637; 17.224; 16.2229 90; 109.735; 90 | 3586.7 | Gonell, Sergio; Massey, Marsha D.; Moseley, Ian P.; Schauer, Cynthia K.; Muckerman, James T.; Miller, Alexander J. M. The Trans Effect in Electrocatalytic CO<sub>2</sub> Reduction: Mechanistic Studies of Asymmetric Ruthenium Pyridyl-Carbene Catalysts. Journal of the American Chemical Society, 2019, 141, 6658-6671 |
| 4128255 | CIF | C36.08 H19 F6 N6 O10 Ru S2 | P 1 21/c 1 | 14.0654; 18.8075; 15.5986 90; 114.047; 90 | 3768.3 | Gonell, Sergio; Massey, Marsha D.; Moseley, Ian P.; Schauer, Cynthia K.; Muckerman, James T.; Miller, Alexander J. M. The Trans Effect in Electrocatalytic CO<sub>2</sub> Reduction: Mechanistic Studies of Asymmetric Ruthenium Pyridyl-Carbene Catalysts. Journal of the American Chemical Society, 2019, 141, 6658-6671 |
| 4128256 | CIF | C26 H30 O3 | P 1 21/c 1 | 13.8835; 13.7039; 11.1974 90; 96.2374; 90 | 2117.78 | Zhu, Yuxiang; Colomer, Ignacio; Thompson, Amber L.; Donohoe, Timothy J. HFIP Solvent Enables Alcohols To Act as Alkylating Agents in Stereoselective Heterocyclization. Journal of the American Chemical Society, 2019, 141, 6489-6493 |
| 4128257 | CIF | C33 H29 I O3 | P 1 21/c 1 | 26.112; 7.1996; 29.268 90; 94.2377; 90 | 5487.22 | Zhu, Yuxiang; Colomer, Ignacio; Thompson, Amber L.; Donohoe, Timothy J. HFIP Solvent Enables Alcohols To Act as Alkylating Agents in Stereoselective Heterocyclization. Journal of the American Chemical Society, 2019, 141, 6489-6493 |
| 4128258 | CIF | C22 H23 Br F6 Mn N4 O3 P | P -1 | 7.1504; 13.4353; 27.972 80.848; 87.913; 83.603 | 2636 | Sung, Siyoung; Li, Xiaohui; Wolf, Lucienna M.; Meeder, Jeremy R.; Bhuvanesh, Nattamai S.; Grice, Kyle A.; Panetier, Julien A.; Nippe, Michael Synergistic Effects of Imidazolium-Functionalization on fac-Mn(CO)<sub>3</sub> Bipyridine Catalyst Platforms for Electrocatalytic Carbon Dioxide Reduction. Journal of the American Chemical Society, 2019, 141, 6569-6582 |
| 4128259 | CIF | C19 H17 Br F6 Mn N4 O3 P | P 1 21/c 1 | 7.7267; 29.1116; 10.7432 90; 107.91; 90 | 2299.44 | Sung, Siyoung; Li, Xiaohui; Wolf, Lucienna M.; Meeder, Jeremy R.; Bhuvanesh, Nattamai S.; Grice, Kyle A.; Panetier, Julien A.; Nippe, Michael Synergistic Effects of Imidazolium-Functionalization on fac-Mn(CO)<sub>3</sub> Bipyridine Catalyst Platforms for Electrocatalytic Carbon Dioxide Reduction. Journal of the American Chemical Society, 2019, 141, 6569-6582 |
| 4128260 | CIF | C22 H23 Br F6 Mn N4 O3 P | P 21 21 21 | 7.937; 12.188; 26.58 90; 90; 90 | 2571.2 | Sung, Siyoung; Li, Xiaohui; Wolf, Lucienna M.; Meeder, Jeremy R.; Bhuvanesh, Nattamai S.; Grice, Kyle A.; Panetier, Julien A.; Nippe, Michael Synergistic Effects of Imidazolium-Functionalization on fac-Mn(CO)<sub>3</sub> Bipyridine Catalyst Platforms for Electrocatalytic Carbon Dioxide Reduction. Journal of the American Chemical Society, 2019, 141, 6569-6582 |
| 4128261 | CIF | C168 H204 N6 O18 | P -1 | 20.7339; 22.5701; 22.5707 61.056; 68.264; 88.742 | 8423.6 | Nakamura, Takashi; Tsukuda, Shinnosuke; Nabeshima, Tatsuya Double-Circularly Connected Saloph-Belt Macrocycles Generated from a Bis-Armed Bifunctional Monomer. Journal of the American Chemical Society, 2019, 141, 6462-6467 |
| 4128262 | CIF | C294.62 H305.46 N8 Na0.38 O34.62 Zn4 | P -1 | 17.213; 18.121; 20.788 80.167; 71.677; 85.782 | 6064 | Nakamura, Takashi; Tsukuda, Shinnosuke; Nabeshima, Tatsuya Double-Circularly Connected Saloph-Belt Macrocycles Generated from a Bis-Armed Bifunctional Monomer. Journal of the American Chemical Society, 2019, 141, 6462-6467 |
| 4128263 | CIF | C37 H24 | P 1 21/c 1 | 12.2686; 12.0157; 17.27 90; 95.498; 90 | 2534.2 | Zhou, Zhibiao; Xie, Sheng; Chen, Xian; Tu, Yujie; Xiang, Jiannan; Wang, Jianguo; He, Zikai; Zeng, Zebing; Tang, Ben Zhong Spiro-Functionalized Diphenylethenes: Suppression of a Reversible Photocyclization Contributes to the Aggregation-Induced Emission Effect. Journal of the American Chemical Society, 2019, 141, 9803-9807 |
| 4128264 | CIF | C37 H24 | P 1 21/c 1 | 9.9961; 11.5411; 22.484 90; 101.4; 90 | 2542.7 | Zhou, Zhibiao; Xie, Sheng; Chen, Xian; Tu, Yujie; Xiang, Jiannan; Wang, Jianguo; He, Zikai; Zeng, Zebing; Tang, Ben Zhong Spiro-Functionalized Diphenylethenes: Suppression of a Reversible Photocyclization Contributes to the Aggregation-Induced Emission Effect. Journal of the American Chemical Society, 2019, 141, 9803-9807 |
| 4128265 | CIF | C33 H22 | P 1 21/c 1 | 12.3418; 9.6112; 19.6749 90; 106.691; 90 | 2235.5 | Zhou, Zhibiao; Xie, Sheng; Chen, Xian; Tu, Yujie; Xiang, Jiannan; Wang, Jianguo; He, Zikai; Zeng, Zebing; Tang, Ben Zhong Spiro-Functionalized Diphenylethenes: Suppression of a Reversible Photocyclization Contributes to the Aggregation-Induced Emission Effect. Journal of the American Chemical Society, 2019, 141, 9803-9807 |
| 4128266 | CIF | C50 H52 Cl4 N4 O2 Ru | P 1 21/c 1 | 9.9196; 21.8678; 21.5084 90; 100.817; 90 | 4582.7 | Song, Jung-Ah; Park, Bohyun; Kim, Soohyung; Kang, Cheol; Lee, Dongwhan; Baik, Mu-Hyun; Grubbs, Robert H.; Choi, Tae-Lim Living Polymerization Caught in the Act: Direct Observation of an Arrested Intermediate in Metathesis Polymerization. Journal of the American Chemical Society, 2019, 141, 10039-10047 |
| 4128267 | CIF | C64 H60 Br2 Cl2 N4 O4 Ru | P -1 | 13.7156; 15.0052; 17.1877 85.65; 78.025; 63.955 | 3108.47 | Song, Jung-Ah; Park, Bohyun; Kim, Soohyung; Kang, Cheol; Lee, Dongwhan; Baik, Mu-Hyun; Grubbs, Robert H.; Choi, Tae-Lim Living Polymerization Caught in the Act: Direct Observation of an Arrested Intermediate in Metathesis Polymerization. Journal of the American Chemical Society, 2019, 141, 10039-10047 |
| 4128268 | CIF | C20 H44 Br4 N2 Pb | C 1 2/c 1 | 20.364; 8.4235; 18.8888 90; 123.796; 90 | 2692.6 | Morad, Viktoriia; Shynkarenko, Yevhen; Yakunin, Sergii; Brumberg, Alexandra; Schaller, Richard D.; Kovalenko, Maksym V. Disphenoidal Zero-Dimensional Lead, Tin, and Germanium Halides: Highly Emissive Singlet and Triplet Self-Trapped Excitons and X-ray Scintillation. Journal of the American Chemical Society, 2019, 141, 9764-9768 |
| 4128269 | CIF | C20 H44 Br4 Ge N2 | C 1 2/c 1 | 20.0807; 8.4248; 18.3778 90; 121.862; 90 | 2640.61 | Morad, Viktoriia; Shynkarenko, Yevhen; Yakunin, Sergii; Brumberg, Alexandra; Schaller, Richard D.; Kovalenko, Maksym V. Disphenoidal Zero-Dimensional Lead, Tin, and Germanium Halides: Highly Emissive Singlet and Triplet Self-Trapped Excitons and X-ray Scintillation. Journal of the American Chemical Society, 2019, 141, 9764-9768 |
| 4128270 | CIF | C20 H44 Br4 N2 Sn | C 1 2/c 1 | 20.122; 8.4218; 18.801 90; 123.374; 90 | 2660.7 | Morad, Viktoriia; Shynkarenko, Yevhen; Yakunin, Sergii; Brumberg, Alexandra; Schaller, Richard D.; Kovalenko, Maksym V. Disphenoidal Zero-Dimensional Lead, Tin, and Germanium Halides: Highly Emissive Singlet and Triplet Self-Trapped Excitons and X-ray Scintillation. Journal of the American Chemical Society, 2019, 141, 9764-9768 |
| 4128271 | CIF | C19 H28 O S | P 21 21 21 | 9.7647; 10.1799; 18.091 90; 90; 90 | 1798.3 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
| 4128272 | CIF | C12 H14 O2 | P b c n | 25.4036; 8.6525; 9.0953 90; 90; 90 | 1999.19 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
| 4128273 | CIF Paper | C9 H8 O2 | P 1 21/n 1 | 7.3457; 13.3767; 7.3693 90; 108.584; 90 | 686.36 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
| 4128274 | CIF | C9 H8 O S | P -1 | 7.705; 8.751; 13.141 88.382; 84.595; 64.17 | 793.9 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
| 4128275 | CIF | C10 H10 O2 | P b c a | 8.5386; 10.4949; 18.8536 90; 90; 90 | 1689.5 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
| 4128276 | CIF | C14 H16 F5 N O | P 1 21 1 | 8.7849; 5.4108; 14.8752 90; 98.627; 90 | 699.07 | Zhang, Juner; Huang, Xiongyi; Zhang, Ruijie K.; Arnold, Frances H. Enantiodivergent α-Amino C-H Fluoroalkylation Catalyzed by Engineered Cytochrome P450s. Journal of the American Chemical Society, 2019, 141, 9798-9802 |
| 4128277 | CIF | C12 H14 F3 N | P 1 21 1 | 8.3312; 17.574; 8.379 90; 116.975; 90 | 1093.3 | Zhang, Juner; Huang, Xiongyi; Zhang, Ruijie K.; Arnold, Frances H. Enantiodivergent α-Amino C-H Fluoroalkylation Catalyzed by Engineered Cytochrome P450s. Journal of the American Chemical Society, 2019, 141, 9798-9802 |
| 4128278 | CIF | C48 H108 K O16 Si4 Tb | P -1 | 12.94476; 20.0897; 26.0868 91.2399; 94.7326; 91.1183 | 6757.78 | Palumbo, Chad T.; Zivkovic, Ivica; Scopelliti, Rosario; Mazzanti, Marinella Molecular Complex of Tb in the +4 Oxidation State. Journal of the American Chemical Society, 2019, 141, 9827-9831 |
| 4128279 | CIF | C48 H108 O16 Si4 Tb | C 1 2/c 1 | 24.0696; 13.4628; 40.7459 90; 96.4478; 90 | 13120 | Palumbo, Chad T.; Zivkovic, Ivica; Scopelliti, Rosario; Mazzanti, Marinella Molecular Complex of Tb in the +4 Oxidation State. Journal of the American Chemical Society, 2019, 141, 9827-9831 |
| 4128280 | CIF | C32 H42 N2 | P 1 21/c 1 | 17.9751; 15.1881; 9.872 90; 97.535; 90 | 2671.86 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128281 | CIF | C32 H42 N P | P 1 21/n 1 | 10.4959; 14.0915; 18.7602 90; 102.806; 90 | 2705.67 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128282 | CIF | C28 H43 N O2 | P 1 21/n 1 | 9.595; 18.456; 13.848 90; 101.346; 90 | 2404 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128283 | CIF | C51 H65 N3 | P 21 21 21 | 9.3291; 18.9635; 23.1474 90; 90; 90 | 4095.1 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128284 | CIF | C27 H43 N S | P 1 21 1 | 9.6679; 18.7513; 13.8244 90; 102.399; 90 | 2447.71 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128285 | CIF | C39 H54 N P | P 21 21 21 | 18.3658; 18.8888; 19.5947 90; 90; 90 | 6797.6 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128286 | CIF | C73 H120 N4 | P 1 | 9.4457; 9.7034; 18.412 79.515; 87.442; 85.632 | 1653.7 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128287 | CIF | C34 H48 N2 O | P 1 21 1 | 10.6372; 16.6939; 16.7043 90; 91.822; 90 | 2964.8 | Tolentino, Daniel R.; Neale, Samuel E.; Isaac, Connie J.; Macgregor, Stuart A.; Whittlesey, Michael K.; Jazzar, Rodolphe; Bertrand, Guy Reductive Elimination at Carbon under Steric Control. Journal of the American Chemical Society, 2019, 141, 9823-9826 |
| 4128288 | CIF | C19 H21 N | P 1 21/c 1 | 12.887; 6.012; 18.99 90; 94.389; 90 | 1467 | Asako, Sobi; Ishihara, Seina; Hirata, Keiya; Takai, Kazuhiko Deoxygenative Insertion of Carbonyl Carbon into a C(sp<sup>3</sup>)-H Bond: Synthesis of Indolines and Indoles. Journal of the American Chemical Society, 2019, 141, 9832-9836 |
| 4128289 | CIF | C64 H96 Br0.69 Cl0.31 Fe Mg O8 | P -1 | 11.944; 13.0469; 21.0494 72.339; 80.743; 74.699 | 3003.11 | Neate, Peter G. N.; Greenhalgh, Mark D.; Brennessel, William W.; Thomas, Stephen P.; Neidig, Michael L. Mechanism of the Bis(imino)pyridine-Iron-Catalyzed Hydromagnesiation of Styrene Derivatives. Journal of the American Chemical Society, 2019, 141, 10099-10108 |
| 4128290 | CIF | C67 H112 Br0.67 Cl0.33 Fe Mg N3 O7.5 | P 1 21/n 1 | 11.4045; 22.533; 26.176 90; 99.122; 90 | 6641.6 | Neate, Peter G. N.; Greenhalgh, Mark D.; Brennessel, William W.; Thomas, Stephen P.; Neidig, Michael L. Mechanism of the Bis(imino)pyridine-Iron-Catalyzed Hydromagnesiation of Styrene Derivatives. Journal of the American Chemical Society, 2019, 141, 10099-10108 |
| 4128291 | CIF | C61 H92 Br0.6 Cl0.4 Fe Mg N5 O5 | P c a 21 | 22.6754; 12.315; 24.0776 90; 90; 90 | 6723.6 | Neate, Peter G. N.; Greenhalgh, Mark D.; Brennessel, William W.; Thomas, Stephen P.; Neidig, Michael L. Mechanism of the Bis(imino)pyridine-Iron-Catalyzed Hydromagnesiation of Styrene Derivatives. Journal of the American Chemical Society, 2019, 141, 10099-10108 |
| 4128292 | CIF | C41 H38 O9 | P -1 | 13.151; 13.717; 13.813 69.601; 62.568; 82.672 | 2071.3 | Timmerman, Jacob C.; Sims, Noah J.; Wood, John L. Total Synthesis of Caesalpinnone A and Caesalpinflavan B: Evolution of a Concise Strategy. Journal of the American Chemical Society, 2019, 141, 10082-10090 |
| 4128293 | CIF | C41 H38 O7 | P -1 | 11.2663; 12.5159; 12.5665 96.867; 105.428; 104.245 | 1622.81 | Timmerman, Jacob C.; Sims, Noah J.; Wood, John L. Total Synthesis of Caesalpinnone A and Caesalpinflavan B: Evolution of a Concise Strategy. Journal of the American Chemical Society, 2019, 141, 10082-10090 |
| 4128294 | CIF | C21 H18 N4 O | P -1 | 7.0423; 10.4389; 12.1272 76.1046; 88.391; 77.957 | 846.15 | Xing, Pengyao; Li, Yongxin; Xue, Shixin; Fiona Phua, Soo Zeng; Ding, Chendi; Chen, Hongzhong; Zhao, Yanli Occurrence of Chiral Nanostructures Induced by Multiple Hydrogen Bonds. Journal of the American Chemical Society, 2019, 141, 9946-9954 |
| 4128295 | CIF | C21 H18 N6 | P -1 | 11.7863; 24.768; 28.259 112.963; 96.27; 103.206 | 7211.6 | Xing, Pengyao; Li, Yongxin; Xue, Shixin; Fiona Phua, Soo Zeng; Ding, Chendi; Chen, Hongzhong; Zhao, Yanli Occurrence of Chiral Nanostructures Induced by Multiple Hydrogen Bonds. Journal of the American Chemical Society, 2019, 141, 9946-9954 |
| 4128296 | CIF | C23 H23 N O5 | P 21 21 21 | 4.8537; 7.4768; 50.879 90; 90; 90 | 1846.4 | Xing, Pengyao; Li, Yongxin; Xue, Shixin; Fiona Phua, Soo Zeng; Ding, Chendi; Chen, Hongzhong; Zhao, Yanli Occurrence of Chiral Nanostructures Induced by Multiple Hydrogen Bonds. Journal of the American Chemical Society, 2019, 141, 9946-9954 |
| 4128297 | CIF | C20 H16 F6 N2 O7 | P -1 | 4.766; 9.398; 12.71 104.348; 97.123; 91.867 | 546.1 | Belligund, Kavita; Mathew, Thomas; Hunt, Jonathan R.; Nirmalchandar, Archith; Haiges, Ralf; Dawlaty, Jahan; Prakash, G. K. Surya Photochemistry of 2-Nitroarenes: 2-Nitrophenyl-α-trifluoromethyl Carbinols as Synthons for Fluoroorganics. Journal of the American Chemical Society, 2019, 141, 15921-15931 |
| 4128298 | CIF | C24 H12 F6 N2 O3 | P -1 | 7.9032; 8.8144; 14.88 93.28; 95.688; 90.365 | 1029.7 | Belligund, Kavita; Mathew, Thomas; Hunt, Jonathan R.; Nirmalchandar, Archith; Haiges, Ralf; Dawlaty, Jahan; Prakash, G. K. Surya Photochemistry of 2-Nitroarenes: 2-Nitrophenyl-α-trifluoromethyl Carbinols as Synthons for Fluoroorganics. Journal of the American Chemical Society, 2019, 141, 15921-15931 |
| 4128299 | CIF | C16 H8 F6 N2 O3 | P b c a | 16.3899; 8.4422; 21.6823 90; 90; 90 | 3000.1 | Belligund, Kavita; Mathew, Thomas; Hunt, Jonathan R.; Nirmalchandar, Archith; Haiges, Ralf; Dawlaty, Jahan; Prakash, G. K. Surya Photochemistry of 2-Nitroarenes: 2-Nitrophenyl-α-trifluoromethyl Carbinols as Synthons for Fluoroorganics. Journal of the American Chemical Society, 2019, 141, 15921-15931 |
| 4128300 | CIF | C12 H17 Br F3 N O5 S2 | P -1 | 9.414; 9.426; 11.441 112.364; 98.218; 101.891 | 890.8 | Belligund, Kavita; Mathew, Thomas; Hunt, Jonathan R.; Nirmalchandar, Archith; Haiges, Ralf; Dawlaty, Jahan; Prakash, G. K. Surya Photochemistry of 2-Nitroarenes: 2-Nitrophenyl-α-trifluoromethyl Carbinols as Synthons for Fluoroorganics. Journal of the American Chemical Society, 2019, 141, 15921-15931 |
| 4128301 | CIF | C8 H4 F3 N O3 | P 1 21/c 1 | 6.4041; 16.548; 8.082 90; 105.719; 90 | 824.5 | Belligund, Kavita; Mathew, Thomas; Hunt, Jonathan R.; Nirmalchandar, Archith; Haiges, Ralf; Dawlaty, Jahan; Prakash, G. K. Surya Photochemistry of 2-Nitroarenes: 2-Nitrophenyl-α-trifluoromethyl Carbinols as Synthons for Fluoroorganics. Journal of the American Chemical Society, 2019, 141, 15921-15931 |
| 4128302 | CIF | C22 H30.75 N2 O8.38 | P 1 21 1 | 13.2836; 9.513; 17.387 90; 90.057; 90 | 2197.1 | Thesmar, Pierre; Baudoin, Olivier Efficient and Divergent Total Synthesis of (-)-Epicoccin G and (-)-Rostratin A Enabled by Double C(sp<sup>3</sup>)-H Activation. Journal of the American Chemical Society, 2019, 141, 15779-15783 |
| 4128303 | CIF | C22 H27 N2 O8.5 | P 32 2 1 | 9.883; 9.883; 36.809 90; 90; 120 | 3113.6 | Thesmar, Pierre; Baudoin, Olivier Efficient and Divergent Total Synthesis of (-)-Epicoccin G and (-)-Rostratin A Enabled by Double C(sp<sup>3</sup>)-H Activation. Journal of the American Chemical Society, 2019, 141, 15779-15783 |
| 4128304 | CIF | C22 H26 N2 O6 | P 1 | 9.48; 9.5062; 13.0768 79.7133; 87.5882; 60.4663 | 1007.41 | Thesmar, Pierre; Baudoin, Olivier Efficient and Divergent Total Synthesis of (-)-Epicoccin G and (-)-Rostratin A Enabled by Double C(sp<sup>3</sup>)-H Activation. Journal of the American Chemical Society, 2019, 141, 15779-15783 |
| 4128305 | CIF | C30 H31 Cl4 N Ru | P 21 21 21 | 7.8236; 14.7618; 24.4735 90; 90; 90 | 2826.45 | Li, Zhong-Yuan; Lakmal, Hetti Handi Chaminda; Qian, Xiaolin; Zhu, Zhenyu; Donnadieu, Bruno; McClain, Sarah J.; Xu, Xue; Cui, Xin Ruthenium-Catalyzed Enantioselective C-H Functionalization: A Practical Access to Optically Active Indoline Derivatives. Journal of the American Chemical Society, 2019, 141, 15730-15736 |
| 4128306 | CIF | C23 H21 N O3 S | P 1 21 1 | 5.5476; 8.4528; 21.0022 90; 97.001; 90 | 977.51 | Li, Zhong-Yuan; Lakmal, Hetti Handi Chaminda; Qian, Xiaolin; Zhu, Zhenyu; Donnadieu, Bruno; McClain, Sarah J.; Xu, Xue; Cui, Xin Ruthenium-Catalyzed Enantioselective C-H Functionalization: A Practical Access to Optically Active Indoline Derivatives. Journal of the American Chemical Society, 2019, 141, 15730-15736 |
| 4128307 | CIF | C79.5 H54 B Cl F24 O P2 Pd | P -1 | 14.6401; 17.2051; 17.93 115.267; 96.9948; 103.786 | 3836 | Wierschen, Andreas L.; Romano, Neyen; Lee, Stephen J.; Gagné, Michel R Silylpalladium Cations Enable the Oxidative Addition of C(sp<sup>3</sup>)-O Bonds. Journal of the American Chemical Society, 2019, 141, 16024-16032 |
| 4128308 | CIF | C24 H25 N O7 | P 43 | 7.0841; 7.0841; 41.0624 90; 90; 90 | 2060.69 | Trost, Barry M.; Hung, Chao-I Joey; Jiao, Zhiwei Enantioselective Divergent Syntheses of (+)-Bulleyanaline and Related Isoquinoline Alkaloids from the Genus <i>Corydalis</i>. Journal of the American Chemical Society, 2019, 141, 16085-16092 |
| 4128309 | CIF | C23 H26 B N O2 | P 1 21/n 1 | 6.1967; 22.128; 14.697 90; 94.665; 90 | 2008.59 | Vidal, Fernando; Gomezcoello, John; Lalancette, Roger A.; Jäkle, Frieder Lewis Pairs as Highly Tunable Dynamic Cross-Links in Transient Polymer Networks. Journal of the American Chemical Society, 2019, 141, 15963-15971 |
| 4128310 | CIF | C21 H25 B N2 O2 | P 1 21 1 | 11.9238; 13.673; 12.7983 90; 112.838; 90 | 1922.99 | Vidal, Fernando; Gomezcoello, John; Lalancette, Roger A.; Jäkle, Frieder Lewis Pairs as Highly Tunable Dynamic Cross-Links in Transient Polymer Networks. Journal of the American Chemical Society, 2019, 141, 15963-15971 |
| 4128311 | CIF | C32 H23 Cl2 Co N4 O12 | P -1 | 14.226; 14.478; 15.346 117.356; 99.68; 104.803 | 2559.6 | Roy, Souvik; Huang, Zhehao; Bhunia, Asamanjoy; Castner, Ashleigh; Gupta, Arvind K.; Zou, Xiaodong; Ott, Sascha Electrocatalytic Hydrogen Evolution from a Cobaloxime-Based Metal-Organic Framework Thin Film. Journal of the American Chemical Society, 2019, 141, 15942-15950 |
| 4128312 | CIF | C21 H32 O4 | P 1 21 1 | 9.1839; 10.4178; 19.8431 90; 99.184; 90 | 1874.17 | Min, Long; Lin, Xiaohong; Li, Chuang-Chuang Asymmetric Total Synthesis of (-)-Vinigrol. Journal of the American Chemical Society, 2019, 141, 15773-15778 |
| 4128313 | CIF | C20 H28 O2 | P 21 21 21 | 9.1575; 9.248; 19.2789 90; 90; 90 | 1632.7 | Min, Long; Lin, Xiaohong; Li, Chuang-Chuang Asymmetric Total Synthesis of (-)-Vinigrol. Journal of the American Chemical Society, 2019, 141, 15773-15778 |
| 4128314 | CIF | C12 H32 I8 N4 Pb2 | P 1 c 1 | 10.5315; 12.5444; 12.5572 90; 89.99; 90 | 1658.95 | Park, In-Hyeok; Zhang, Qiannan; Kwon, Ki Chang; Zhu, Ziyu; Yu, Wei; Leng, Kai; Giovanni, David; Choi, Hwa Seob; Abdelwahab, Ibrahim; Xu, Qing-Hua; Sum, Tze Chien; Loh, Kian Ping Ferroelectricity and Rashba Effect in a Two-Dimensional Dion-Jacobson Hybrid Organic-Inorganic Perovskite. Journal of the American Chemical Society, 2019, 141, 15972-15976 |
| 4128315 | CIF | C6 H16 I4 N2 Pb | P 1 21/c 1 | 10.6173; 12.54; 12.53 90; 89.983; 90 | 1668.3 | Park, In-Hyeok; Zhang, Qiannan; Kwon, Ki Chang; Zhu, Ziyu; Yu, Wei; Leng, Kai; Giovanni, David; Choi, Hwa Seob; Abdelwahab, Ibrahim; Xu, Qing-Hua; Sum, Tze Chien; Loh, Kian Ping Ferroelectricity and Rashba Effect in a Two-Dimensional Dion-Jacobson Hybrid Organic-Inorganic Perovskite. Journal of the American Chemical Society, 2019, 141, 15972-15976 |
| 4128316 | CIF | C29 H33 N2 O5 Zn | P -1 | 8.5379; 11.6565; 14.3665 76.954; 78.816; 83.43 | 1362.69 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128317 | CIF | C42 H46 N4 O7 Zn | P 1 21/n 1 | 9.8343; 20.384; 19.3857 90; 96.479; 90 | 3861.3 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128318 | CIF | C27.41 H19.41 N O4 Zn | P -1 | 9.803; 9.8836; 11.8009 88.301; 86.59; 80.201 | 1124.48 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128319 | CIF | C27 H19 N O4 Zn | P -1 | 15.0725; 15.7354; 20.5142 78.984; 88.169; 80.392 | 4708.7 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128320 | CIF | C30 H26 N2 O5 Zn | P -1 | 9.0865; 11.1662; 13.4069 77.455; 83.372; 83.133 | 1312.66 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128321 | CIF | C31 H31 N2 O5 Zn | P -1 | 8.4884; 11.785; 14.7536 76.227; 76.572; 83.831 | 1392.14 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128322 | CIF | C30 H28 N2 O5 Zn | P -1 | 8.8203; 11.0081; 14.1769 78.272; 79.655; 80.661 | 1314.51 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128323 | CIF | C32 H30 N2 O5 Zn | P -1 | 9.038; 12.0885; 14.9988 67.39; 72.49; 89.005 | 1433.64 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128324 | CIF | C32 H36 N2 O5 Zn | P -1 | 8.5536; 12.1855; 15.0843 67.442; 74.816; 87.306 | 1398.7 | Kusaka, Shinpei; Kiyose, Atsushi; Sato, Hiroshi; Hijikata, Yuh; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 15742-15746 |
| 4128325 | CIF | C40 H48 Br4 K2 Mn O12 | C 1 c 1 | 9.5199; 35.864; 27.0516 90; 90.65; 90 | 9235.4 | Zhao, Jian; Zhang, Tongjin; Dong, Xi-Yan; Sun, Meng-En; Zhang, Chong; Li, Xinlei; Zhao, Yong Sheng; Zang, Shuang-Quan Circularly Polarized Luminescence from Achiral Single Crystals of Hybrid Manganese Halides. Journal of the American Chemical Society, 2019, 141, 15755-15760 |
| 4128326 | CIF | C40 H48 Cl4 K2 Mn O12 | C 1 c 1 | 9.418; 35.5659; 26.6416 90; 91.008; 90 | 8922.48 | Zhao, Jian; Zhang, Tongjin; Dong, Xi-Yan; Sun, Meng-En; Zhang, Chong; Li, Xinlei; Zhao, Yong Sheng; Zang, Shuang-Quan Circularly Polarized Luminescence from Achiral Single Crystals of Hybrid Manganese Halides. Journal of the American Chemical Society, 2019, 141, 15755-15760 |
| 4128327 | CIF | C229 H96 Au24 Cl2 F108 P2 Pt | P 1 2/n 1 | 17.464; 20.626; 35.907 90; 95.69; 90 | 12870 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128328 | CIF | C72 H198 Au24 Pt S18 Si18 | P -1 | 16.883; 16.927; 17.005 103.829; 112.014; 107.241 | 3952.2 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128329 | CIF | C112.5 H199 Au23 Pd S17 | P -1 | 19.5656; 26.9697; 29.4945 92.24; 108.448; 96.785 | 14612 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128330 | CIF | C198 H270 Au24 Pt S18 | P -1 | 19.3124; 19.3602; 21.1823 64.389; 80.212; 62.406 | 6324.9 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128331 | CIF | C144 H162 Au24 Pd S18 | P -1 | 13.5826; 16.0653; 19.6261 112.202; 97.322; 94.939 | 3890.5 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128332 | CIF | C229 H96 Au24 Cl2 F108 P2 Pd | P 1 2/n 1 | 17.477; 20.733; 35.724 90; 95.792; 90 | 12879 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128333 | CIF | C72 H198 Au24 Pd S18 Si18 | P -1 | 16.8731; 16.9117; 17.0006 103.768; 112.008; 107.269 | 3946.7 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128334 | CIF | C115 H206 Au24 Pt S18 | P -1 | 16.139; 16.956; 17.758 111.431; 116.42; 94.089 | 3888 | Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping. Journal of the American Chemical Society, 2019, 141, 15994-16002 |
| 4128335 | CIF | C66 H70 Ag2 F6 Ir2 N16 O6 S2 | P -1 | 9.1921; 13.8664; 15.1426 83.111; 82.152; 77.693 | 1859.83 | Zhang, Hai-Ning; Gao, Wen-Xi; Lin, Yue-Jian; Jin, Guo-Xin Reversible Structural Transformation between a Molecular Solomon Link and an Unusual Unsymmetrical Trefoil Knot. Journal of the American Chemical Society, 2019, 141, 16057-16063 |
| 4128336 | CIF | C130 H141 F12 Ir4 N16 O16.5 S4 | C 1 c 1 | 49.616; 15.5826; 37.8111 90; 106.495; 90 | 28030 | Zhang, Hai-Ning; Gao, Wen-Xi; Lin, Yue-Jian; Jin, Guo-Xin Reversible Structural Transformation between a Molecular Solomon Link and an Unusual Unsymmetrical Trefoil Knot. Journal of the American Chemical Society, 2019, 141, 16057-16063 |
| 4128337 | CIF | C44 H50 F6 Ir2 N8 O6 S2 | P 1 21/n 1 | 9.0059; 23.0531; 11.8913 90; 91.56; 90 | 2467.9 | Zhang, Hai-Ning; Gao, Wen-Xi; Lin, Yue-Jian; Jin, Guo-Xin Reversible Structural Transformation between a Molecular Solomon Link and an Unusual Unsymmetrical Trefoil Knot. Journal of the American Chemical Society, 2019, 141, 16057-16063 |
| 4128338 | CIF | C210 H228 Ag2 F18 Ir6 N24 O26 S6 | P 1 21/n 1 | 28.2902; 21.3553; 36.871 90; 101.089; 90 | 21860 | Zhang, Hai-Ning; Gao, Wen-Xi; Lin, Yue-Jian; Jin, Guo-Xin Reversible Structural Transformation between a Molecular Solomon Link and an Unusual Unsymmetrical Trefoil Knot. Journal of the American Chemical Society, 2019, 141, 16057-16063 |
| 4128339 | CIF | C11 H11 Cl2 N O3 | P 21 21 21 | 7.9241; 9.4871; 16.0357 90; 90; 90 | 1205.51 | Fager, Diana C.; Lee, KyungA; Hoveyda, Amir H. Catalytic Enantioselective Addition of an Allyl Group to Ketones Containing a Tri-, a Di-, or a Monohalomethyl Moiety. Stereochemical Control Based on Distinctive Electronic and Steric Attributes of C-Cl, C-Br, and C-F Bonds. Journal of the American Chemical Society, 2019, 141, 16125-16138 |
| 4128340 | CIF | C17 H16 Br F O3 | P 21 21 21 | 5.7046; 7.4441; 35.724 90; 90; 90 | 1517.04 | Fager, Diana C.; Lee, KyungA; Hoveyda, Amir H. Catalytic Enantioselective Addition of an Allyl Group to Ketones Containing a Tri-, a Di-, or a Monohalomethyl Moiety. Stereochemical Control Based on Distinctive Electronic and Steric Attributes of C-Cl, C-Br, and C-F Bonds. Journal of the American Chemical Society, 2019, 141, 16125-16138 |
| 4128341 | CIF | C14 H13 F4 N3 O | P 21 21 21 | 5.3574; 9.2902; 28.0903 90; 90; 90 | 1398.09 | Fager, Diana C.; Lee, KyungA; Hoveyda, Amir H. Catalytic Enantioselective Addition of an Allyl Group to Ketones Containing a Tri-, a Di-, or a Monohalomethyl Moiety. Stereochemical Control Based on Distinctive Electronic and Steric Attributes of C-Cl, C-Br, and C-F Bonds. Journal of the American Chemical Society, 2019, 141, 16125-16138 |
| 4128342 | CIF | C15 H13 Cl3 O2 | P 1 21 1 | 8.0561; 6.0406; 14.5291 90; 98.325; 90 | 699.59 | Fager, Diana C.; Lee, KyungA; Hoveyda, Amir H. Catalytic Enantioselective Addition of an Allyl Group to Ketones Containing a Tri-, a Di-, or a Monohalomethyl Moiety. Stereochemical Control Based on Distinctive Electronic and Steric Attributes of C-Cl, C-Br, and C-F Bonds. Journal of the American Chemical Society, 2019, 141, 16125-16138 |
| 4128343 | CIF | C92 H123 F12 N4 O6 P6 Pt2 | P -1 | 13.0565; 15.3284; 30.5271 92.426; 90.698; 106.598 | 5847.9 | Huo, Gui-Fei; Shi, Xueliang; Tu, Qian; Hu, Yi-Xiong; Wu, Gui-Yuan; Yin, Guang-Qiang; Li, Xiaopeng; Xu, Lin; Ding, Hong-Ming; Yang, Hai-Bo Radical-Induced Hierarchical Self-Assembly Involving Supramolecular Coordination Complexes in Both Solution and Solid States. Journal of the American Chemical Society, 2019, 141, 16014-16023 |
| 4128344 | CIF | C19 H34 Cl3 P2 Pt | P b c n | 26.1116; 12.5972; 14.3418 90; 90; 90 | 4717.49 | Huo, Gui-Fei; Shi, Xueliang; Tu, Qian; Hu, Yi-Xiong; Wu, Gui-Yuan; Yin, Guang-Qiang; Li, Xiaopeng; Xu, Lin; Ding, Hong-Ming; Yang, Hai-Bo Radical-Induced Hierarchical Self-Assembly Involving Supramolecular Coordination Complexes in Both Solution and Solid States. Journal of the American Chemical Society, 2019, 141, 16014-16023 |
| 4128345 | CIF | C39 H48 F6 N2 O P3 Pt | P -1 | 10.6217; 19.9663; 24.0398 96.588; 100.265; 96.237 | 4939.9 | Huo, Gui-Fei; Shi, Xueliang; Tu, Qian; Hu, Yi-Xiong; Wu, Gui-Yuan; Yin, Guang-Qiang; Li, Xiaopeng; Xu, Lin; Ding, Hong-Ming; Yang, Hai-Bo Radical-Induced Hierarchical Self-Assembly Involving Supramolecular Coordination Complexes in Both Solution and Solid States. Journal of the American Chemical Society, 2019, 141, 16014-16023 |
| 4128346 | CIF | C72 H162 Au24 Hg S18 | P -1 | 16.2584; 17.3297; 25.0056 107.614; 91.395; 117.174 | 5863.12 | Fei, Wenwen; Antonello, Sabrina; Dainese, Tiziano; Dolmella, Alessandro; Lahtinen, Manu; Rissanen, Kari; Venzo, Alfonso; Maran, Flavio Metal Doping of Au<sub>25</sub>(SR)<sub>18</sub><sup>-</sup> Clusters: Insights and Hindsights. Journal of the American Chemical Society, 2019, 141, 16033-16045 |
| 4128347 | CIF | C72 H162 Au24 Cd S18 | P -1 | 16.2535; 17.3097; 25.0233 107.579; 91.4; 117.251 | 5855.46 | Fei, Wenwen; Antonello, Sabrina; Dainese, Tiziano; Dolmella, Alessandro; Lahtinen, Manu; Rissanen, Kari; Venzo, Alfonso; Maran, Flavio Metal Doping of Au<sub>25</sub>(SR)<sub>18</sub><sup>-</sup> Clusters: Insights and Hindsights. Journal of the American Chemical Society, 2019, 141, 16033-16045 |
| 4128348 | CIF | C144 H162 Au24 Cd S18 | P c c n | 31.3135; 27.0073; 18.5226 90; 90; 90 | 15664.4 | Fei, Wenwen; Antonello, Sabrina; Dainese, Tiziano; Dolmella, Alessandro; Lahtinen, Manu; Rissanen, Kari; Venzo, Alfonso; Maran, Flavio Metal Doping of Au<sub>25</sub>(SR)<sub>18</sub><sup>-</sup> Clusters: Insights and Hindsights. Journal of the American Chemical Society, 2019, 141, 16033-16045 |
| 4128349 | CIF | C144 H162 Au24 Hg S18 | P c c n | 31.2563; 26.9439; 18.457 90; 90; 90 | 15543.9 | Fei, Wenwen; Antonello, Sabrina; Dainese, Tiziano; Dolmella, Alessandro; Lahtinen, Manu; Rissanen, Kari; Venzo, Alfonso; Maran, Flavio Metal Doping of Au<sub>25</sub>(SR)<sub>18</sub><sup>-</sup> Clusters: Insights and Hindsights. Journal of the American Chemical Society, 2019, 141, 16033-16045 |
| 4128350 | CIF | C144 H162 Au24 Hg S18 | P c c n | 31.2914; 27.0095; 18.5163 90; 90; 90 | 15649.3 | Fei, Wenwen; Antonello, Sabrina; Dainese, Tiziano; Dolmella, Alessandro; Lahtinen, Manu; Rissanen, Kari; Venzo, Alfonso; Maran, Flavio Metal Doping of Au<sub>25</sub>(SR)<sub>18</sub><sup>-</sup> Clusters: Insights and Hindsights. Journal of the American Chemical Society, 2019, 141, 16033-16045 |
| 4128351 | CIF | C72 H162 Au24 Cd S18 | P -1 | 16.2635; 17.3283; 25.0097 107.58; 91.337; 117.222 | 5865.4 | Fei, Wenwen; Antonello, Sabrina; Dainese, Tiziano; Dolmella, Alessandro; Lahtinen, Manu; Rissanen, Kari; Venzo, Alfonso; Maran, Flavio Metal Doping of Au<sub>25</sub>(SR)<sub>18</sub><sup>-</sup> Clusters: Insights and Hindsights. Journal of the American Chemical Society, 2019, 141, 16033-16045 |
| 4128352 | CIF | C15 H19 Br O2 | P 1 21/n 1 | 13.615; 5.6025; 20.277 90; 104.195; 90 | 1499.5 | Gao, Qianwen; Shang, Yong; Song, Fuzhen; Ye, Jinxiang; Liu, Ze-Shui; Li, Lisha; Cheng, Hong-Gang; Zhou, Qianghui Modular Dual-Tasked C-H Methylation via the Catellani Strategy. Journal of the American Chemical Society, 2019, 141, 15986-15993 |
| 4128353 | CIF | C23 H18 F N3 | P 1 21/c 1 | 16.7047; 14.256; 17.8359 90; 122.014; 90 | 3601.5 | Le Fouler, Vincent; Chen, Yu; Gandon, Vincent; Bizet, Vincent; Salomé, Christophe; Fessard, Thomas; Liu, Fang; Houk, K. N.; Blanchard, Nicolas Activating Pyrimidines by Pre-distortion for the General Synthesis of 7-Aza-indazoles from 2-Hydrazonylpyrimidines via Intramolecular Diels-Alder Reactions. Journal of the American Chemical Society, 2019, 141, 15901-15909 |
| 4128354 | CIF | C22 H25 F N4 O2 | P -1 | 8.0215; 10.3318; 12.9525 73.191; 89.769; 75.301 | 991.17 | Le Fouler, Vincent; Chen, Yu; Gandon, Vincent; Bizet, Vincent; Salomé, Christophe; Fessard, Thomas; Liu, Fang; Houk, K. N.; Blanchard, Nicolas Activating Pyrimidines by Pre-distortion for the General Synthesis of 7-Aza-indazoles from 2-Hydrazonylpyrimidines via Intramolecular Diels-Alder Reactions. Journal of the American Chemical Society, 2019, 141, 15901-15909 |
| 4128355 | CIF | C13 H10 F N3 | P -1 | 10.1762; 13.3486; 14.3784 65.334; 71.413; 77.355 | 1673.96 | Le Fouler, Vincent; Chen, Yu; Gandon, Vincent; Bizet, Vincent; Salomé, Christophe; Fessard, Thomas; Liu, Fang; Houk, K. N.; Blanchard, Nicolas Activating Pyrimidines by Pre-distortion for the General Synthesis of 7-Aza-indazoles from 2-Hydrazonylpyrimidines via Intramolecular Diels-Alder Reactions. Journal of the American Chemical Society, 2019, 141, 15901-15909 |
| 4128356 | CIF | C14 H11 F N4 | P 1 21/c 1 | 12.2141; 11.1208; 9.4452 90; 105.823; 90 | 1234.33 | Le Fouler, Vincent; Chen, Yu; Gandon, Vincent; Bizet, Vincent; Salomé, Christophe; Fessard, Thomas; Liu, Fang; Houk, K. N.; Blanchard, Nicolas Activating Pyrimidines by Pre-distortion for the General Synthesis of 7-Aza-indazoles from 2-Hydrazonylpyrimidines via Intramolecular Diels-Alder Reactions. Journal of the American Chemical Society, 2019, 141, 15901-15909 |
| 4128357 | CIF | C17 H14 F N3 | P -1 | 9.757; 11.3567; 13.6657 82.028; 80.377; 72.198 | 1415.27 | Le Fouler, Vincent; Chen, Yu; Gandon, Vincent; Bizet, Vincent; Salomé, Christophe; Fessard, Thomas; Liu, Fang; Houk, K. N.; Blanchard, Nicolas Activating Pyrimidines by Pre-distortion for the General Synthesis of 7-Aza-indazoles from 2-Hydrazonylpyrimidines via Intramolecular Diels-Alder Reactions. Journal of the American Chemical Society, 2019, 141, 15901-15909 |
| 4128358 | CIF | C3 H N3 O3 Rb2 | C m c m | 13.429; 6.695; 7.259 90; 90; 90 | 652.6 | Lu, Jing; Lian, Yu-Kun; Xiong, Lin; Wu, Qian-Ru; Zhao, Min; Shi, Ke-Xin; Chen, Ling; Wu, Li-Ming How To Maximize Birefringence and Nonlinearity of π-Conjugated Cyanurates. Journal of the American Chemical Society, 2019, 141, 16151-16159 |
| 4128359 | CIF | C3 H5 Li2 N3 O5 | P 1 21/c 1 | 3.4142; 16.974; 11.176 90; 90.92; 90 | 647.6 | Lu, Jing; Lian, Yu-Kun; Xiong, Lin; Wu, Qian-Ru; Zhao, Min; Shi, Ke-Xin; Chen, Ling; Wu, Li-Ming How To Maximize Birefringence and Nonlinearity of π-Conjugated Cyanurates. Journal of the American Chemical Society, 2019, 141, 16151-16159 |
| 4128360 | CIF | C3 H4 Cs0 Li N3 O5 Rb | P n a 21 | 15.689; 3.7585; 12.759 90; 90; 90 | 752.4 | Lu, Jing; Lian, Yu-Kun; Xiong, Lin; Wu, Qian-Ru; Zhao, Min; Shi, Ke-Xin; Chen, Ling; Wu, Li-Ming How To Maximize Birefringence and Nonlinearity of π-Conjugated Cyanurates. Journal of the American Chemical Society, 2019, 141, 16151-16159 |
| 4128361 | CIF | C194 H148 N10 O20 | P 3 c 1 | 31.791; 31.791; 45.798 90; 90; 120 | 40085 | Meng, Dong; Liu, Guogang; Xiao, Chengyi; Shi, Yanjun; Zhang, Lei; Jiang, Lang; Baldridge, Kim K.; Li, Yan; Siegel, Jay S.; Wang, Zhaohui Corannurylene Pentapetalae. Journal of the American Chemical Society, 2019, 141, 5402-5408 |
| 4128362 | CIF | C191 H142 N10 O20 | P -1 | 21.504; 22.883; 44.815 96.64; 100.37; 109.8 | 20035 | Meng, Dong; Liu, Guogang; Xiao, Chengyi; Shi, Yanjun; Zhang, Lei; Jiang, Lang; Baldridge, Kim K.; Li, Yan; Siegel, Jay S.; Wang, Zhaohui Corannurylene Pentapetalae. Journal of the American Chemical Society, 2019, 141, 5402-5408 |
| 4128363 | CIF | C273.27 H366.41 N89.81 O140.75 Pd12 | P -1 | 27.2333; 27.3279; 32.2689 101.089; 91.74; 107.559 | 22369 | Takezawa, Hiroki; Kanda, Tomoya; Nanjo, Hikaru; Fujita, Makoto Site-Selective Functionalization of Linear Diterpenoids through U-Shaped Folding in a Confined Artificial Cavity. Journal of the American Chemical Society, 2019, 141, 5112-5115 |
| 4128364 | CIF | C249.04 H325.16 N83.49 O104.67 Pd12 | P -1 | 27.413; 27.587; 32.476 100.778; 91.868; 107.512 | 22905 | Takezawa, Hiroki; Kanda, Tomoya; Nanjo, Hikaru; Fujita, Makoto Site-Selective Functionalization of Linear Diterpenoids through U-Shaped Folding in a Confined Artificial Cavity. Journal of the American Chemical Society, 2019, 141, 5112-5115 |
| 4128365 | CIF | C127 H166.74 N41.46 O53.42 Pd6 | P -1 | 27.2824; 27.3856; 32.624 100.843; 92.109; 107.136 | 22766.2 | Takezawa, Hiroki; Kanda, Tomoya; Nanjo, Hikaru; Fujita, Makoto Site-Selective Functionalization of Linear Diterpenoids through U-Shaped Folding in a Confined Artificial Cavity. Journal of the American Chemical Society, 2019, 141, 5112-5115 |
| 4128366 | CIF | C21 H26 B Br2 N O2 | P 31 2 1 | 18.5092; 18.5092; 12.7134 90; 90; 120 | 3771.96 | Zou, Xiaoliang; Zhao, Haonan; Li, Yinwu; Gao, Qian; Ke, Zhuofeng; Senmiao Xu, ? Chiral Bidentate Boryl Ligand Enabled Iridium-Catalyzed Asymmetric C(sp<sup>2</sup>)-H Borylation of Diarylmethylamines. Journal of the American Chemical Society, 2019, 141, 5334-5342 |
| 4128367 | CIF | C38 H45 B Cl Ir N2 O Si | P 21 21 21 | 12.233; 18.2364; 19.0123 90; 90; 90 | 4241.38 | Zou, Xiaoliang; Zhao, Haonan; Li, Yinwu; Gao, Qian; Ke, Zhuofeng; Senmiao Xu, ? Chiral Bidentate Boryl Ligand Enabled Iridium-Catalyzed Asymmetric C(sp<sup>2</sup>)-H Borylation of Diarylmethylamines. Journal of the American Chemical Society, 2019, 141, 5334-5342 |
| 4128368 | CIF | C15 H17 N O | P 21 21 21 | 7.4113; 9.563; 18.357 90; 90; 90 | 1301.04 | Zou, Xiaoliang; Zhao, Haonan; Li, Yinwu; Gao, Qian; Ke, Zhuofeng; Senmiao Xu, ? Chiral Bidentate Boryl Ligand Enabled Iridium-Catalyzed Asymmetric C(sp<sup>2</sup>)-H Borylation of Diarylmethylamines. Journal of the American Chemical Society, 2019, 141, 5334-5342 |
| 4128369 | CIF | C19 H19 Br O2 | P 1 21/n 1 | 7.76362; 21.0599; 9.84571 90; 96.0573; 90 | 1600.8 | Holt, Connor; Alachouzos, Georgios; Frontier, Alison J. Leveraging the Halo-Nazarov Cyclization for the Chemodivergent Assembly of Functionalized Haloindenes and Indanones. Journal of the American Chemical Society, 2019, 141, 5461-5469 |
| 4128370 | CIF | C19 H19 Br O2 | I 1 2 1 | 17.9455; 4.9568; 19.3568 90; 112.704; 90 | 1588.41 | Holt, Connor; Alachouzos, Georgios; Frontier, Alison J. Leveraging the Halo-Nazarov Cyclization for the Chemodivergent Assembly of Functionalized Haloindenes and Indanones. Journal of the American Chemical Society, 2019, 141, 5461-5469 |
| 4128371 | CIF | C21 H22 O2 | P 21 21 21 | 9.2478; 9.9984; 17.5641 90; 90; 90 | 1624.03 | Holt, Connor; Alachouzos, Georgios; Frontier, Alison J. Leveraging the Halo-Nazarov Cyclization for the Chemodivergent Assembly of Functionalized Haloindenes and Indanones. Journal of the American Chemical Society, 2019, 141, 5461-5469 |
| 4128372 | CIF | C45 H62 Cu N4 O3 | P 21 21 21 | 13.8662; 17.1025; 19.5603 90; 90; 90 | 4638.66 | Bailey, Wilson D.; Dhar, Debanjan; Cramblitt, Anna C.; Tolman, William B. Mechanistic Dichotomy in Proton-Coupled Electron-Transfer Reactions of Phenols with a Copper Superoxide Complex. Journal of the American Chemical Society, 2019, 141, 5470-5480 |
| 4128373 | CIF | C50 H74 Cu N4 O5 | P 1 21/n 1 | 14.1362; 18.2096; 19.4267 90; 103.126; 90 | 4870.1 | Bailey, Wilson D.; Dhar, Debanjan; Cramblitt, Anna C.; Tolman, William B. Mechanistic Dichotomy in Proton-Coupled Electron-Transfer Reactions of Phenols with a Copper Superoxide Complex. Journal of the American Chemical Society, 2019, 141, 5470-5480 |
| 4128374 | CIF | C39 H47 Cu N4 O3 | P 1 21/n 1 | 12.804; 19.802; 24.105 90; 92.625; 90 | 6105.3 | Bailey, Wilson D.; Dhar, Debanjan; Cramblitt, Anna C.; Tolman, William B. Mechanistic Dichotomy in Proton-Coupled Electron-Transfer Reactions of Phenols with a Copper Superoxide Complex. Journal of the American Chemical Society, 2019, 141, 5470-5480 |
| 4128375 | CIF | C55 H110 B6 N2 O2 P2 Si4 | P 1 21/c 1 | 18.1486; 20.9685; 18.7151 90; 109.125; 90 | 6728.9 | Lu, Wei; Li, Yongxin; Kinjo, Rei Crystalline Tetraatomic Boron(0) Species. Journal of the American Chemical Society, 2019, 141, 5164-5168 |
| 4128376 | CIF | C116 H170 N6 O3 Re3 U | P -1 | 15.1739; 15.9697; 24.5541 77.863; 86.54; 69.678 | 5454.42 | Boreen, Michael A.; Lohrey, Trevor D.; Rao, Guodong; Britt, R. David; Maron, Laurent; Arnold, John A Uranium Tri-Rhenium Triple Inverse Sandwich Compound. Journal of the American Chemical Society, 2019, 141, 5144-5148 |
| 4128377 | CIF | C112 H160 N6 O Re3 U | P -1 | 13.1634; 16.7458; 25.515 98.327; 90.663; 109.671 | 5229.3 | Boreen, Michael A.; Lohrey, Trevor D.; Rao, Guodong; Britt, R. David; Maron, Laurent; Arnold, John A Uranium Tri-Rhenium Triple Inverse Sandwich Compound. Journal of the American Chemical Society, 2019, 141, 5144-5148 |
| 4128378 | CIF | C109 H148 N8 Re3 U | P 1 21/n 1 | 16.8272; 19.4767; 30.7821 90; 98.321; 90 | 9982.3 | Boreen, Michael A.; Lohrey, Trevor D.; Rao, Guodong; Britt, R. David; Maron, Laurent; Arnold, John A Uranium Tri-Rhenium Triple Inverse Sandwich Compound. Journal of the American Chemical Society, 2019, 141, 5144-5148 |
| 4128379 | CIF | C258 H90 | C 1 2 1 | 45.7488; 31.7238; 31.6653 90; 122.171; 90 | 38901 | Zhu, Yanpeng; Guo, Xiaoyu; Li, Yang; Wang, Jiaobing Fusing of Seven HBCs toward a Green Nanographene Propeller. Journal of the American Chemical Society, 2019, 141, 5511-5517 |
| 4128380 | CIF | C17 H16 O4 S2 | C 1 2/c 1 | 12.5003; 8.0481; 16.3678 90; 102.908; 90 | 1605 | Dolgopolova, Ekaterina A.; Galitskiy, Vladimir A.; Martin, Corey R.; Gregory, Haley N.; Yarbrough, Brandon J.; Rice, Allison M.; Berseneva, Anna A.; Ejegbavwo, Otega A.; Stephenson, Kenneth S.; Kittikhunnatham, Preecha; Karakalos, Stavros G.; Smith, Mark D.; Greytak, Andrew B.; Garashchuk, Sophya; Shustova, Natalia B. Connecting Wires: Photoinduced Electronic Structure Modulation in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 5350-5358 |
| 4128381 | CIF | C51 H28 Br2 N2 O9 Zn2 | P m m m | 11.4319; 15.7328; 18.3308 90; 90; 90 | 3296.9 | Dolgopolova, Ekaterina A.; Galitskiy, Vladimir A.; Martin, Corey R.; Gregory, Haley N.; Yarbrough, Brandon J.; Rice, Allison M.; Berseneva, Anna A.; Ejegbavwo, Otega A.; Stephenson, Kenneth S.; Kittikhunnatham, Preecha; Karakalos, Stavros G.; Smith, Mark D.; Greytak, Andrew B.; Garashchuk, Sophya; Shustova, Natalia B. Connecting Wires: Photoinduced Electronic Structure Modulation in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 5350-5358 |
| 4128382 | CIF | C57 H42 N2 O8 S2 Zn2 | P 1 21/c 1 | 26.4692; 17.4806; 29.688 90; 103.562; 90 | 13353.5 | Dolgopolova, Ekaterina A.; Galitskiy, Vladimir A.; Martin, Corey R.; Gregory, Haley N.; Yarbrough, Brandon J.; Rice, Allison M.; Berseneva, Anna A.; Ejegbavwo, Otega A.; Stephenson, Kenneth S.; Kittikhunnatham, Preecha; Karakalos, Stavros G.; Smith, Mark D.; Greytak, Andrew B.; Garashchuk, Sophya; Shustova, Natalia B. Connecting Wires: Photoinduced Electronic Structure Modulation in Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 5350-5358 |
| 4128383 | CIF | C21 H20 Br N3 O | P 21 21 21 | 5.4657; 13.2961; 25.2012 90; 90; 90 | 1831.43 | Liu, En-Chih; Topczewski, Joseph J. Enantioselective Copper Catalyzed Alkyne-Azide Cycloaddition by Dynamic Kinetic Resolution. Journal of the American Chemical Society, 2019, 141, 5135-5138 |
| 4128384 | CIF | C25 H38 O7 S Si | P 21 21 21 | 18.6122; 22.6992; 27.114 90; 90; 90 | 11455.2 | Dimakos, Victoria; Su, Hsin Y.; Garrett, Graham E.; Taylor, Mark S. Site-Selective and Stereoselective C-H Alkylations of Carbohydrates via Combined Diarylborinic Acid and Photoredox Catalysis. Journal of the American Chemical Society, 2019, 141, 5149-5153 |
| 4128385 | CIF | C11 H34 I7 N3 Pb2 | C 1 c 1 | 41.3091; 8.9764; 8.8719 90; 95.0826; 90 | 3276.83 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128386 | CIF | C14 H52 I16 N6 Pb5 | P 1 c 1 | 39.454; 8.9418; 8.893 90; 93.698; 90 | 3130.8 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128387 | CIF | C13 H46 I13 N5 Pb4 | C 1 c 1 | 66.269; 8.948; 8.8839 90; 93.179; 90 | 5259.8 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128388 | CIF | C15 H50 I13 N5 Pb4 | C 1 c 1 | 68.752; 8.9445; 8.8984 90; 93.77; 90 | 5460.2 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128389 | CIF | C12 H40 I10 N4 Pb3 | P 1 c 1 | 26.9783; 8.954; 8.8757 90; 95.5426; 90 | 2134.02 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128390 | CIF | C14 H44 I10 N4 Pb3 | P 1 c 1 | 28.1426; 8.9413; 8.9025 90; 94.5632; 90 | 2233.05 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128391 | CIF | C13 H38 I7 N3 Pb2 | C 1 c 1 | 45.3552; 8.9209; 8.8062 90; 98.2088; 90 | 3526.56 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Tu, Qing; Chen, Michelle; Tsai, Hsinhan; He, Yihui; Shekhawat, Gajendra; Dravid, Vinayak P.; Wasielewski, Michael R.; Mohite, Aditya D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Uniaxial Expansion of the 2D Ruddlesden-Popper Perovskite Family for Improved Environmental Stability. Journal of the American Chemical Society, 2019, 141, 5518-5534 |
| 4128392 | CIF | C99.18 H63.18 Cl3.54 F12 N4 | P -1 | 16.181; 16.229; 18.735 64.77; 76.472; 76.628 | 4278.3 | Suzuki, Wataru; Kotani, Hiroaki; Ishizuka, Tomoya; Kojima, Takahiko Dioxygen/Hydrogen Peroxide Interconversion Using Redox Couples of Saddle-Distorted Porphyrins and Isophlorins. Journal of the American Chemical Society, 2019, 141, 5987-5994 |
| 4128393 | CIF | C98 H64 F12 N4 O | P -1 | 15.1005; 16.7532; 18.7562 90.18; 109.151; 97.462 | 4439.1 | Suzuki, Wataru; Kotani, Hiroaki; Ishizuka, Tomoya; Kojima, Takahiko Dioxygen/Hydrogen Peroxide Interconversion Using Redox Couples of Saddle-Distorted Porphyrins and Isophlorins. Journal of the American Chemical Society, 2019, 141, 5987-5994 |
| 4128394 | CIF | C23 H24 Cl N O4 | P 21 21 21 | 9.5175; 10.2604; 22.887 90; 90; 90 | 2234.99 | Lin, Hua-Chen; Xie, Pei-Pei; Dai, Zhen-Yao; Zhang, Shuo-Qing; Wang, Pu-Sheng; Chen, Yu-Gen; Wang, Tian-Ci; Hong, Xin; Gong, Liu-Zhu Nucleophile-Dependent Z/ E- and Regioselectivity in the Palladium-Catalyzed Asymmetric Allylic C-H Alkylation of 1,4-Dienes. Journal of the American Chemical Society, 2019, 141, 5824-5834 |
| 4128395 | CIF | C17 H13 N O2 | P 21 21 21 | 5.4588; 10.6465; 21.7635 90; 90; 90 | 1264.83 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128396 | CIF | C11 H15 Co I2 O | P 1 21/m 1 | 7.0976; 12.673; 8.57 90; 112.29; 90 | 713.3 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128397 | CIF | C16 H15 N O | P 1 21 1 | 9.1246; 6.02431; 23.2712 90; 100.952; 90 | 1255.91 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128398 | CIF | C33 H29 Co I2 O3 | P 1 21 1 | 7.8959; 18.3744; 10.6262 90; 104.823; 90 | 1490.37 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128399 | CIF | C40 H37 Co I2 O3 | P 1 21 1 | 7.74793; 12.5796; 18.6446 90; 99.7262; 90 | 1791.09 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128400 | CIF | C30 H23 Co I2 O3 | P 1 21 1 | 14.8651; 7.3449; 15.0607 90; 98.255; 90 | 1627.33 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128401 | CIF | C12 H13 N O3 | P 1 21 1 | 10.8622; 5.17605; 19.432 90; 101.425; 90 | 1070.88 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128402 | CIF | C34 H31 Co I2 O3 | P 21 21 21 | 9.9249; 12.0314; 25.6817 90; 90; 90 | 3066.66 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128403 | CIF | C11 H13 N O2 | P 1 21/c 1 | 11.7035; 7.6414; 10.7527 90; 93.565; 90 | 959.77 | Ozols, Kristers; Jang, Yun-Suk; Cramer, Nicolai Chiral Cyclopentadienyl Cobalt(III) Complexes Enable Highly Enantioselective 3d-Metal-Catalyzed C-H Functionalizations. Journal of the American Chemical Society, 2019, 141, 5675-5680 |
| 4128404 | CIF | C10 H20 Mn N9 | P 21 21 21 | 7.5991; 9.5866; 20.193 90; 90; 90 | 1471.1 | Vaddypally, Shivaiah; Tomlinson, Warren; O'Sullivan, Owen T; Ding, Ran; Van Vliet, Megan M.; Wayland, Bradford B.; Hooper, Joseph P.; Zdilla, Michael J. Activation of C-H, N-H, and O-H Bonds via Proton-Coupled Electron Transfer to a Mn(III) Complex of Redox-Noninnocent Octaazacyclotetradecadiene, a Catenated-Nitrogen Macrocyclic Ligand. Journal of the American Chemical Society, 2019, 141, 5699-5709 |
| 4128405 | CIF | C12 H30 Mn N9 Si2 | P -1 | 8.3841; 15.402; 17.081 73.318; 81.288; 89.959 | 2086.4 | Vaddypally, Shivaiah; Tomlinson, Warren; O'Sullivan, Owen T; Ding, Ran; Van Vliet, Megan M.; Wayland, Bradford B.; Hooper, Joseph P.; Zdilla, Michael J. Activation of C-H, N-H, and O-H Bonds via Proton-Coupled Electron Transfer to a Mn(III) Complex of Redox-Noninnocent Octaazacyclotetradecadiene, a Catenated-Nitrogen Macrocyclic Ligand. Journal of the American Chemical Society, 2019, 141, 5699-5709 |
| 4128406 | CIF | C38 H78 Mn2 N26 O2 | P 1 21/c 1 | 17.504; 18.005; 17.337 90; 113.955; 90 | 4993.3 | Vaddypally, Shivaiah; Tomlinson, Warren; O'Sullivan, Owen T; Ding, Ran; Van Vliet, Megan M.; Wayland, Bradford B.; Hooper, Joseph P.; Zdilla, Michael J. Activation of C-H, N-H, and O-H Bonds via Proton-Coupled Electron Transfer to a Mn(III) Complex of Redox-Noninnocent Octaazacyclotetradecadiene, a Catenated-Nitrogen Macrocyclic Ligand. Journal of the American Chemical Society, 2019, 141, 5699-5709 |
| 4128407 | CIF | C30 H30 N6 O5 | P 1 21/c 1 | 8.5118; 21.5727; 14.8041 90; 98.907; 90 | 2685.6 | Kang, Suk-Il; Lee, Milim; Lee, Dongwhan Weak Links To Differentiate Weak Bonds: Size-Selective Response of π-Conjugated Macrocycle Gels to Ammonium Ions. Journal of the American Chemical Society, 2019, 141, 5980-5986 |
| 4128408 | CIF | C22 H16 Br2 N6 O3 | P 1 21/c 1 | 4.22755; 26.151; 18.5287 90; 95.85; 90 | 2037.77 | Kang, Suk-Il; Lee, Milim; Lee, Dongwhan Weak Links To Differentiate Weak Bonds: Size-Selective Response of π-Conjugated Macrocycle Gels to Ammonium Ions. Journal of the American Chemical Society, 2019, 141, 5980-5986 |
| 4128409 | CIF | C12 H17 F9 N6 O7 | P 1 21/n 1 | 12.297; 7.774; 20.789 90; 90.85; 90 | 1987.1 | Huang, Rui-Kang; Wang, Sha-Sha; Liu, De-Xuan; Li, Xin; Song, Jian-Ming; Xia, Yuan-Hua; Zhou, Dong-Dong; Huang, Jin; Zhang, Wei-Xiong; Chen, Xiao-Ming Supercooling Behavior and Dipole-Glass-like Relaxation in a Three-Dimensional Water Framework. Journal of the American Chemical Society, 2019, 141, 5645-5649 |
| 4128410 | CIF | C12 H17 F9 N6 O7 | P c n b | 12.338; 7.906; 21.055 90; 90; 90 | 2053.8 | Huang, Rui-Kang; Wang, Sha-Sha; Liu, De-Xuan; Li, Xin; Song, Jian-Ming; Xia, Yuan-Hua; Zhou, Dong-Dong; Huang, Jin; Zhang, Wei-Xiong; Chen, Xiao-Ming Supercooling Behavior and Dipole-Glass-like Relaxation in a Three-Dimensional Water Framework. Journal of the American Chemical Society, 2019, 141, 5645-5649 |
| 4128411 | CIF | C12 H17 F9 N6 O7 | P c n b | 12.283; 7.782; 20.867 90; 90; 90 | 1994.6 | Huang, Rui-Kang; Wang, Sha-Sha; Liu, De-Xuan; Li, Xin; Song, Jian-Ming; Xia, Yuan-Hua; Zhou, Dong-Dong; Huang, Jin; Zhang, Wei-Xiong; Chen, Xiao-Ming Supercooling Behavior and Dipole-Glass-like Relaxation in a Three-Dimensional Water Framework. Journal of the American Chemical Society, 2019, 141, 5645-5649 |
| 4128412 | CIF | C23 H35.5 Br N3 O3.75 | P 21 21 21 | 6.606; 12.0607; 31.8122 90; 90; 90 | 2534.57 | Combes, Sébastien; Tran, Khoa Truong; Ayhan, Mehmet Menaf; Karoui, Hakim; Rockenbauer, Antal; Tonetto, Alain; Monnier, Valérie; Charles, Laurence; Rosas, Roselyne; Viel, Stéphane; Siri, Didier; Tordo, Paul; Clair, Sylvain; Wang, Ruibing; Bardelang, David; Ouari, Olivier Triangular Regulation of Cucurbit[8]uril 1:1 Complexes. Journal of the American Chemical Society, 2019, 141, 5897-5907 |
| 4128413 | CIF | C16 H18 B2 | P -1 | 5.1697; 7.5135; 9.1628 76.716; 74.826; 84.882 | 334.15 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128414 | CIF | C28 H26 B2 | P 1 21/n 1 | 10.3844; 8.6036; 12.5024 90; 98.997; 90 | 1103.26 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128415 | CIF | C42 H54 B2 Li2 O4 | P -1 | 9.1549; 9.8159; 11.6092 69.862; 79.949; 81.811 | 960.6 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128416 | CIF | C24 H34 B2 Na2 O3 | C 1 2/c 1 | 16.846; 10.2105; 15.0325 90; 106.425; 90 | 2480.2 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128417 | CIF | C28 H42 B2 K2 O4 | P 1 21/n 1 | 14.6657; 10.0154; 21.2355 90; 102.926; 90 | 3040.1 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128418 | CIF | C34 H38 B2 K2 O2 | P 1 21/c 1 | 6.358; 12.581; 19.691 90; 90.278; 90 | 1575.1 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128419 | CIF | C94 H134 B4 Na4 O12 | P 1 21/c 1 | 16.013; 17.3067; 34.7821 90; 101.572; 90 | 9443.3 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128420 | CIF | C36 H60 B2 K2 O12 | P b a m | 22.959; 9.4933; 18.771 90; 90; 90 | 4091.3 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128421 | CIF | C40 H56 B4 K4 O3 | P 1 21/n 1 | 11.1111; 24.7167; 16.6417 90; 107.866; 90 | 4349.91 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128422 | CIF | C84 H112 B4 K4 O14 | P -1 | 11.9532; 12.655; 15.273 112.47; 90.868; 100.044 | 2093.7 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128423 | CIF | C45 H70 B2 Li N O9 | P 1 21/c 1 | 13.8997; 13.1337; 25.5265 90; 104.454; 90 | 4512.5 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128424 | CIF | C36 H58 B2 Li2 O9 | P 1 21 1 | 14.3173; 12.8231; 20.9241 90; 102.873; 90 | 3744.9 | von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts. Journal of the American Chemical Society, 2019, 141, 6082-6091 |
| 4128425 | CIF | C198 H198 O6 | P 1 21/c 1 | 8.2267; 41.4797; 53.185 90; 92.465; 90 | 18132.1 | Lu, Xuefeng; Gopalakrishna, Tullimilli Y.; Han, Yi; Ni, Yong; Zou, Ya; Wu, Jishan Bowl-Shaped Carbon Nanobelts Showing Size-Dependent Properties and Selective Encapsulation of C<sub>70</sub>. Journal of the American Chemical Society, 2019, 141, 5934-5941 |
| 4128426 | CIF | C21 H27 Br O4 | P -1 | 8.3462; 11.106; 12.021 112.915; 99.596; 105.642 | 940.81 | Huang, David; Szewczyk, Suzanne M.; Zhang, Pengpeng; Newhouse, Timothy R. Allyl-Nickel Catalysis Enables Carbonyl Dehydrogenation and Oxidative Cycloalkenylation of Ketones. Journal of the American Chemical Society, 2019, 141, 5669-5674 |
| 4128427 | CIF | C19 H17 N | P 1 21 1 | 9.3155; 8.4154; 9.8563 90; 112.865; 90 | 711.96 | Zhang, Wu-Bin; Yang, Xin-Tuo; Ma, Jun-Bao; Su, Zhi-Ming; Shi, Shi-Liang Regio- and Enantioselective C-H Cyclization of Pyridines with Alkenes Enabled by a Nickel/N-Heterocyclic Carbene Catalysis. Journal of the American Chemical Society, 2019, 141, 5628-5634 |
| 4128428 | CIF | C23 H20 S3 | P 1 21/c 1 | 15.775; 8.5272; 14.2714 90; 100.924; 90 | 1885 | Ishiwari, Fumitaka; Nascimbeni, Giulia; Sauter, Eric; Tago, Hiromu; Shoji, Yoshiaki; Fujii, Shintaro; Kiguchi, Manabu; Tada, Tomofumi; Zharnikov, Michael; Zojer, Egbert; Fukushima, Takanori Triptycene Tripods for the Formation of Highly Uniform and Densely Packed Self-Assembled Monolayers with Controlled Molecular Orientation. Journal of the American Chemical Society, 2019, 141, 5995-6005 |
| 4128429 | CIF | C42 H39 Cr O3 | P -1 | 10.7286; 11.7519; 15.0753 95.481; 102.26; 115.318 | 1641.19 | Hirscher, Nathanael A.; Perez Sierra, Danny; Agapie, Theodor Robust Chromium Precursors for Catalysis: Isolation and Structure of a Single-Component Ethylene Tetramerization Precatalyst. Journal of the American Chemical Society, 2019, 141, 6022-6029 |
| 4128430 | CIF | C45 H45 Cr O3 | P 1 21/c 1 | 11.5802; 15.8845; 20.0281 90; 103.123; 90 | 3587.9 | Hirscher, Nathanael A.; Perez Sierra, Danny; Agapie, Theodor Robust Chromium Precursors for Catalysis: Isolation and Structure of a Single-Component Ethylene Tetramerization Precatalyst. Journal of the American Chemical Society, 2019, 141, 6022-6029 |
| 4128431 | CIF | C21 H21 Cr O3 | P -1 | 12.015; 12.4851; 15.1703 75.513; 87.541; 80.203 | 2171.2 | Hirscher, Nathanael A.; Perez Sierra, Danny; Agapie, Theodor Robust Chromium Precursors for Catalysis: Isolation and Structure of a Single-Component Ethylene Tetramerization Precatalyst. Journal of the American Chemical Society, 2019, 141, 6022-6029 |
| 4128432 | CIF | C25 H29 Cr O4.58 | C 1 c 1 | 20.0935; 11.1921; 10.9889 90; 116.859; 90 | 2204.68 | Hirscher, Nathanael A.; Perez Sierra, Danny; Agapie, Theodor Robust Chromium Precursors for Catalysis: Isolation and Structure of a Single-Component Ethylene Tetramerization Precatalyst. Journal of the American Chemical Society, 2019, 141, 6022-6029 |
| 4128433 | CIF | C27 H33 Cr O3 | P 1 21/n 1 | 8.3974; 22.6187; 12.1007 90; 92.754; 90 | 2295.73 | Hirscher, Nathanael A.; Perez Sierra, Danny; Agapie, Theodor Robust Chromium Precursors for Catalysis: Isolation and Structure of a Single-Component Ethylene Tetramerization Precatalyst. Journal of the American Chemical Society, 2019, 141, 6022-6029 |
| 4128434 | CIF | C77.5 H62 B Cl Cr F24 N O2 P2 | P -1 | 12.9268; 16.7595; 18.995 104.445; 96.51; 107.746 | 3714.6 | Hirscher, Nathanael A.; Perez Sierra, Danny; Agapie, Theodor Robust Chromium Precursors for Catalysis: Isolation and Structure of a Single-Component Ethylene Tetramerization Precatalyst. Journal of the American Chemical Society, 2019, 141, 6022-6029 |
| 4128435 | CIF | C39 H52 B Eu N2 O9 | C 1 2/c 1 | 32.1523; 8.6704; 32.0714 90; 115.022; 90 | 8101.5 | Ebrahim, Fatmah Mish; Nguyen, Tu N.; Shyshkanov, Serhii; Gładysiak, Andrzej; Favre, Patrick; Zacharia, Anna; Itskos, Grigorios; Dyson, Paul J.; Stylianou, Kyriakos C. Selective, Fast-Response, and Regenerable Metal-Organic Framework for Sampling Excess Fluoride Levels in Drinking Water. Journal of the American Chemical Society, 2019, 141, 3052-3058 |
| 4128436 | CIF | C41 H51 N O8 | P 1 21 1 | 9.855; 13.243; 13.89 90; 101.25; 90 | 1777.9 | Liu, Xin; Liu, Junyang; Wu, Jianlei; Huang, Guocheng; Liang, Rong; Chung, Lung Wa; Li, Chuang-Chuang Asymmetric Total Synthesis of Cerorubenic Acid-III. Journal of the American Chemical Society, 2019, 141, 2872-2877 |
| 4128437 | CIF | C27 H42 O2 | P 21 21 21 | 9.8763; 15.381; 15.448 90; 90; 90 | 2346.7 | Liu, Xin; Liu, Junyang; Wu, Jianlei; Huang, Guocheng; Liang, Rong; Chung, Lung Wa; Li, Chuang-Chuang Asymmetric Total Synthesis of Cerorubenic Acid-III. Journal of the American Chemical Society, 2019, 141, 2872-2877 |
| 4128438 | CIF | C62 H32 Cr3 O16 | P -6 m 2 | 19.503; 19.503; 11.1225 90; 90; 120 | 3663.8 | Chen, Zhijie; Li, Penghao; Zhang, Xuan; Li, Peng; Wasson, Megan C.; Islamoglu, Timur; Stoddart, J. Fraser; Farha, Omar K. Reticular Access to Highly Porous acs-MOFs with Rigid Trigonal Prismatic Linkers for Water Sorption. Journal of the American Chemical Society, 2019, 141, 2900-2905 |
| 4128439 | CIF | C17 H31 N2 O3 | P 1 21/c 1 | 13.9834; 10.838; 11.6223 90; 97.462; 90 | 1746.47 | Siu, Juno C.; Parry, Joseph B.; Lin, Song Aminoxyl-Catalyzed Electrochemical Diazidation of Alkenes Mediated by a Metastable Charge-Transfer Complex. Journal of the American Chemical Society, 2019, 141, 2825-2831 |
| 4128440 | CIF | C11 H11 Au Cl2 N4 | P -1 | 6.5749; 9.8918; 11.4738 66.667; 86.471; 89.021 | 683.88 | Li, Weipeng; Yuan, Dandan; Wang, Guoqiang; Zhao, Yue; Xie, Jin; Li, Shuhua; Zhu, Chengjian Cooperative Au/Ag Dual-Catalyzed Cross-Dehydrogenative Biaryl Coupling: Reaction Development and Mechanistic Insight. Journal of the American Chemical Society, 2019, 141, 3187-3197 |
| 4128441 | CIF | B2 Li2 Na2 O5 | C m c m | 3.313; 9.985; 13.4 90; 90; 90 | 443.3 | Zhang, Min; An, Donghai; Hu, Cong; Chen, Xinglong; Yang, Zhihua; Pan, Shilie Rational Design via Synergistic Combination Leads to an Outstanding Deep-Ultraviolet Birefringent Li<sub>2</sub>Na<sub>2</sub>B<sub>2</sub>O<sub>5</sub> Material with an Unvalued B<sub>2</sub>O<sub>5</sub> Functional Gene. Journal of the American Chemical Society, 2019, 141, 3258-3264 |
| 4128442 | CIF | C47 H25.7 Cl4 F3 O5 S | P -1 | 10.1047; 14.132; 14.8352 111.146; 93.115; 104.921 | 1883.5 | Wehrmann, Caleb M.; Charlton, Ryan T.; Chen, Mark S. A Concise Synthetic Strategy for Accessing Ambient Stable Bisphenalenyls toward Achieving Electroactive Open-Shell π-Conjugated Materials. Journal of the American Chemical Society, 2019, 141, 3240-3248 |
| 4128443 | CIF | C46 H26 Cl6 | P -1 | 9.0833; 9.8014; 11.365 106.928; 111.639; 92.186 | 887.63 | Wehrmann, Caleb M.; Charlton, Ryan T.; Chen, Mark S. A Concise Synthetic Strategy for Accessing Ambient Stable Bisphenalenyls toward Achieving Electroactive Open-Shell π-Conjugated Materials. Journal of the American Chemical Society, 2019, 141, 3240-3248 |
| 4128444 | CIF | C8 H5 Cu F9 N | C 1 2/c 1 | 16.926; 9.04; 15.522 90; 101.987; 90 | 2323.2 | Paeth, Matthew; Tyndall, Sam B.; Chen, Liang-Yu; Hong, Jia-Cheng; Carson, William P.; Liu, Xingwu; Sun, Xiaodong; Liu, Jinjia; Yang, Kundi; Hale, Elizabeth M.; Tierney, David L.; Liu, Bin; Cao, Zhi; Cheng, Mu-Jeng; Goddard, 3rd, William A; Liu, Wei Csp<sup>3</sup>-Csp<sup>3</sup> Bond-Forming Reductive Elimination from Well-Defined Copper(III) Complexes. Journal of the American Chemical Society, 2019, 141, 3153-3159 |
| 4128445 | CIF | C25 H41 Cl Cu F9 N2 | P -1 | 9.3496; 12.2827; 14.2427 97.25; 106.305; 94.849 | 1544.86 | Paeth, Matthew; Tyndall, Sam B.; Chen, Liang-Yu; Hong, Jia-Cheng; Carson, William P.; Liu, Xingwu; Sun, Xiaodong; Liu, Jinjia; Yang, Kundi; Hale, Elizabeth M.; Tierney, David L.; Liu, Bin; Cao, Zhi; Cheng, Mu-Jeng; Goddard, 3rd, William A; Liu, Wei Csp<sup>3</sup>-Csp<sup>3</sup> Bond-Forming Reductive Elimination from Well-Defined Copper(III) Complexes. Journal of the American Chemical Society, 2019, 141, 3153-3159 |
| 4128446 | CIF | C23 H42 Cu F9 N2 | C 1 2/c 1 | 28.67; 12.0733; 16.8245 90; 104.183; 90 | 5646.1 | Paeth, Matthew; Tyndall, Sam B.; Chen, Liang-Yu; Hong, Jia-Cheng; Carson, William P.; Liu, Xingwu; Sun, Xiaodong; Liu, Jinjia; Yang, Kundi; Hale, Elizabeth M.; Tierney, David L.; Liu, Bin; Cao, Zhi; Cheng, Mu-Jeng; Goddard, 3rd, William A; Liu, Wei Csp<sup>3</sup>-Csp<sup>3</sup> Bond-Forming Reductive Elimination from Well-Defined Copper(III) Complexes. Journal of the American Chemical Society, 2019, 141, 3153-3159 |
| 4128447 | CIF | C26 H43 Cu F9 N | P -1 | 9.992; 11.5379; 13.0599 96.997; 92.663; 92.2 | 1491.33 | Paeth, Matthew; Tyndall, Sam B.; Chen, Liang-Yu; Hong, Jia-Cheng; Carson, William P.; Liu, Xingwu; Sun, Xiaodong; Liu, Jinjia; Yang, Kundi; Hale, Elizabeth M.; Tierney, David L.; Liu, Bin; Cao, Zhi; Cheng, Mu-Jeng; Goddard, 3rd, William A; Liu, Wei Csp<sup>3</sup>-Csp<sup>3</sup> Bond-Forming Reductive Elimination from Well-Defined Copper(III) Complexes. Journal of the American Chemical Society, 2019, 141, 3153-3159 |
| 4128448 | CIF | C94 H76 F6 N4 O2 S4 | P -1 | 8.3692; 15.4456; 18.9453 68.171; 88.703; 77.059 | 2210.7 | Aldrich, Thomas J.; Matta, Micaela; Zhu, Weigang; Swick, Steven M.; Stern, Charlotte L.; Schatz, George C.; Facchetti, Antonio; Melkonyan, Ferdinand S.; Marks, Tobin J. Fluorination Effects on Indacenodithienothiophene Acceptor Packing and Electronic Structure, End-Group Redistribution, and Solar Cell Photovoltaic Response. Journal of the American Chemical Society, 2019, 141, 3274-3287 |
| 4128449 | CIF | C188 H160 F8 N8 O4 S8 | P -1 | 15.4222; 17.6025; 21.1852 73.995; 68.809; 81.206 | 5145.3 | Aldrich, Thomas J.; Matta, Micaela; Zhu, Weigang; Swick, Steven M.; Stern, Charlotte L.; Schatz, George C.; Facchetti, Antonio; Melkonyan, Ferdinand S.; Marks, Tobin J. Fluorination Effects on Indacenodithienothiophene Acceptor Packing and Electronic Structure, End-Group Redistribution, and Solar Cell Photovoltaic Response. Journal of the American Chemical Society, 2019, 141, 3274-3287 |
| 4128450 | CIF | C189 H162 Br2 F4 N8 O4 S8 | P -1 | 15.467; 17.5307; 20.7381 82.827; 68.565; 80.934 | 5154.9 | Aldrich, Thomas J.; Matta, Micaela; Zhu, Weigang; Swick, Steven M.; Stern, Charlotte L.; Schatz, George C.; Facchetti, Antonio; Melkonyan, Ferdinand S.; Marks, Tobin J. Fluorination Effects on Indacenodithienothiophene Acceptor Packing and Electronic Structure, End-Group Redistribution, and Solar Cell Photovoltaic Response. Journal of the American Chemical Society, 2019, 141, 3274-3287 |
| 4128451 | CIF | C96 H86 Br4 N4 O2 S4 | P -1 | 8.42; 23.019; 23.126 101.78; 95.319; 91.105 | 4366 | Aldrich, Thomas J.; Matta, Micaela; Zhu, Weigang; Swick, Steven M.; Stern, Charlotte L.; Schatz, George C.; Facchetti, Antonio; Melkonyan, Ferdinand S.; Marks, Tobin J. Fluorination Effects on Indacenodithienothiophene Acceptor Packing and Electronic Structure, End-Group Redistribution, and Solar Cell Photovoltaic Response. Journal of the American Chemical Society, 2019, 141, 3274-3287 |
| 4128452 | CIF | C94 H80 F2 N4 O2 S4 | P -1 | 15.5206; 17.8326; 20.96 72.141; 68.454; 80.226 | 5125.1 | Aldrich, Thomas J.; Matta, Micaela; Zhu, Weigang; Swick, Steven M.; Stern, Charlotte L.; Schatz, George C.; Facchetti, Antonio; Melkonyan, Ferdinand S.; Marks, Tobin J. Fluorination Effects on Indacenodithienothiophene Acceptor Packing and Electronic Structure, End-Group Redistribution, and Solar Cell Photovoltaic Response. Journal of the American Chemical Society, 2019, 141, 3274-3287 |
| 4128453 | CIF | C10 H18 B Cl O2 | P -1 | 7.339; 7.6739; 11.4931 105.065; 95.119; 114.634 | 553.57 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4128454 | CIF | C21 H29 Cl3 O4 | P -1 | 7.2805; 11.3131; 13.8979 78.564; 78.616; 85.234 | 1098.75 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4128455 | CIF | C23 H31 Cl3 O4 | P 1 21 1 | 10.912; 9.4971; 11.5555 90; 99.171; 90 | 1182.22 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4128456 | CIF | C12 H13 Cl O4 | P 1 21/n 1 | 10.1102; 11.1721; 11.1221 90; 115.225; 90 | 1136.5 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4128457 | CIF | C21 H29 Cl3 O4 | P -1 | 7.2288; 10.311; 15.9253 75.328; 87.251; 72.819 | 1096.6 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4128458 | CIF | C33 H35 Cl2 O8 | P -1 | 10.7112; 11.688; 12.6327 89.4701; 89.1293; 79.0974 | 1552.8 | Landry, Matthew L.; McKenna, Grace M.; Burns, Noah Z. Enantioselective Synthesis of Azamerone. Journal of the American Chemical Society, 2019, 141, 2867-2871 |
| 4128459 | CIF | C25 H19 N O2 S | P 21 21 21 | 6.4263; 12.1889; 24.4609 90; 90; 90 | 1916.01 | Bertuzzi, Giulio; Thøgersen, Mathias Kirk; Giardinetti, Maxime; Vidal-Albalat, Andreu; Simon, Adam; Houk, K. N.; Jørgensen, Karl Anker Catalytic Enantioselective Hetero-[6+4] and -[6+2] Cycloadditions for the Construction of Condensed Polycyclic Pyrroles, Imidazoles, and Pyrazoles. Journal of the American Chemical Society, 2019, 141, 3288-3297 |
| 4128460 | CIF | C15 H24 O5 | P 21 21 21 | 7.5553; 13.0406; 14.8215 90; 90; 90 | 1460.3 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128461 | CIF | C15 H22 O4 | P 21 21 21 | 6.7812; 11.9069; 16.4542 90; 90; 90 | 1328.56 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128462 | CIF | C33 H47 Cl3 O5 | P 21 21 21 | 6.83561; 15.11333; 30.94568 90; 90; 90 | 3196.96 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128463 | CIF | C15 H22 O5 | P 1 | 6.2584; 7.9523; 8.4873 62.655; 69.084; 82.665 | 350.14 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128464 | CIF | C15 H23 N O4 S | P 21 21 21 | 7.42853; 12.26292; 16.19471 90; 90; 90 | 1475.26 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128465 | CIF | C15 H24 O5 | P 1 21 1 | 7.37217; 9.20606; 10.02549 90; 93.8045; 90 | 678.917 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128466 | CIF | C14 H20 O4 | P 1 21 1 | 6.2397; 11.9278; 9.1162 90; 103.411; 90 | 659.98 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128467 | CIF | C16 H24 O4 | P 1 21 1 | 8.0619; 9.8882; 9.804 90; 113.579; 90 | 716.3 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128468 | CIF | C15 H21 Cl O4 | P 21 21 21 | 7.7264; 11.6672; 15.5282 90; 90; 90 | 1399.8 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128469 | CIF | C15 H24 O5 | P 21 21 21 | 7.0086; 13.265; 14.9026 90; 90; 90 | 1385.5 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128470 | CIF | C15 H22 O4 | P 1 21 1 | 12.8174; 13.7159; 16.1653 90; 103.093; 90 | 2768.02 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128471 | CIF | C18 H20 O8 | P 21 21 21 | 11.9151; 11.956; 12.2289 90; 90; 90 | 1742.09 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128472 | CIF | C15 H24 O3 | P 1 21 1 | 8.7529; 6.3723; 11.9743 90; 90.872; 90 | 667.8 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128473 | CIF | C15 H22 O3 | P 1 21 1 | 8.3883; 11.5548; 13.553 90; 96.319; 90 | 1305.65 | Hung, Kevin; Condakes, Matthew L.; Novaes, Luiz F. T.; Harwood, Stephen J.; Morikawa, Takahiro; Yang, Zhi; Maimone, Thomas J. Development of a Terpene Feedstock-Based Oxidative Synthetic Approach to the Illicium Sesquiterpenes. Journal of the American Chemical Society, 2019, 141, 3083-3099 |
| 4128474 | CIF | C9 H11 Cl2 O P | P 1 21/m 1 | 8.0851; 6.8766; 10.0457 90; 109.579; 90 | 526.23 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128475 | CIF | C9 H13 O3 P | P 1 21/m 1 | 7.9568; 7.0412; 8.3981 90; 98.998; 90 | 464.72 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128476 | CIF | C36 H30 O12 P6 | P -1 | 8.7802; 11.2721; 12.4055 114.987; 104.507; 94.529 | 1053.23 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128477 | CIF | C30 H39 O6 P3 | P c a 21 | 12.8407; 12.7885; 37.8214 90; 90; 90 | 6210.78 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128478 | CIF | C27 H33 O6 P3 | P 1 21 1 | 8.4177; 17.2187; 9.4319 90; 108.594; 90 | 1295.72 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128479 | CIF | C36 H51 O6 P3 | P 1 21/n 1 | 11.054; 24.398; 13.4029 90; 97.424; 90 | 3584.4 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128480 | CIF | C13 H15 N2 O2 P | P 1 21/c 1 | 11.9962; 8.0932; 14.1305 90; 112.876; 90 | 1263.99 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128481 | CIF | C16 H21 N2 O2 P | P 1 21/c 1 | 7.9289; 14.1994; 13.0373 90; 92.861; 90 | 1466 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128482 | CIF | C31 H15 B F15 N2 O2 P | P 1 21/c 1 | 9.6015; 22.5281; 14.3198 90; 94.418; 90 | 3088.22 | Arz, Marius I.; Annibale, Vincent T.; Kelly, Nicole L.; Hanna, John V.; Manners, Ian Ring-Opening Polymerization of Cyclic Phosphonates: Access to Inorganic Polymers with a P<sup>V</sup>-O Main Chain. Journal of the American Chemical Society, 2019, 141, 2894-2899 |
| 4128483 | CIF | C37 H69 Cl N6 Ni Si2 | P -1 | 10.3889; 12.1012; 18.1909 101.198; 101.994; 99.504 | 2143.51 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128484 | CIF | C37 H69 Cl N5 Ni P Si2 | P 1 21/n 1 | 30.1187; 9.9367; 30.372 90; 100.471; 90 | 8938.38 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128485 | CIF | C37 H69 As Cl N5 Ni Si2 | P 1 21/n 1 | 30.2685; 9.9287; 30.4291 90; 101.039; 90 | 8975.6 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128486 | CIF | C37 H68 N6 Ni Si2 | P 1 21/n 1 | 18.5126; 11.665; 20.9368 90; 113.769; 90 | 4137.79 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128487 | CIF | C37 H68 N5 Ni P Si2 | P b c a | 18.5935; 18.54; 24.548 90; 90; 90 | 8462.3 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128488 | CIF | C57 H88 B N5 Ni O0.5 P Si2 | P 1 21/n 1 | 12.0277; 24.3467; 20.1754 90; 93.369; 90 | 5897.85 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128489 | CIF | C63 H116 N8 Ni2 P2 Si4 | P -1 | 13.2496; 15.6628; 19.872 81.759; 74.827; 66.298 | 3641.1 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128490 | CIF | C52 H96 As2 N6 Ni Si4 | P b c n | 16.0818; 13.6449; 27.3122 90; 90; 90 | 5993.2 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128491 | CIF | C52 H98 As N7 Ni2 O Si2 | P -1 | 12.4971; 13.6791; 18.6705 75.272; 76.225; 80.498 | 2979.43 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128492 | CIF | C46 H90 As Li N7 Ni Si2 | P -1 | 15.7427; 18.018; 20.4069 91.496; 102.225; 103.698 | 5478.5 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128493 | CIF | C21 H20 B Li N | P 1 21/n 1 | 10.3572; 21.8676; 15.3918 90; 93.764; 90 | 3478.52 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128494 | CIF | C6 H18 As Li N2 | P 41 | 8.612; 8.612; 14.7393 90; 90; 90 | 1093.16 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128495 | CIF | C58 H110 N8 Ni Si4 | P 1 21/n 1 | 14.551; 16.6693; 26.9463 90; 101.511; 90 | 6404.5 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
| 4128496 | CIF | C23 H53 N O8 P2 Ru | P b c a | 12.463; 15.073; 32.221 90; 90; 90 | 6053 | Kar, Sayan; Sen, Raktim; Kothandaraman, Jotheeswari; Goeppert, Alain; Chowdhury, Ryan; Munoz, Socrates B.; Haiges, Ralf; Prakash, G. K. Surya Mechanistic Insights into Ruthenium-Pincer-Catalyzed Amine-Assisted Homogeneous Hydrogenation of CO<sub>2</sub> to Methanol. Journal of the American Chemical Society, 2019, 141, 3160-3170 |
| 4128497 | CIF | C31 H31 N O5 P2 Ru | P -1 | 8.6522; 12.368; 16.043 76.1; 83.249; 79.846 | 1635.3 | Kar, Sayan; Sen, Raktim; Kothandaraman, Jotheeswari; Goeppert, Alain; Chowdhury, Ryan; Munoz, Socrates B.; Haiges, Ralf; Prakash, G. K. Surya Mechanistic Insights into Ruthenium-Pincer-Catalyzed Amine-Assisted Homogeneous Hydrogenation of CO<sub>2</sub> to Methanol. Journal of the American Chemical Society, 2019, 141, 3160-3170 |
| 4128498 | CIF | C18 H19 N O3 | P b c n | 22.4623; 11.2375; 11.9368 90; 90; 90 | 3013.1 | Wu, Ju; Dou, Yingchao; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume Electrochemical Dearomative 2,3-Difunctionalization of Indoles. Journal of the American Chemical Society, 2019, 141, 2832-2837 |
| 4128499 | CIF | C23 H28 N2 O5 S | P -1 | 10.1411; 11.0449; 22.463 97.093; 96.892; 116.882 | 2182.6 | Wu, Ju; Dou, Yingchao; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume Electrochemical Dearomative 2,3-Difunctionalization of Indoles. Journal of the American Chemical Society, 2019, 141, 2832-2837 |
| 4128500 | CIF | C13 H15 N O3 | P n a 21 | 15.1003; 8.7723; 8.7236 90; 90; 90 | 1155.57 | Wu, Ju; Dou, Yingchao; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume Electrochemical Dearomative 2,3-Difunctionalization of Indoles. Journal of the American Chemical Society, 2019, 141, 2832-2837 |
| 4128501 | CIF | C28 H25 Cl2 N7 O | P 1 21/c 1 | 15.6062; 9.7091; 17.6166 90; 105.033; 90 | 2578 | Wu, Ju; Dou, Yingchao; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume Electrochemical Dearomative 2,3-Difunctionalization of Indoles. Journal of the American Chemical Society, 2019, 141, 2832-2837 |
| 4128502 | CIF | C20 H20 Br N O3 S | P 1 21/n 1 | 8.4325; 13.319; 16.3809 90; 99.593; 90 | 1814.1 | Wu, Ju; Dou, Yingchao; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume Electrochemical Dearomative 2,3-Difunctionalization of Indoles. Journal of the American Chemical Society, 2019, 141, 2832-2837 |
| 4128503 | CIF | C19 H23 N3 O2 S | P -1 | 7.8984; 10.0654; 11.7138 78.839; 74.149; 83.65 | 877.25 | Wu, Ju; Dou, Yingchao; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume Electrochemical Dearomative 2,3-Difunctionalization of Indoles. Journal of the American Chemical Society, 2019, 141, 2832-2837 |
| 4128504 | CIF | C19 H22 F N | P 1 21 1 | 8.4671; 11.6731; 16.0818 90; 100.441; 90 | 1563.16 | Pupo, Gabriele; Vicini, Anna Chiara; Ascough, David M. H.; Ibba, Francesco; Christensen, Kirsten E.; Thompson, Amber L.; Brown, John M.; Paton, Robert S.; Gouverneur, Véronique Hydrogen Bonding Phase-Transfer Catalysis with Potassium Fluoride: Enantioselective Synthesis of β-Fluoroamines. Journal of the American Chemical Society, 2019, 141, 2878-2883 |
| 4128505 | CIF | C19 H27 Cl F N O2 | P 1 21 1 | 13.4967; 18.0291; 15.8187 90; 107.072; 90 | 3679.6 | Pupo, Gabriele; Vicini, Anna Chiara; Ascough, David M. H.; Ibba, Francesco; Christensen, Kirsten E.; Thompson, Amber L.; Brown, John M.; Paton, Robert S.; Gouverneur, Véronique Hydrogen Bonding Phase-Transfer Catalysis with Potassium Fluoride: Enantioselective Synthesis of β-Fluoroamines. Journal of the American Chemical Society, 2019, 141, 2878-2883 |
| 4128506 | CIF | C19 H27 Cl F N O2 | P 1 21 1 | 8.8499; 17.9444; 12.0116 90; 99.75; 90 | 1879.96 | Pupo, Gabriele; Vicini, Anna Chiara; Ascough, David M. H.; Ibba, Francesco; Christensen, Kirsten E.; Thompson, Amber L.; Brown, John M.; Paton, Robert S.; Gouverneur, Véronique Hydrogen Bonding Phase-Transfer Catalysis with Potassium Fluoride: Enantioselective Synthesis of β-Fluoroamines. Journal of the American Chemical Society, 2019, 141, 2878-2883 |
| 4128507 | CIF | C19 H27 Cl F N O2 | P 1 21 1 | 13.4572; 17.9878; 15.8501 90; 107.078; 90 | 3667.6 | Pupo, Gabriele; Vicini, Anna Chiara; Ascough, David M. H.; Ibba, Francesco; Christensen, Kirsten E.; Thompson, Amber L.; Brown, John M.; Paton, Robert S.; Gouverneur, Véronique Hydrogen Bonding Phase-Transfer Catalysis with Potassium Fluoride: Enantioselective Synthesis of β-Fluoroamines. Journal of the American Chemical Society, 2019, 141, 2878-2883 |
| 4128508 | CIF | C44 H25 Cl4 N9 O9 | P -1 | 12.538; 18.879; 19.6252 91.044; 105.987; 106.771 | 4251.6 | Ma, Jian-Xin; Li, Jian; Chen, Yi-Fan; Ning, Rui; Ao, Yu-Fei; Liu, Jun-Min; Sun, Junliang; Wang, De-Xian; Wang, Qi-Qiang Cage Based Crystalline Covalent Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 3843-3848 |
| 4128509 | CIF | C78 H62 N12 O7 | P 1 21/n 1 | 13.9724; 29.8124; 16.4699 90; 108.05; 90 | 6522.9 | Ma, Jian-Xin; Li, Jian; Chen, Yi-Fan; Ning, Rui; Ao, Yu-Fei; Liu, Jun-Min; Sun, Junliang; Wang, De-Xian; Wang, Qi-Qiang Cage Based Crystalline Covalent Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 3843-3848 |
| 4128510 | CIF | C88 H104 O8 | P 1 21/c 1 | 18.4511; 7.8907; 13.3139 90; 108.175; 90 | 1841.69 | Thiyagarajan, Subramanian; Gunanathan, Chidambaram Catalytic Cross-Coupling of Secondary Alcohols. Journal of the American Chemical Society, 2019, 141, 3822-3827 |
| 4128511 | CIF | C304 N12 O108 Rh24 | P 4/m | 29.62; 29.62; 29.14 90; 90; 90 | 25566 | Carné-Sánchez, Arnau; Albalad, Jorge; Grancha, Thais; Imaz, Inhar; Juanhuix, Judith; Larpent, Patrick; Furukawa, Shuhei; Maspoch, Daniel Postsynthetic Covalent and Coordination Functionalization of Rhodium(II)-Based Metal-Organic Polyhedra. Journal of the American Chemical Society, 2019, 141, 4094-4102 |
| 4128512 | CIF | C272 H252 N20 O152 Rh24 | I 4/m | 31.08; 31.08; 31.25 90; 90; 90 | 30186 | Carné-Sánchez, Arnau; Albalad, Jorge; Grancha, Thais; Imaz, Inhar; Juanhuix, Judith; Larpent, Patrick; Furukawa, Shuhei; Maspoch, Daniel Postsynthetic Covalent and Coordination Functionalization of Rhodium(II)-Based Metal-Organic Polyhedra. Journal of the American Chemical Society, 2019, 141, 4094-4102 |
| 4128513 | CIF | C192 H96 O121 Rh24 | I m -3 m | 27.48; 27.48; 27.48 90; 90; 90 | 20752 | Carné-Sánchez, Arnau; Albalad, Jorge; Grancha, Thais; Imaz, Inhar; Juanhuix, Judith; Larpent, Patrick; Furukawa, Shuhei; Maspoch, Daniel Postsynthetic Covalent and Coordination Functionalization of Rhodium(II)-Based Metal-Organic Polyhedra. Journal of the American Chemical Society, 2019, 141, 4094-4102 |
| 4128514 | CIF | C60 H60 Cu17 N60 O12 | I a -3 d | 31.272; 31.272; 31.272 90; 90; 90 | 30582 | Li, Jia; Jiang, Lianyan; Chen, Sheng; Kirchon, Angelo; Li, Bao; Li, Yanshuo; Zhou, Hong-Cai Metal-Organic Framework Containing Planar Metal-Binding Sites: Efficiently and Cost-Effectively Enhancing the Kinetic Separation of C<sub>2</sub>H<sub>2</sub>/C<sub>2</sub>H<sub>4</sub>. Journal of the American Chemical Society, 2019, 141, 3807-3811 |
| 4128515 | CIF | C11 H11 N O | P 21 21 21 | 5.41264; 5.942; 26.9046 90; 90; 90 | 865.3 | Xing, Qi; Chan, Chun-Ming; Yeung, Yiu-Wai; Yu, Wing-Yiu Ruthenium(II)-Catalyzed Enantioselective γ-Lactams Formation by Intramolecular C-H Amidation of 1,4,2-Dioxazol-5-ones. Journal of the American Chemical Society, 2019, 141, 3849-3853 |
| 4128516 | CIF | C20 H30 O3 | P 21 21 21 | 8.3615; 19.6695; 21.2939 90; 90; 90 | 3502.13 | Dong, Liao-Bin; Zhang, Xiao; Rudolf, Jeffrey D.; Deng, Ming-Rong; Kalkreuter, Edward; Cepeda, Alexis J.; Renata, Hans; Shen, Ben Cryptic and Stereospecific Hydroxylation, Oxidation, and Reduction in Platensimycin and Platencin Biosynthesis. Journal of the American Chemical Society, 2019, 141, 4043-4050 |
| 4128517 | CIF | C20 H30 O4 | P 32 2 1 | 11.2006; 11.2006; 25.1011 90; 90; 120 | 2727.13 | Dong, Liao-Bin; Zhang, Xiao; Rudolf, Jeffrey D.; Deng, Ming-Rong; Kalkreuter, Edward; Cepeda, Alexis J.; Renata, Hans; Shen, Ben Cryptic and Stereospecific Hydroxylation, Oxidation, and Reduction in Platensimycin and Platencin Biosynthesis. Journal of the American Chemical Society, 2019, 141, 4043-4050 |
| 4128518 | CIF | C20 H30 O4 | P 1 21 1 | 7.2283; 11.3241; 10.6872 90; 92.941; 90 | 873.64 | Dong, Liao-Bin; Zhang, Xiao; Rudolf, Jeffrey D.; Deng, Ming-Rong; Kalkreuter, Edward; Cepeda, Alexis J.; Renata, Hans; Shen, Ben Cryptic and Stereospecific Hydroxylation, Oxidation, and Reduction in Platensimycin and Platencin Biosynthesis. Journal of the American Chemical Society, 2019, 141, 4043-4050 |
| 4128519 | CIF | C262 H220 B9 Cl F36 N31 Ni5 | C 1 2/c 1 | 45.589; 28.5973; 54.689 90; 121.371; 90 | 60876 | Zhang, Liang; Stephens, Alexander J.; Lemonnier, Jean-François; Pirvu, Lucian; Vitorica-Yrezabal, Iñigo J; Robinson, Christopher J.; Leigh, David A. Coordination Chemistry of a Molecular Pentafoil Knot. Journal of the American Chemical Society, 2019, 141, 3952-3958 |
| 4128520 | CIF | C260 H220 B9 Cl F36 N30 Zn5 | P 1 21/c 1 | 46.5552; 25.4416; 54.939 90; 108.29; 90 | 61784 | Zhang, Liang; Stephens, Alexander J.; Lemonnier, Jean-François; Pirvu, Lucian; Vitorica-Yrezabal, Iñigo J; Robinson, Christopher J.; Leigh, David A. Coordination Chemistry of a Molecular Pentafoil Knot. Journal of the American Chemical Society, 2019, 141, 3952-3958 |
| 4128521 | CIF | C275 H237 B9 Cl Co5 F36 N34 | P -1 | 22.1116; 28.081; 28.5729 61.443; 87.521; 67.458 | 14176 | Zhang, Liang; Stephens, Alexander J.; Lemonnier, Jean-François; Pirvu, Lucian; Vitorica-Yrezabal, Iñigo J; Robinson, Christopher J.; Leigh, David A. Coordination Chemistry of a Molecular Pentafoil Knot. Journal of the American Chemical Society, 2019, 141, 3952-3958 |
| 4128522 | CIF | C43 H52 Au Cl F3 N P | P 1 21 1 | 13.857; 10.761; 27.29 90; 98.089; 90 | 4028.9 | Cheng, Xinpeng; Wang, Zhixun; Quintanilla, Carlos D.; Zhang, Liming Chiral Bifunctional Phosphine Ligand Enabling Gold-Catalyzed Asymmetric Isomerization of Alkyne to Allene and Asymmetric Synthesis of 2,5-Dihydrofuran. Journal of the American Chemical Society, 2019, 141, 3787-3791 |
| 4128523 | CIF | C43 H55 Au Cl F3 N P | P 1 21 1 | 12.81; 10.578; 14.298 90; 99.99; 90 | 1908 | Cheng, Xinpeng; Wang, Zhixun; Quintanilla, Carlos D.; Zhang, Liming Chiral Bifunctional Phosphine Ligand Enabling Gold-Catalyzed Asymmetric Isomerization of Alkyne to Allene and Asymmetric Synthesis of 2,5-Dihydrofuran. Journal of the American Chemical Society, 2019, 141, 3787-3791 |
| 4128524 | CIF | Cs2 F16 Mn U3 | P 63/m m c | 8.0135; 8.0135; 13.1776 90; 90; 120 | 732.84 | Klepov, Vladislav V.; Pace, Kristen A.; Calder, Stuart; Felder, Justin B.; Loye, Hans-Conrad Zur 3d-Metal Induced Magnetic Ordering on U(IV) Atoms as a Route toward U(IV) Magnetic Materials. Journal of the American Chemical Society, 2019, 141, 3838-3842 |
| 4128525 | CIF | Cs2 F16 U3 Zn | P 63/m m c | 7.9849; 7.9849; 12.9721 90; 90; 120 | 716.28 | Klepov, Vladislav V.; Pace, Kristen A.; Calder, Stuart; Felder, Justin B.; Loye, Hans-Conrad Zur 3d-Metal Induced Magnetic Ordering on U(IV) Atoms as a Route toward U(IV) Magnetic Materials. Journal of the American Chemical Society, 2019, 141, 3838-3842 |
| 4128526 | CIF | Cs2 F16 Ni U3 | P 63/m m c | 7.9778; 7.9778; 12.9039 90; 90; 120 | 711.24 | Klepov, Vladislav V.; Pace, Kristen A.; Calder, Stuart; Felder, Justin B.; Loye, Hans-Conrad Zur 3d-Metal Induced Magnetic Ordering on U(IV) Atoms as a Route toward U(IV) Magnetic Materials. Journal of the American Chemical Society, 2019, 141, 3838-3842 |
| 4128527 | CIF | Co Cs2 F16 U3 | P 63/m m c | 7.9891; 7.9891; 13.006 90; 90; 120 | 718.903 | Klepov, Vladislav V.; Pace, Kristen A.; Calder, Stuart; Felder, Justin B.; Loye, Hans-Conrad Zur 3d-Metal Induced Magnetic Ordering on U(IV) Atoms as a Route toward U(IV) Magnetic Materials. Journal of the American Chemical Society, 2019, 141, 3838-3842 |
| 4128528 | CIF | Cs2 F16 Mg U3 | P 63/m m c | 7.9753; 7.9753; 12.8826 90; 90; 120 | 709.62 | Klepov, Vladislav V.; Pace, Kristen A.; Calder, Stuart; Felder, Justin B.; Loye, Hans-Conrad Zur 3d-Metal Induced Magnetic Ordering on U(IV) Atoms as a Route toward U(IV) Magnetic Materials. Journal of the American Chemical Society, 2019, 141, 3838-3842 |
| 4128529 | CIF | C30 H27 F3 Ir N | P -1 | 10.0758; 15.6498; 16.5383 75.2367; 87.6486; 87.6424 | 2518.34 | Kim, Jinwoo; Shin, Kwangmin; Jin, Seongho; Kim, Dongwook; Chang, Sukbok Oxidatively Induced Reductive Elimination: Exploring the Scope and Catalyst Systems with Ir, Rh, and Ru Complexes. Journal of the American Chemical Society, 2019, 141, 4137-4146 |
| 4128530 | CIF | C24 H26 N Rh | P n m a | 7.7219; 15.438; 16.476 90; 90; 90 | 1964.1 | Kim, Jinwoo; Shin, Kwangmin; Jin, Seongho; Kim, Dongwook; Chang, Sukbok Oxidatively Induced Reductive Elimination: Exploring the Scope and Catalyst Systems with Ir, Rh, and Ru Complexes. Journal of the American Chemical Society, 2019, 141, 4137-4146 |
| 4128531 | CIF | C30 H26 F3 N Ru | P 1 21/n 1 | 11.4269; 13.8051; 15.1312 90; 90.052; 90 | 2386.9 | Kim, Jinwoo; Shin, Kwangmin; Jin, Seongho; Kim, Dongwook; Chang, Sukbok Oxidatively Induced Reductive Elimination: Exploring the Scope and Catalyst Systems with Ir, Rh, and Ru Complexes. Journal of the American Chemical Society, 2019, 141, 4137-4146 |
| 4128532 | CIF | C30 H27 F3 N Rh | P -1 | 10.0608; 15.6796; 16.4999 75.5893; 87.1754; 87.4635 | 2516.51 | Kim, Jinwoo; Shin, Kwangmin; Jin, Seongho; Kim, Dongwook; Chang, Sukbok Oxidatively Induced Reductive Elimination: Exploring the Scope and Catalyst Systems with Ir, Rh, and Ru Complexes. Journal of the American Chemical Society, 2019, 141, 4137-4146 |
| 4128533 | CIF | H4 Li2 N Na O8 S2 | C 1 2 1 | 27.7435; 4.9525; 8.2103 90; 91.246; 90 | 1127.83 | Li, Yanqiang; Liang, Fei; Zhao, Sangen; Li, Lina; Wu, Zhenyue; Ding, Qingran; Liu, Shuai; Lin, Zheshuai; Hong, Maochun; Luo, Junhua Two Non-π-Conjugated Deep-UV Nonlinear Optical Sulfates. Journal of the American Chemical Society, 2019, 141, 3833-3837 |
| 4128534 | CIF | H8 Li9 N2 Na3 O28 S7 | P 63 | 12.1271; 12.1271; 4.8365 90; 90; 120 | 615.99 | Li, Yanqiang; Liang, Fei; Zhao, Sangen; Li, Lina; Wu, Zhenyue; Ding, Qingran; Liu, Shuai; Lin, Zheshuai; Hong, Maochun; Luo, Junhua Two Non-π-Conjugated Deep-UV Nonlinear Optical Sulfates. Journal of the American Chemical Society, 2019, 141, 3833-3837 |
| 4128535 | CIF | C17 H44 N10 O11 | P 1 21/c 1 | 17.825; 8.2502; 20.6233 90; 108.527; 90 | 2875.68 | Shi, Ming W.; Thomas, Sajesh P.; Hathwar, Venkatesha R.; Edwards, Alison J.; Piltz, Ross O.; Jayatilaka, Dylan; Koutsantonis, George A.; Overgaard, Jacob; Nishibori, Eiji; Iversen, Bo B.; Spackman, Mark A. Measurement of Electric Fields Experienced by Urea Guest Molecules in the 18-Crown-6/Urea (1:5) Host-Guest Complex: An Experimental Reference Point for Electric-Field-Assisted Catalysis. Journal of the American Chemical Society, 2019, 141, 3965-3976 |
| 4128536 | CIF | C17 H44 N10 O11 | P 1 21/c 1 | 17.825; 8.2502; 20.6233 90; 108.527; 90 | 2875.68 | Shi, Ming W.; Thomas, Sajesh P.; Hathwar, Venkatesha R.; Edwards, Alison J.; Piltz, Ross O.; Jayatilaka, Dylan; Koutsantonis, George A.; Overgaard, Jacob; Nishibori, Eiji; Iversen, Bo B.; Spackman, Mark A. Measurement of Electric Fields Experienced by Urea Guest Molecules in the 18-Crown-6/Urea (1:5) Host-Guest Complex: An Experimental Reference Point for Electric-Field-Assisted Catalysis. Journal of the American Chemical Society, 2019, 141, 3965-3976 |
| 4128537 | CIF | C8 H24 Br7 Cs N2 Pb2 | C m c e | 39.75; 8.2718; 8.2733 90; 90; 90 | 2720.3 | Wu, Zhenyue; Liu, Xitao; Ji, Chengmin; Li, Lina; Wang, Sasa; Peng, Yu; Tao, Kewen; Sun, Zhihua; Hong, Maochun; Luo, Junhua Discovery of an Above-Room-Temperature Antiferroelectric in Two-Dimensional Hybrid Perovskite. Journal of the American Chemical Society, 2019, 141, 3812-3816 |
| 4128538 | CIF | C8 H24 Br7 Cs N2 Pb2 | P m n b | 39.342; 8.2081; 8.3092 90; 90; 90 | 2683.2 | Wu, Zhenyue; Liu, Xitao; Ji, Chengmin; Li, Lina; Wang, Sasa; Peng, Yu; Tao, Kewen; Sun, Zhihua; Hong, Maochun; Luo, Junhua Discovery of an Above-Room-Temperature Antiferroelectric in Two-Dimensional Hybrid Perovskite. Journal of the American Chemical Society, 2019, 141, 3812-3816 |
| 4128539 | CIF | C10 H16 Fe2 N S4 | I 41/a :2 | 17.1853; 17.1853; 20.4819 90; 90; 90 | 6049.01 | Horwitz, Noah E.; Xie, Jiaze; Filatov, Alexander S.; Papoular, Robert J.; Shepard, William E.; Zee, David Z.; Grahn, Mia P.; Gilder, Chloe; Anderson, John S. Redox-Active 1D Coordination Polymers of Iron-Sulfur Clusters. Journal of the American Chemical Society, 2019, 141, 3940-3951 |
| 4128540 | CIF | C22 H40 Fe2 N S4 | P 42 c m | 11.92662; 11.92662; 19.8484 90; 90; 90 | 2823.32 | Horwitz, Noah E.; Xie, Jiaze; Filatov, Alexander S.; Papoular, Robert J.; Shepard, William E.; Zee, David Z.; Grahn, Mia P.; Gilder, Chloe; Anderson, John S. Redox-Active 1D Coordination Polymers of Iron-Sulfur Clusters. Journal of the American Chemical Society, 2019, 141, 3940-3951 |
| 4128541 | CIF | C45 H28 Cl6 O6 | P 21 21 21 | 9.093; 19.7; 21.859 90; 90; 90 | 3915.6 | Takaishi, Kazuto; Hinoide, Sakiko; Matsumoto, Tomoki; Ema, Tadashi Axially Chiral <i>peri</i>-Xanthenoxanthenes as a Circularly Polarized Luminophore. Journal of the American Chemical Society, 2019, 141, 11852-11857 |
| 4128542 | CIF | C42 H22 O6 | P 1 21 1 | 8.2394; 28.4962; 12.2667 90; 90.028; 90 | 2880.1 | Takaishi, Kazuto; Hinoide, Sakiko; Matsumoto, Tomoki; Ema, Tadashi Axially Chiral <i>peri</i>-Xanthenoxanthenes as a Circularly Polarized Luminophore. Journal of the American Chemical Society, 2019, 141, 11852-11857 |
| 4128543 | CIF | C24 H20 Cl2 O4 S | P -1 | 8.331; 11.358; 12.437 95.499; 103.944; 90.227 | 1136.5 | Meng, Lingkui; Wu, Peng; Fang, Jing; Xiao, Ying; Xiao, Xiong; Tu, Guangsheng; Ma, Xiang; Teng, Shuang; Zeng, Jing; Wan, Qian Glycosylation Enabled by Successive Rhodium(II) and Brønsted Acid Catalysis. Journal of the American Chemical Society, 2019, 141, 11775-11780 |
| 4128544 | CIF | C143.99 H119.99 Cl6 N12 O40 Zr12 | F m -3 m | 43.026; 43.026; 43.026 90; 90; 90 | 79651.3 | Liu, Jinjin; Duan, Wenjie; Song, Jie; Guo, Xiuxiu; Wang, Zhifang; Shi, Xinlei; Liang, Jiajie; Wang, Juan; Cheng, Peng; Chen, Yao; Zaworotko, Michael J.; Zhang, Zhenjie Self-Healing Hyper-Cross-Linked Metal-Organic Polyhedra (HCMOPs) Membranes with Antimicrobial Activity and Highly Selective Separation Properties. Journal of the American Chemical Society, 2019, 141, 12064-12070 |
| 4128545 | CIF | C52 H66 B2 Fe2 N8 | P -1 | 10.8558; 13.0976; 19.9752 72.7024; 89.0943; 68.2116 | 2503.64 | Hickey, Anne K.; Greer, Samuel M.; Valdez-Moreira, Juan A; Lutz, Sean A.; Pink, Maren; DeGayner, Jordan A.; Harris, T. David; Hill, Stephen; Telser, Joshua; Smith, Jeremy M. A Dimeric Hydride-Bridged Complex with Geometrically Distinct Iron Centers Giving Rise to an <i>S</i> = 3 Ground State. Journal of the American Chemical Society, 2019, 141, 11970-11975 |
| 4128546 | CIF | C21 H28 B F3 O2 | P 1 | 6.7306; 9.662; 16.8578 95.475; 98.967; 106.855 | 1024.84 | Sun, Yu; Zhou, Yuebiao; Shi, Ying; Del Pozo, Juan; Torker, Sebastian; Hoveyda, Amir H. Copper-Hydride-Catalyzed Enantioselective Processes with Allenyl Boronates. Mechanistic Nuances, Scope, and Utility in Target-Oriented Synthesis. Journal of the American Chemical Society, 2019, 141, 12087-12099 |
| 4128547 | CIF | C38 H57 B Cu N2 O2.5 | P 1 21/c 1 | 10.458; 25.05; 15.77 90; 107.96; 90 | 3930 | Sun, Yu; Zhou, Yuebiao; Shi, Ying; Del Pozo, Juan; Torker, Sebastian; Hoveyda, Amir H. Copper-Hydride-Catalyzed Enantioselective Processes with Allenyl Boronates. Mechanistic Nuances, Scope, and Utility in Target-Oriented Synthesis. Journal of the American Chemical Society, 2019, 141, 12087-12099 |
| 4128548 | CIF | C28 H25 N3 Ni O2 S | P 1 21/n 1 | 7.2268; 33.721; 9.7279 90; 96.327; 90 | 2356.2 | Ravn, Anne K.; Vilstrup, Maria B. T.; Noerby, Peter; Nielsen, Dennis U.; Daasbjerg, Kim; Skrydstrup, Troels Carbon Isotope Labeling Strategy for β-Amino Acid Derivatives via Carbonylation of Azanickellacycles. Journal of the American Chemical Society, 2019, 141, 11821-11826 |
| 4128549 | CIF | C29 H25 N3 Ni O3 S | P -1 | 10.6334; 10.7865; 11.1203 84.176; 83.985; 71.067 | 1196.73 | Ravn, Anne K.; Vilstrup, Maria B. T.; Noerby, Peter; Nielsen, Dennis U.; Daasbjerg, Kim; Skrydstrup, Troels Carbon Isotope Labeling Strategy for β-Amino Acid Derivatives via Carbonylation of Azanickellacycles. Journal of the American Chemical Society, 2019, 141, 11821-11826 |
| 4128550 | CIF | Ba2 P6 Si3 | P n a 21 | 9.6272; 9.1437; 11.9261 90; 90; 90 | 1049.83 | Mark, Justin; Wang, Jian; Wu, Kui; Lo, Jeane Gladys; Lee, Shannon; Kovnir, Kirill Ba<sub>2</sub>Si<sub>3</sub>P<sub>6</sub>: 1D Nonlinear Optical Material with Thermal Barrier Chains. Journal of the American Chemical Society, 2019, 141, 11976-11983 |
| 4128551 | CIF | C176 H212 Au25 N55 S18 | R -3 :H | 34.623; 34.623; 15.731 90; 90; 120 | 16331 | Gunawardene, Praveen N.; Corrigan, John F.; Workentin, Mark S. Golden Opportunity: A Clickable Azide-Functionalized [Au<sub>25</sub>(SR)<sub>18</sub>]<sup>-</sup> Nanocluster Platform for Interfacial Surface Modifications. Journal of the American Chemical Society, 2019, 141, 11781-11785 |
| 4128552 | CIF | C59 H76 Cl2 O10 | P b c n | 42.9147; 15.7637; 16.3301 90; 90; 90 | 11047.2 | Zhou, Yujuan; Jie, Kecheng; Zhao, Run; Huang, Feihe <i>Cis</i>-<i>Trans</i> Selectivity of Haloalkene Isomers in Nonporous Adaptive Pillararene Crystals. Journal of the American Chemical Society, 2019, 141, 11847-11851 |
| 4128553 | CIF | C35 H45 Cl O6 | P 1 21/n 1 | 11.365; 13.1318; 21.8808 90; 91.274; 90 | 3264.75 | Zhou, Yujuan; Jie, Kecheng; Zhao, Run; Huang, Feihe <i>Cis</i>-<i>Trans</i> Selectivity of Haloalkene Isomers in Nonporous Adaptive Pillararene Crystals. Journal of the American Chemical Society, 2019, 141, 11847-11851 |
| 4128554 | CIF | C59 H76 Cl2 O10 | P b c n | 43.026; 15.8064; 16.2928 90; 90; 90 | 11080.5 | Zhou, Yujuan; Jie, Kecheng; Zhao, Run; Huang, Feihe <i>Cis</i>-<i>Trans</i> Selectivity of Haloalkene Isomers in Nonporous Adaptive Pillararene Crystals. Journal of the American Chemical Society, 2019, 141, 11847-11851 |
| 4128555 | CIF | C78 H102 Cl3 O12 | C 1 2/c 1 | 26.441; 12.5644; 25.776 90; 120.301; 90 | 7393 | Zhou, Yujuan; Jie, Kecheng; Zhao, Run; Huang, Feihe <i>Cis</i>-<i>Trans</i> Selectivity of Haloalkene Isomers in Nonporous Adaptive Pillararene Crystals. Journal of the American Chemical Society, 2019, 141, 11847-11851 |
| 4128556 | CIF | C16 H21 N O3 | I 1 a 1 | 22.174; 10.4504; 28.6661 90; 111.129; 90 | 6196.1 | Lei, Honghui; Conway, Jr, John H; Cook, Caleb C.; Rovis, Tomislav Ligand Controlled Ir-Catalyzed Regiodivergent Oxyamination of Unactivated Alkenes. Journal of the American Chemical Society, 2019, 141, 11864-11869 |
| 4128557 | CIF | C6 H11 N O2 | P 1 21/n 1 | 4.5734; 9.8222; 15.0672 90; 94.519; 90 | 674.73 | Lei, Honghui; Conway, Jr, John H; Cook, Caleb C.; Rovis, Tomislav Ligand Controlled Ir-Catalyzed Regiodivergent Oxyamination of Unactivated Alkenes. Journal of the American Chemical Society, 2019, 141, 11864-11869 |
| 4128558 | CIF | C6 H10 Br N O | P -1 | 5.9616; 7.0596; 9.5102 70.172; 89.251; 79.122 | 369.19 | Lei, Honghui; Conway, Jr, John H; Cook, Caleb C.; Rovis, Tomislav Ligand Controlled Ir-Catalyzed Regiodivergent Oxyamination of Unactivated Alkenes. Journal of the American Chemical Society, 2019, 141, 11864-11869 |
| 4128559 | CIF | C9 H16 N4 O4 | P 21 21 21 | 8.3359; 11.5375; 11.8279 90; 90; 90 | 1137.55 | Zhang, Weicheng; Pal, Ayan; Ricardo, Alonso; Szostak, Jack W. Template-Directed Nonenzymatic Primer Extension Using 2-Methylimidazole-Activated Morpholino Derivatives of Guanosine and Cytidine. Journal of the American Chemical Society, 2019, 141, 12159-12166 |
| 4128560 | CIF | C40 H68 N24 O18 | P 1 21 1 | 8.38505; 36.0429; 8.62496 90; 98.4463; 90 | 2578.38 | Zhang, Weicheng; Pal, Ayan; Ricardo, Alonso; Szostak, Jack W. Template-Directed Nonenzymatic Primer Extension Using 2-Methylimidazole-Activated Morpholino Derivatives of Guanosine and Cytidine. Journal of the American Chemical Society, 2019, 141, 12159-12166 |
| 4128561 | CIF | C336 H348 Ag40 P8 S24 | P 4 n c | 29.9757; 29.9757; 25.6092 90; 90; 90 | 23011 | Yuan, Xiting; Sun, Cunfa; Li, Xihua; Malola, Sami; Teo, Boon K.; Häkkinen, Hannu; Zheng, Lan-Sun; Zheng, Nanfeng Combinatorial Identification of Hydrides in a Ligated Ag<sub>40</sub> Nanocluster with Noncompact Metal Core. Journal of the American Chemical Society, 2019, 141, 11905-11911 |
| 4128562 | CIF | C40 H38 Au Cl F12 N P | P 1 21 1 | 9.3985; 35.4184; 11.55526 90; 90.1733; 90 | 3846.5 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128563 | CIF | C114.5 H94 Au2 B Cl F48 N2 P2 | P 1 21 1 | 13.4203; 18.534; 24.6963 90; 103.767; 90 | 5966.3 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128564 | CIF | C54.4 H69.4 Au Cl3.4 N O1.3 P | C 1 2 1 | 24.0901; 12.5656; 17.3127 90; 93.747; 90 | 5229.47 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128565 | CIF | C21 H24 O3 | P 1 21 1 | 11.051; 5.95087; 13.0137 90; 96.926; 90 | 849.58 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128566 | CIF | C22.25 H27 O3 | P -1 | 10.6353; 13.0254; 15.5365 107.834; 104.675; 98.9253 | 1917.66 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128567 | CIF | C27 H38 O6 | P n a 21 | 17.5452; 11.4903; 24.4692 90; 90; 90 | 4933 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128568 | CIF | C20 H22 O3 | P 1 21/n 1 | 13.3067; 7.852; 17.2035 90; 107.407; 90 | 1715.18 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128569 | CIF | C27 H30 O2 | P 1 21 1 | 10.9819; 8.2059; 12.0674 90; 102.146; 90 | 1063.13 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128570 | CIF | C107.95 H109.9 Au2 Cl2.4 F24 N2 O0.25 P2 | P 1 | 14.6354; 14.6996; 14.9478 108.499; 118.729; 96.102 | 2541.4 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128571 | CIF | C54.9 H53.5 Au Cl1.3 F15 N P | P 1 | 14.4908; 14.6376; 15.2041 66.7066; 61.5893; 83.9903 | 2591.4 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128572 | CIF | C36 H42 Fe O6 | P 1 | 9.2294; 9.5235; 9.8268 76.3219; 66.9921; 89.3666 | 769.28 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128573 | CIF | C52 H50 Au Cl F12 N P | I 1 2/a 1 | 19.752; 10.2926; 46.4258 90; 94.082; 90 | 9414.4 | Zuccarello, Giuseppe; Mayans, Joan G.; Escofet, Imma; Scharnagel, Dagmar; Kirillova, Mariia S.; Pérez-Jimeno, Alba H; Calleja, Pilar; Boothe, Jordan R.; Echavarren, Antonio M. Enantioselective Folding of Enynes by Gold(I) Catalysts with a Remote <i>C</i><sub>2</sub>-Chiral Element. Journal of the American Chemical Society, 2019, 141, 11858-11863 |
| 4128574 | CIF | C92 H80 As8 F48 N20 O2 Pd4 | C 1 2/c 1 | 52.893; 8.1609; 38.856 90; 132.39; 90 | 12388 | Lavendomme, Roy; Ronson, Tanya K.; Nitschke, Jonathan R. Metal and Organic Templates Together Control the Size of Covalent Macrocycles and Cages. Journal of the American Chemical Society, 2019, 141, 12147-12158 |
| 4128575 | CIF | C243 H178.25 B F70 N35.25 O19 Pd6 Sb11 | P -1 | 21.9773; 22.3335; 34.7471 107.703; 91.695; 116.031 | 14331.9 | Lavendomme, Roy; Ronson, Tanya K.; Nitschke, Jonathan R. Metal and Organic Templates Together Control the Size of Covalent Macrocycles and Cages. Journal of the American Chemical Society, 2019, 141, 12147-12158 |
| 4128576 | CIF | C138 H102 As6 Cl6 F36 N22 Pd6 | C m c m | 21.948; 30.273; 31.103 90; 90; 90 | 20666 | Lavendomme, Roy; Ronson, Tanya K.; Nitschke, Jonathan R. Metal and Organic Templates Together Control the Size of Covalent Macrocycles and Cages. Journal of the American Chemical Society, 2019, 141, 12147-12158 |
| 4128577 | CIF | C48 H48 Cl8 Fe3 O6 | P -1 | 11.2263; 11.4866; 12.2107 68.513; 67.287; 70.345 | 1316.2 | Hanson, Carly S.; Psaltakis, Mary C.; Cortes, Janiel J.; Devery, 3rd, James J Catalyst Behavior in Metal-Catalyzed Carbonyl-Olefin Metathesis. Journal of the American Chemical Society, 2019, 141, 11870-11880 |
| 4128578 | CIF | C28 H24 Cl6 Fe2 O4 | P -1 | 10.4909; 11.3351; 13.476 93.2595; 92.3269; 94.7368 | 1592.79 | Hanson, Carly S.; Psaltakis, Mary C.; Cortes, Janiel J.; Devery, 3rd, James J Catalyst Behavior in Metal-Catalyzed Carbonyl-Olefin Metathesis. Journal of the American Chemical Society, 2019, 141, 11870-11880 |
| 4128579 | CIF | C18 H36 Cl8 Fe3 O6 | P 1 21/n 1 | 9.176; 18.7713; 10.2557 90; 91.1083; 90 | 1766.17 | Hanson, Carly S.; Psaltakis, Mary C.; Cortes, Janiel J.; Devery, 3rd, James J Catalyst Behavior in Metal-Catalyzed Carbonyl-Olefin Metathesis. Journal of the American Chemical Society, 2019, 141, 11870-11880 |
| 4128580 | CIF | C252 H242 Co24 N12 O109 | F m -3 m | 39.887; 39.887; 39.887 90; 90; 90 | 63459 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128581 | CIF | C324 H360 Mo24 N12 O102 | P 1 21/n 1 | 29.526; 29.7496; 42.4158 90; 90.473; 90 | 37256 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128582 | CIF | C71.24 H45.4 D10.4 Fe4 N3.3 O23.22 | F m -3 m | 40.3; 40.3; 40.3 90; 90; 90 | 65451 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128583 | CIF | C39.13 H22.5 D19.49 Fe2 N1.65 O11.61 | F m -3 m | 40.237; 40.237; 40.237 90; 90; 90 | 65144 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128584 | CIF | C32.76 H17.52 Co2 D22.9 N1.38 O11.4 | F m -3 m | 39.85; 39.85; 39.85 90; 90; 90 | 63283 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128585 | CIF | C30.07 H17.52 Co2 D12.18 N1.38 O11.4 | F m -3 m | 39.86; 39.86; 39.86 90; 90; 90 | 63330 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128586 | CIF | C36.89 H22.5 D10.52 Fe2 N1.65 O11.61 | F m -3 m | 40.233; 40.233; 40.233 90; 90; 90 | 65125 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128587 | CIF | C28.19 H19.74 Co2 D9.07 N1.38 O10.65 | F m -3 m | 39.857; 39.857; 39.857 90; 90; 90 | 63316 | Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. Understanding Gas Storage in Cuboctahedral Porous Coordination Cages. Journal of the American Chemical Society, 2019, 141, 12128-12138 |
| 4128588 | CIF | C35 H45 N3 | P -1 | 10.8286; 11.9086; 12.5098 81.132; 76.324; 66.007 | 1428.95 | Kieser, Jerod M.; Kinney, Zacharias J.; Gaffen, Joshua R.; Evariste, Sloane; Harrison, Alexandra M.; Rheingold, Arnold L.; Protasiewicz, John D. Three Ways Isolable Carbenes Can Modulate Emission of NH-Containing Fluorophores. Journal of the American Chemical Society, 2019, 141, 12055-12063 |
| 4128589 | CIF | C39 H45 N3 | C 1 c 1 | 23.3219; 9.3633; 17.7798 90; 122.646; 90 | 3269.2 | Kieser, Jerod M.; Kinney, Zacharias J.; Gaffen, Joshua R.; Evariste, Sloane; Harrison, Alexandra M.; Rheingold, Arnold L.; Protasiewicz, John D. Three Ways Isolable Carbenes Can Modulate Emission of NH-Containing Fluorophores. Journal of the American Chemical Society, 2019, 141, 12055-12063 |
| 4128590 | CIF | C34 H44 N2 | P -1 | 9.3881; 9.6798; 15.74 104.169; 90.296; 98.022 | 1372.13 | Kieser, Jerod M.; Kinney, Zacharias J.; Gaffen, Joshua R.; Evariste, Sloane; Harrison, Alexandra M.; Rheingold, Arnold L.; Protasiewicz, John D. Three Ways Isolable Carbenes Can Modulate Emission of NH-Containing Fluorophores. Journal of the American Chemical Society, 2019, 141, 12055-12063 |
| 4128591 | CIF | C40 H46 N4 | P -1 | 16.6802; 22.0707; 29.4908 106.262; 94.104; 100.781 | 10149.7 | Kieser, Jerod M.; Kinney, Zacharias J.; Gaffen, Joshua R.; Evariste, Sloane; Harrison, Alexandra M.; Rheingold, Arnold L.; Protasiewicz, John D. Three Ways Isolable Carbenes Can Modulate Emission of NH-Containing Fluorophores. Journal of the American Chemical Society, 2019, 141, 12055-12063 |
| 4128592 | CIF | C57 H44 Cl2 O2 | P -1 | 11.17; 12.9671; 15.7532 95.063; 97.091; 91.364 | 2254.1 | Liu, Junzhi; Mishra, Shantanu; Pignedoli, Carlo A.; Passerone, Daniele; Urgel, José I; Fabrizio, Alberto; Lohr, Thorsten G.; Ma, Ji; Komber, Hartmut; Baumgarten, Martin; Corminboeuf, Clémence; Berger, Reinhard; Ruffieux, Pascal; Müllen, Klaus; Fasel, Roman; Feng, Xinliang Open-Shell Nonbenzenoid Nanographenes Containing Two Pairs of Pentagonal and Heptagonal Rings. Journal of the American Chemical Society, 2019, 141, 12011-12020 |
| 4128593 | CIF | C132 H180 F12 N4 O16 P8 Pt4 S4 | P -1 | 12.0369; 15.4579; 22.539 85.802; 74.887; 82.736 | 4012.6 | Shi, Bingbing; Zhou, Zhixuan; Vanderlinden, Ryan T.; Tang, Jian-Hong; Yu, Guocan; Acharyya, Koushik; Sepehrpour, Hajar; Stang, Peter J. Spontaneous Supramolecular Polymerization Driven by Discrete Platinum Metallacycle-Based Host-Guest Complexation. Journal of the American Chemical Society, 2019, 141, 11837-11841 |
| 4128594 | CIF | C16 H18 Cl N O5 | P 1 21 1 | 8.1884; 8.7282; 11.6015 90; 97.533; 90 | 822 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128595 | CIF | C17 H21 N O5 | P 1 21 1 | 10.802; 13.4468; 12.4893 90; 111.444; 90 | 1688.52 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128596 | CIF | C16 H18 N2 O7 | P 21 21 21 | 10.449; 19.9438; 23.4389 90; 90; 90 | 4884.5 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128597 | CIF | C16 H18 Cl N O5 | P 21 21 21 | 7.9095; 12.5033; 16.0063 90; 90; 90 | 1582.94 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128598 | CIF | C20 H19 N O5 | P 21 21 21 | 8.4176; 16.5025; 25.2215 90; 90; 90 | 3503.6 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128599 | CIF | C16 H23 N O3 | P 21 21 21 | 7.7728; 10.0844; 19.1537 90; 90; 90 | 1501.34 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128600 | CIF | C16 H18 Br N O5 | P 21 21 21 | 7.9491; 12.798; 15.8009 90; 90; 90 | 1607.47 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128601 | CIF | C16 H18 N2 O7 | P 1 21 1 | 7.8665; 20.7338; 10.0786 90; 90.438; 90 | 1643.8 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128602 | CIF | C14 H17 N O5 | P 1 21 1 | 10.2919; 5.9783; 11.3506 90; 98.101; 90 | 691.41 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128603 | CIF | C16 H21 N O5 | P 1 21 1 | 12.9997; 7.5607; 17.0068 90; 111.408; 90 | 1556.22 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128604 | CIF | C16 H18 Br N O5 | P 1 21 1 | 8.0024; 8.9423; 11.7925 90; 99.172; 90 | 833.08 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128605 | CIF | C17 H21 N O5 | P 21 21 21 | 8.0194; 12.4357; 16.2639 90; 90; 90 | 1621.95 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128606 | CIF | C59 H73 Cu F3 N2 O10 S | P 21 21 21 | 10.1253; 16.2847; 34.7577 90; 90; 90 | 5731.1 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128607 | CIF | C17 H20 Cl N O5 | C 1 2 1 | 21.5588; 9.6915; 18.4478 90; 111.05; 90 | 3597.2 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128608 | CIF | C17 H21 N O5 | P 21 21 21 | 9.4138; 9.5283; 18.5945 90; 90; 90 | 1667.88 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128609 | CIF | C16 H19 N O5 | P 1 21 1 | 8.3697; 8.4872; 10.8138 90; 93.883; 90 | 766.4 | Willig, Felix; Lang, Johannes; Hans, Andreas C.; Ringenberg, Mark R.; Pfeffer, Daniel; Frey, Wolfgang; Peters, René Polyfunctional Imidazolium Aryloxide Betaine/Lewis Acid Catalysts as Tools for the Asymmetric Synthesis of Disfavored Diastereomers. Journal of the American Chemical Society, 2019, 141, 12029-12043 |
| 4128610 | CIF | C102 H90 Br6 F6 N1.5 Np18 O78 | P 6/m | 20.525; 20.525; 18.668 90; 90; 120 | 6810.7 | Gilson, Sara E.; Li, Peng; Szymanowski, Jennifer E. S.; White, Jacob; Ray, Debmalya; Gagliardi, Laura; Farha, Omar K.; Burns, Peter C. In Situ Formation of Unprecedented Neptunium-Oxide Wheel Clusters Stabilized in a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 11842-11846 |
| 4128611 | CIF | C102 H90 F6 Np18 O78 | P 6/m | 20.835; 20.835; 18.453 90; 90; 120 | 6937 | Gilson, Sara E.; Li, Peng; Szymanowski, Jennifer E. S.; White, Jacob; Ray, Debmalya; Gagliardi, Laura; Farha, Omar K.; Burns, Peter C. In Situ Formation of Unprecedented Neptunium-Oxide Wheel Clusters Stabilized in a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 11842-11846 |
| 4128612 | CIF | C1.34 H1.18 F0.08 N0.04 Np0.24 O1.05 | P 6/m | 20.719; 20.719; 18.477 90; 90; 120 | 6869 | Gilson, Sara E.; Li, Peng; Szymanowski, Jennifer E. S.; White, Jacob; Ray, Debmalya; Gagliardi, Laura; Farha, Omar K.; Burns, Peter C. In Situ Formation of Unprecedented Neptunium-Oxide Wheel Clusters Stabilized in a Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 11842-11846 |
| 4128613 | CIF | C10 H28 Cl14 N4 Pb5 | C 2 2 21 | 10.7997; 18.2694; 16.827 90; 90; 90 | 3320 | Peng, Yu; Li, Lina; Ji, Chengmin; Wu, Zhenyue; Wang, Sasa; Liu, Xitao; Yao, Yunpeng; Luo, Junhua Tailored Synthesis of an Unprecedented Pb-Mn Heterometallic Halide Hybrid with Enhanced Emission. Journal of the American Chemical Society, 2019, 141, 12197-12201 |
| 4128614 | CIF | C10 H28 Cl14 Mn N4 Pb4 | P 21 21 21 | 10.3435; 16.9247; 18.366 90; 90; 90 | 3215.16 | Peng, Yu; Li, Lina; Ji, Chengmin; Wu, Zhenyue; Wang, Sasa; Liu, Xitao; Yao, Yunpeng; Luo, Junhua Tailored Synthesis of an Unprecedented Pb-Mn Heterometallic Halide Hybrid with Enhanced Emission. Journal of the American Chemical Society, 2019, 141, 12197-12201 |
| 4128615 | CIF | C16 H22 O3 | P -1 | 12.1239; 13.1282; 14.4151 87.304; 75.4289; 76.0963 | 2155.3 | Thomas, William P.; Schatz, Devon J.; George, David T.; Pronin, Sergey V. A Radical-Polar Crossover Annulation To Access Terpenoid Motifs. Journal of the American Chemical Society, 2019, 141, 12246-12250 |
| 4128616 | CIF | C21 H32 O6 | P 1 21/c 1 | 11.3869; 11.0755; 16.4649 90; 106.017; 90 | 1995.87 | Thomas, William P.; Schatz, Devon J.; George, David T.; Pronin, Sergey V. A Radical-Polar Crossover Annulation To Access Terpenoid Motifs. Journal of the American Chemical Society, 2019, 141, 12246-12250 |
| 4128617 | CIF | C27 H46 Cl2 O4 | P 1 21/n 1 | 6.1836; 31.5163; 15.3756 90; 97.1381; 90 | 2973.2 | Thomas, William P.; Schatz, Devon J.; George, David T.; Pronin, Sergey V. A Radical-Polar Crossover Annulation To Access Terpenoid Motifs. Journal of the American Chemical Society, 2019, 141, 12246-12250 |
| 4128618 | CIF | C108 H104 Br0.55 Cl1.45 Fe2 Mg N8 O4 P4 | P 41 21 2 | 30.2467; 30.2467; 40.3458 90; 90; 90 | 36910.9 | Boddie, Theresa E.; Carpenter, Stephanie H.; Baker, Tessa M.; DeMuth, Joshua C.; Cera, Gianpiero; Brennessel, William W.; Ackermann, Lutz; Neidig, Michael L. Identification and Reactivity of Cyclometalated Iron(II) Intermediates in Triazole-Directed Iron-Catalyzed C-H Activation. Journal of the American Chemical Society, 2019, 141, 12338-12345 |
| 4128619 | CIF | C60 H52 Fe P2 | P 1 21/c 1 | 18.1339; 10.2597; 25.508 90; 103.062; 90 | 4622.9 | Boddie, Theresa E.; Carpenter, Stephanie H.; Baker, Tessa M.; DeMuth, Joshua C.; Cera, Gianpiero; Brennessel, William W.; Ackermann, Lutz; Neidig, Michael L. Identification and Reactivity of Cyclometalated Iron(II) Intermediates in Triazole-Directed Iron-Catalyzed C-H Activation. Journal of the American Chemical Society, 2019, 141, 12338-12345 |
| 4128620 | CIF | C146 H182 Br2.81 Cl1.19 Fe2 Mg3 N8 O13 P4 | P -1 | 20.9654; 22.0142; 24.361 105.257; 98.223; 116.486 | 9256.8 | Boddie, Theresa E.; Carpenter, Stephanie H.; Baker, Tessa M.; DeMuth, Joshua C.; Cera, Gianpiero; Brennessel, William W.; Ackermann, Lutz; Neidig, Michael L. Identification and Reactivity of Cyclometalated Iron(II) Intermediates in Triazole-Directed Iron-Catalyzed C-H Activation. Journal of the American Chemical Society, 2019, 141, 12338-12345 |
| 4128621 | CIF | C14 H20 O2 | P 1 21 1 | 10.7125; 7.9053; 15.482 90; 98.775; 90 | 1295.75 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128622 | CIF | C14 H16 Cl N | P 21 21 21 | 6.9593; 7.4662; 24.7555 90; 90; 90 | 1286.28 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128623 | CIF | C22 H19 Br2 N O2 | P 41 | 17.9521; 17.9521; 12.3975 90; 90; 90 | 3995.44 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128624 | CIF | C15 H14 N4 | P 1 21 1 | 5.55961; 8.2257; 13.5491 90; 91.2759; 90 | 619.47 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128625 | CIF | C18 H17 Cl N2 O4 | P 1 21 1 | 7.8468; 8.0192; 13.739 90; 95.361; 90 | 860.7 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128626 | CIF | C13 H14 Cl N O | P 21 21 21 | 6.2187; 7.2638; 27.5254 90; 90; 90 | 1243.36 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128627 | CIF | C15 H14 Cl2 O | P 1 | 5.8128; 8.5698; 13.4075 83.978; 88.299; 88.26 | 663.66 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
| 4128628 | CIF | C13 H15 B Cl2 N2 O | C 1 2/c 1 | 31.3149; 5.1903; 22.4457 90; 129.034; 90 | 2833.8 | Dai, Wen; Geib, Steven J.; Curran, Dennis P. Facile Synthesis of α-N-Heterocyclic Carbene-Boryl Ketones from N-Heterocyclic Carbene-Boranes and Alkenyl Triflates. Journal of the American Chemical Society, 2019, 141, 12355-12361 |
| 4128629 | CIF | C6.4 H6.2 Co N4 | P b c a | 15.5286; 15.6454; 18.0654 90; 90; 90 | 4389 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128630 | CIF | C6.4 H6.2 Co N4 | P b c a | 15.5088; 15.5888; 18.0871 90; 90; 90 | 4372.8 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128631 | CIF | C6 H6 Co N4 | P b c a | 15.487; 15.52; 18.108 90; 90; 90 | 4352.4 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128632 | CIF | C6 H6 Co N4 | P b c a | 15.2978; 15.4168; 18.1951 90; 90; 90 | 4291.2 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128633 | CIF | C6.4 H6.2 Co N4 | P b c a | 15.2069; 15.3558; 18.1389 90; 90; 90 | 4235.7 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128634 | CIF | C7.2 H6.6 Co N4 | P b c a | 15.342; 15.808; 18.03 90; 90; 90 | 4372.7 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128635 | CIF | C7.2 H6.6 Co N4 | P b c a | 15.5146; 15.7585; 18.0597 90; 90; 90 | 4415.4 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128636 | CIF | C6 H6 Co N4 | I 41 c d | 23.4856; 23.4856; 12.4606 90; 90; 90 | 6872.9 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128637 | CIF | C7.2 H6.6 Co N4 | P b c a | 15.4766; 15.6759; 18.0353 90; 90; 90 | 4375.5 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128638 | CIF | C6.48 H5.98 N4 Zn | P b c a | 15.3978; 15.3546; 18.1591 90; 90; 90 | 4293.3 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128639 | CIF | C6 H6 Co N4 | I 41 c d | 23.549; 23.549; 12.446 90; 90; 90 | 6902 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128640 | CIF | C6 H6 Co N4 | I 41 c d | 23.4363; 23.4363; 12.4615 90; 90; 90 | 6844.6 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128641 | CIF | C7.62 H9.12 N4.5 O0.5 Zn | P b c a | 15.4409; 15.0978; 18.2903 90; 90; 90 | 4263.9 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128642 | CIF | C7.9 H9.7 Co N4.5 O0.5 | P b c a | 15.1566; 15.6776; 18.2216 90; 90; 90 | 4329.8 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128643 | CIF | C6.4 H6.2 Co N4 | P b c a | 15.403; 15.504; 18.1233 90; 90; 90 | 4328 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128644 | CIF | C6 H6 Co N4 | P b c a | 15.0835; 15.2881; 18.2031 90; 90; 90 | 4197.6 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128645 | CIF | C7.78 H9.28 N4.5 O0.5 Zn | P b c a | 15.4686; 15.1468; 18.2938 90; 90; 90 | 4286.2 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128646 | CIF | C7.7 H9.2 N4.5 O0.5 Zn | P b c a | 15.4872; 15.0774; 18.3105 90; 90; 90 | 4275.6 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128647 | CIF | C7.58 H9.54 N4.5 O0.62 Zn | P b c a | 15.4061; 15.281; 18.2918 90; 90; 90 | 4306.3 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128648 | CIF | C6.68 H6.18 N4 Zn | P b c a | 15.4399; 15.4843; 18.1529 90; 90; 90 | 4339.9 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128649 | CIF | C7.73 H8.79 Co N4.35 O0.35 | P b c a | 15.282; 15.664; 18.179 90; 90; 90 | 4351.6 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128650 | CIF | C7.2 H6.6 Co N4 | P b c a | 15.386; 15.6096; 18.0571 90; 90; 90 | 4336.8 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128651 | CIF | C6.96 H6.46 N4 Zn | P b c a | 15.4724; 15.5973; 18.1477 90; 90; 90 | 4379.5 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128652 | CIF | C6 H6 Co N4 | P b c a | 15.591; 15.606; 18.103 90; 90; 90 | 4405 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128653 | CIF | C6 H6 Co N4 | I 41 c d | 23.3963; 23.3963; 12.4649 90; 90; 90 | 6823.1 | Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society, 2019, 141, 12362-12371 |
| 4128654 | CIF | C42 H47 Cl2 N5 O3 S2 | P -1 | 11.3638; 12.3409; 15.7074 70.623; 88.773; 86.769 | 2074.7 | Satoh, Yoshiyuki; Catti, Lorenzo; Akita, Munetaka; Yoshizawa, Michito A Redox-Active Heterocyclic Capsule: Radical Generation, Oxygenation, and Guest Uptake/Release. Journal of the American Chemical Society, 2019, 141, 12268-12273 |
| 4128655 | CIF | C88.5 H45.2 O36 Zr6 | P 1 2/m 1 | 21.6317; 12.2815; 21.6273 90; 119.975; 90 | 4977.2 | Chen, Zhijie; Li, Penghao; Wang, Xingjie; Otake, Ken-Ichi; Zhang, Xuan; Robison, Lee; Atilgan, Ahmet; Islamoglu, Timur; Hall, Morgan G.; Peterson, Gregory W.; Stoddart, J. Fraser; Farha, Omar K. Ligand-Directed Reticular Synthesis of Catalytically Active Missing Zirconium-Based Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 12229-12235 |
| 4128656 | CIF | C220 H112 O36 Zr6 | P 1 2/m 1 | 31.678; 19.591; 31.774 90; 119.631; 90 | 17140 | Chen, Zhijie; Li, Penghao; Wang, Xingjie; Otake, Ken-Ichi; Zhang, Xuan; Robison, Lee; Atilgan, Ahmet; Islamoglu, Timur; Hall, Morgan G.; Peterson, Gregory W.; Stoddart, J. Fraser; Farha, Omar K. Ligand-Directed Reticular Synthesis of Catalytically Active Missing Zirconium-Based Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 12229-12235 |
| 4128657 | CIF | C198 H114 O36 Zr6 | P 1 2/m 1 | 28.13; 16.7348; 28.174 90; 120.036; 90 | 11482 | Chen, Zhijie; Li, Penghao; Wang, Xingjie; Otake, Ken-Ichi; Zhang, Xuan; Robison, Lee; Atilgan, Ahmet; Islamoglu, Timur; Hall, Morgan G.; Peterson, Gregory W.; Stoddart, J. Fraser; Farha, Omar K. Ligand-Directed Reticular Synthesis of Catalytically Active Missing Zirconium-Based Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 12229-12235 |
| 4128658 | CIF | C87 H74 F24 N10 O P4 | P 1 2/c 1 | 31.4603; 15.0357; 20.4599 90; 104.239; 90 | 9380.8 | Roy, Indranil; Bobbala, Sharan; Young, Ryan M.; Beldjoudi, Yassine; Nguyen, Minh T.; Cetin, M. Mustafa; Cooper, James A.; Allen, Sean; Anamimoghadam, Ommid; Scott, Evan A.; Wasielewski, Michael R.; Stoddart, J. Fraser A Supramolecular Approach for Modulated Photoprotection, Lysosomal Delivery, and Photodynamic Activity of a Photosensitizer. Journal of the American Chemical Society, 2019, 141, 12296-12304 |
| 4128659 | CIF | C17 H20 B N O2 | P n a 21 | 27.4401; 7.2038; 15.7216 90; 90; 90 | 3107.7 | Rochette, Étienne; Desrosiers, Vincent; Soltani, Yashar; Fontaine, Frédéric-Georges Isodesmic C-H Borylation: Perspectives and Proof of Concept of Transfer Borylation Catalysis. Journal of the American Chemical Society, 2019, 141, 12305-12311 |
| 4128660 | CIF | C16 H36 Cl3 N S Si | P 1 21/c 1 | 17.253; 15.242; 18.394 90; 103.363; 90 | 4706 | Geeson, Michael B.; Ríos, Pablo; Transue, Wesley J.; Cummins, Christopher C. Orthophosphate and Sulfate Utilization for C-E (E = P, S) Bond Formation via Trichlorosilyl Phosphide and Sulfide Anions. Journal of the American Chemical Society, 2019, 141, 6375-6384 |
| 4128661 | CIF | C16 H36 N O9 P3 Si0.5 | P c c n | 13.1805; 18.929; 19.042 90; 90; 90 | 4750.9 | Geeson, Michael B.; Ríos, Pablo; Transue, Wesley J.; Cummins, Christopher C. Orthophosphate and Sulfate Utilization for C-E (E = P, S) Bond Formation via Trichlorosilyl Phosphide and Sulfide Anions. Journal of the American Chemical Society, 2019, 141, 6375-6384 |
| 4128662 | CIF | C51 H35 B3 F20 | C 2 2 21 | 7.755; 26.43; 22.349 90; 90; 90 | 4580.8 | Bamford, Karlee L.; Qu, Zheng-Wang; Stephan, Douglas W. Activation of H<sub>2</sub> and Et<sub>3</sub>SiH by the Borinium Cation [Mes<sub>2</sub>B]<sup>+</sup>: Avenues to Cations [MesB(μ-H)<sub>2</sub>(μ-Mes)BMes]<sup>+</sup> and [H<sub>2</sub>B(μ-H)(μ-Mes)B(μ-Mes)(μ-H)BH<sub>2</sub>]<sup/>. Journal of the American Chemical Society, 2019, 141, 6180-6184 |
| 4128663 | CIF | C48 H32 B4 F22 | P b c a | 16.7541; 20.7321; 26.318 90; 90; 90 | 9141.5 | Bamford, Karlee L.; Qu, Zheng-Wang; Stephan, Douglas W. Activation of H<sub>2</sub> and Et<sub>3</sub>SiH by the Borinium Cation [Mes<sub>2</sub>B]<sup>+</sup>: Avenues to Cations [MesB(μ-H)<sub>2</sub>(μ-Mes)BMes]<sup>+</sup> and [H<sub>2</sub>B(μ-H)(μ-Mes)B(μ-Mes)(μ-H)BH<sub>2</sub>]<sup/>. Journal of the American Chemical Society, 2019, 141, 6180-6184 |
| 4128664 | CIF | C66 H56 Br4 Fe2 N4 O6 | P 1 | 11.5182; 12.6576; 12.8574 79.166; 83.628; 83.716 | 1822.18 | Lu, Ran; Cao, Liya; Guan, Honghao; Liu, Lei Iron-Catalyzed Aerobic Dehydrogenative Kinetic Resolution of Cyclic Secondary Amines. Journal of the American Chemical Society, 2019, 141, 6318-6324 |
| 4128665 | CIF | C70 H71 Br4 Fe2 N11 O6 | P 1 | 11.3961; 12.6727; 12.8895 80.061; 84.9; 84.005 | 1818.8 | Lu, Ran; Cao, Liya; Guan, Honghao; Liu, Lei Iron-Catalyzed Aerobic Dehydrogenative Kinetic Resolution of Cyclic Secondary Amines. Journal of the American Chemical Society, 2019, 141, 6318-6324 |
| 4128666 | CIF | C18 H15 N | P 1 21 1 | 13.2294; 7.4619; 14.9668 90; 110.554; 90 | 1383.42 | Lu, Fu-Dong; Liu, Dan; Zhu, Lei; Lu, Liang-Qiu; Yang, Qian; Zhou, Quan-Quan; Wei, Yi; Lan, Yu; Xiao, Wen-Jing Asymmetric Propargylic Radical Cyanation Enabled by Dual Organophotoredox and Copper Catalysis. Journal of the American Chemical Society, 2019, 141, 6167-6172 |
| 4128667 | CIF | C28 H19 N O2 Pt S | P 1 21/c 1 | 11.7362; 15.51; 12.1799 90; 98.288; 90 | 2193.9 | Sun, Meng-Jia; Liu, Yingying; Zeng, Wei; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian Photoluminescent Anisotropy Amplification in Polymorphic Organic Nanocrystals by Light-Harvesting Energy Transfer. Journal of the American Chemical Society, 2019, 141, 6157-6161 |
| 4128668 | CIF | C27 H19 F2 N O2 Pt | P -1 | 9.3194; 10.2399; 12.4624 76.398; 84.63; 69.717 | 1084.16 | Sun, Meng-Jia; Liu, Yingying; Zeng, Wei; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian Photoluminescent Anisotropy Amplification in Polymorphic Organic Nanocrystals by Light-Harvesting Energy Transfer. Journal of the American Chemical Society, 2019, 141, 6157-6161 |
| 4128669 | CIF | C27 H19 F2 N O2 Pt | P 1 21/n 1 | 14.468; 7.3753; 20.436 90; 101.48; 90 | 2137 | Sun, Meng-Jia; Liu, Yingying; Zeng, Wei; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian Photoluminescent Anisotropy Amplification in Polymorphic Organic Nanocrystals by Light-Harvesting Energy Transfer. Journal of the American Chemical Society, 2019, 141, 6157-6161 |
| 4128670 | CIF | C27 H19 F2 N O2 Pt | P 1 21/n 1 | 14.4681; 7.3806; 20.4113 90; 101.399; 90 | 2136.59 | Sun, Meng-Jia; Liu, Yingying; Zeng, Wei; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian Photoluminescent Anisotropy Amplification in Polymorphic Organic Nanocrystals by Light-Harvesting Energy Transfer. Journal of the American Chemical Society, 2019, 141, 6157-6161 |
| 4128671 | CIF | C27 H19 F2 N O2 Pt | P -1 | 9.3111; 10.2403; 12.4557 76.428; 84.596; 69.771 | 1083.15 | Sun, Meng-Jia; Liu, Yingying; Zeng, Wei; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian Photoluminescent Anisotropy Amplification in Polymorphic Organic Nanocrystals by Light-Harvesting Energy Transfer. Journal of the American Chemical Society, 2019, 141, 6157-6161 |
| 4128672 | CIF | C15 H20 N2 O3 | P 1 21/c 1 | 8.322; 17.969; 18.785 90; 93.483; 90 | 2803.9 | Zhu, Jie S.; Li, Clarabella J.; Tsui, Ka Yi; Kraemer, Niklas; Son, Jung-Ho; Haddadin, Makhluf J.; Tantillo, Dean J.; Kurth, Mark J. Accessing Multiple Classes of 2 H-Indazoles: Mechanistic Implications for the Cadogan and Davis-Beirut Reactions. Journal of the American Chemical Society, 2019, 141, 6247-6253 |
| 4128673 | CIF | C13 H16 N2 O | P -1 | 10.5923; 11.7189; 18.6587 97.374; 90.086; 99.864 | 2262.3 | Zhu, Jie S.; Li, Clarabella J.; Tsui, Ka Yi; Kraemer, Niklas; Son, Jung-Ho; Haddadin, Makhluf J.; Tantillo, Dean J.; Kurth, Mark J. Accessing Multiple Classes of 2 H-Indazoles: Mechanistic Implications for the Cadogan and Davis-Beirut Reactions. Journal of the American Chemical Society, 2019, 141, 6247-6253 |
| 4128674 | CIF | C10 H12 N2 O | P 1 21 1 | 6.1799; 8.3702; 9.1069 90; 106.537; 90 | 451.59 | Zhu, Jie S.; Li, Clarabella J.; Tsui, Ka Yi; Kraemer, Niklas; Son, Jung-Ho; Haddadin, Makhluf J.; Tantillo, Dean J.; Kurth, Mark J. Accessing Multiple Classes of 2 H-Indazoles: Mechanistic Implications for the Cadogan and Davis-Beirut Reactions. Journal of the American Chemical Society, 2019, 141, 6247-6253 |
| 4128675 | CIF | C30 H20 Br2 | P -1 | 8.8193; 10.9345; 11.7593 95.837; 91.786; 109.762 | 1059.1 | Zou, Ya; Zeng, Wangdong; Gopalakrishna, Tullimilli Y.; Han, Yi; Jiang, Qing; Wu, Jishan Dicyclopenta[4,3,2,1- ghi:4',3',2',1'- pqr]perylene: A Bowl-Shaped Fragment of Fullerene C<sub>70</sub> with Global Antiaromaticity. Journal of the American Chemical Society, 2019, 141, 7266-7270 |
| 4128676 | CIF | C45.33 H46.67 | P 1 21/n 1 | 21.6386; 15.0626; 22.67 90; 117.681; 90 | 6543.2 | Zou, Ya; Zeng, Wangdong; Gopalakrishna, Tullimilli Y.; Han, Yi; Jiang, Qing; Wu, Jishan Dicyclopenta[4,3,2,1- ghi:4',3',2',1'- pqr]perylene: A Bowl-Shaped Fragment of Fullerene C<sub>70</sub> with Global Antiaromaticity. Journal of the American Chemical Society, 2019, 141, 7266-7270 |
| 4128677 | CIF | C55 H51 Cl8 Ir O P4 | P 1 21/c 1 | 12.265; 24.523; 22.176 90; 121.94; 90 | 5660 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128678 | CIF | C52 H48 B Br Cl3 Ir O P4 | P b c a | 23.3229; 16.5703; 25.209 90; 90; 90 | 9742.5 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128679 | CIF | C29 H30 Cl2 Ir N O P2 | P -1 | 10.6032; 11.7641; 12.732 97.86; 109.324; 107.162 | 1382.7 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128680 | CIF | C156.4 H138.8 Cl11.8 Ir3 O3 P12 | C 1 2/c 1 | 41.384; 12.1155; 32.3933 90; 109.788; 90 | 15282.6 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128681 | CIF | C33 H33 Cl4 Ir N2 O P2 | P -1 | 14.0605; 14.4113; 19.6677 88.181; 79.515; 63.887 | 3513.5 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128682 | CIF | C32 H27 Cl Ir N O P2 | P 1 | 15.2943; 16.0822; 17.6097 108.002; 92.021; 109.271 | 3842.8 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128683 | CIF | C41.75 H38 Cl Ir O P2 | P -1 | 9.6658; 14.2713; 14.767 107.989; 96.128; 104.806 | 1834.52 | Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments. Journal of the American Chemical Society, 2019, 141, 7596-7604 |
| 4128684 | CIF | C182.67 H102 O60 P3 Zr9 | P 32 2 1 | 45.122; 45.122; 49.238 90; 90; 120 | 86818 | Gong, Wei; Chen, Xu; Jiang, Hong; Chu, Dandan; Cui, Yong; Liu, Yan Highly Stable Zr(IV)-Based Metal-Organic Frameworks with Chiral Phosphoric Acids for Catalytic Asymmetric Tandem Reactions. Journal of the American Chemical Society, 2019, 141, 7498-7508 |
| 4128685 | CIF | C135 H78 O60 P3 Zr9 | P 62 2 2 | 38.1622; 38.1622; 45.5859 90; 90; 120 | 57495 | Gong, Wei; Chen, Xu; Jiang, Hong; Chu, Dandan; Cui, Yong; Liu, Yan Highly Stable Zr(IV)-Based Metal-Organic Frameworks with Chiral Phosphoric Acids for Catalytic Asymmetric Tandem Reactions. Journal of the American Chemical Society, 2019, 141, 7498-7508 |
| 4128686 | CIF | C20 H18 F N O2 S | P 1 21 1 | 6.2029; 8.504; 16.5123 90; 97.283; 90 | 863.99 | Xu, Meng-Yu; Jiang, Wei-Tao; Li, Ying; Xu, Qing-Hao; Zhou, Qiao-Lan; Yang, Shuo; Xiao, Bin Alkyl Carbagermatranes Enable Practical Palladium-Catalyzed sp<sup>2</sup>-sp<sup>3</sup> Cross-Coupling. Journal of the American Chemical Society, 2019, 141, 7582-7588 |
| 4128687 | CIF | C23 H30 F Ge N | P 21 21 21 | 7.3844; 11.767; 24.0742 90; 90; 90 | 2091.86 | Xu, Meng-Yu; Jiang, Wei-Tao; Li, Ying; Xu, Qing-Hao; Zhou, Qiao-Lan; Yang, Shuo; Xiao, Bin Alkyl Carbagermatranes Enable Practical Palladium-Catalyzed sp<sup>2</sup>-sp<sup>3</sup> Cross-Coupling. Journal of the American Chemical Society, 2019, 141, 7582-7588 |
| 4128688 | CIF | C28 H30 N O3 S | P 21 21 21 | 8.5255; 10.9187; 26.122 90; 90; 90 | 2431.6 | Tian, Zhi-Xiong; Qiao, Jin-Bao; Xu, Guang-Li; Pang, Xiaobo; Qi, Liangliang; Ma, Wei-Yuan; Zhao, Zhen-Zhen; Duan, Jicheng; Du, Yun-Fei; Su, Peifeng; Liu, Xue-Yuan; Shu, Xing-Zhong Highly Enantioselective Cross-Electrophile Aryl-Alkenylation of Unactivated Alkenes. Journal of the American Chemical Society, 2019, 141, 7637-7643 |
| 4128689 | CIF | C149 H121.5 Cl7.5 N2 O8 | P -1 | 14.638; 21.545; 21.633 115.86; 91.04; 101.68 | 5968 | Senthilkumar, Kabali; Kondratowicz, Mateusz; Lis, Tadeusz; Chmielewski, Piotr J.; Cybińska, Joanna; Zafra, José L; Casado, Juan; Vives, Thomas; Crassous, Jeanne; Favereau, Ludovic; Stępień, Marcin Lemniscular [16]Cycloparaphenylene: A Radially Conjugated Figure-Eight Aromatic Molecule. Journal of the American Chemical Society, 2019, 141, 7421-7427 |
| 4128690 | CIF | C50.35 H66.5 B4 Cl2.9 N2 O8.9 | P 1 21/c 1 | 11.357; 19.873; 24.561 90; 92.26; 90 | 5539 | Senthilkumar, Kabali; Kondratowicz, Mateusz; Lis, Tadeusz; Chmielewski, Piotr J.; Cybińska, Joanna; Zafra, José L; Casado, Juan; Vives, Thomas; Crassous, Jeanne; Favereau, Ludovic; Stępień, Marcin Lemniscular [16]Cycloparaphenylene: A Radially Conjugated Figure-Eight Aromatic Molecule. Journal of the American Chemical Society, 2019, 141, 7421-7427 |
| 4128691 | CIF | C24 H12 Br4 N2 | P -1 | 12.044; 12.843; 15.312 111.06; 97.93; 92.75 | 2176.9 | Senthilkumar, Kabali; Kondratowicz, Mateusz; Lis, Tadeusz; Chmielewski, Piotr J.; Cybińska, Joanna; Zafra, José L; Casado, Juan; Vives, Thomas; Crassous, Jeanne; Favereau, Ludovic; Stępień, Marcin Lemniscular [16]Cycloparaphenylene: A Radially Conjugated Figure-Eight Aromatic Molecule. Journal of the American Chemical Society, 2019, 141, 7421-7427 |
| 4128692 | CIF | C34 H38 B2 N2 | P 1 21/c 1 | 11.8361; 17.0449; 13.5799 90; 94.612; 90 | 2730.81 | Liu, Kanglei; Lalancette, Roger A.; Jäkle, Frieder Tuning the Structure and Electronic Properties of B-N Fused Dipyridylanthracene and Implications on the Self-Sensitized Reactivity with Singlet Oxygen. Journal of the American Chemical Society, 2019, 141, 7453-7462 |
| 4128693 | CIF | C35 H40 B2 Cl2 N2 | P 1 21 1 | 11.2307; 18.6067; 15.1051 90; 99.152; 90 | 3116.3 | Liu, Kanglei; Lalancette, Roger A.; Jäkle, Frieder Tuning the Structure and Electronic Properties of B-N Fused Dipyridylanthracene and Implications on the Self-Sensitized Reactivity with Singlet Oxygen. Journal of the American Chemical Society, 2019, 141, 7453-7462 |
| 4128694 | CIF | C21 H34 Cl N O2 P2 Ru | P c a 21 | 19.979; 8.1877; 14.542 90; 90; 90 | 2378.8 | Tang, Shan; von Wolff, Niklas; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Pyridine-Based PCP-Ruthenium Complexes: Unusual Structures and Metal-Ligand Cooperation. Journal of the American Chemical Society, 2019, 141, 7554-7561 |
| 4128695 | CIF | C25 H42 Cl N O2 P2 Ru | P 1 21/c 1 | 14.9454; 13.329; 15.2365 90; 114.46; 90 | 2762.81 | Tang, Shan; von Wolff, Niklas; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Pyridine-Based PCP-Ruthenium Complexes: Unusual Structures and Metal-Ligand Cooperation. Journal of the American Chemical Society, 2019, 141, 7554-7561 |
| 4128696 | CIF | C23 H37 Cl F3 N O5 P2 Ru S | P -1 | 8.0794; 11.8473; 16.5367 78.74; 81.335; 71.41 | 1464.74 | Tang, Shan; von Wolff, Niklas; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Pyridine-Based PCP-Ruthenium Complexes: Unusual Structures and Metal-Ligand Cooperation. Journal of the American Chemical Society, 2019, 141, 7554-7561 |
| 4128697 | CIF | C24 H40 Cl N O3 P2 Ru | P -1 | 8.2741; 10.9141; 16.1941 102.467; 96.796; 108.34 | 1327.73 | Tang, Shan; von Wolff, Niklas; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Pyridine-Based PCP-Ruthenium Complexes: Unusual Structures and Metal-Ligand Cooperation. Journal of the American Chemical Society, 2019, 141, 7554-7561 |
| 4128698 | CIF | C27 H46 F3 N O5 P2 Ru S | P -1 | 8.4532; 12.2712; 16.5682 102.398; 103.639; 92.35 | 1623.6 | Tang, Shan; von Wolff, Niklas; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Pyridine-Based PCP-Ruthenium Complexes: Unusual Structures and Metal-Ligand Cooperation. Journal of the American Chemical Society, 2019, 141, 7554-7561 |
| 4128699 | CIF | C25 H43 N O2 P2 Ru | P 1 21/n 1 | 12.2611; 15.6139; 15.0481 90; 109.982; 90 | 2707.43 | Tang, Shan; von Wolff, Niklas; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David Pyridine-Based PCP-Ruthenium Complexes: Unusual Structures and Metal-Ligand Cooperation. Journal of the American Chemical Society, 2019, 141, 7554-7561 |
| 4128700 | CIF | C105 H126 Cl2 Co2 O4.5 P6 | P 1 21 1 | 11.3756; 39.096; 11.5017 90; 96.094; 90 | 5086.4 | Duvvuri, Krishnaja; Dewese, Kendra R.; Parsutkar, Mahesh M.; Jing, Stanley M.; Mehta, Milauni M.; Gallucci, Judith C.; RajanBabu, T. V. Cationic Co(I)-Intermediates for Hydrofunctionalization Reactions: Regio- and Enantioselective Cobalt-Catalyzed 1,2-Hydroboration of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 7365-7375 |
| 4128701 | CIF | C81 H78 Cl2 Co2 P6 | P -1 | 21.4598; 21.5413; 23.7245 66.439; 66.401; 71.722 | 9056.8 | Duvvuri, Krishnaja; Dewese, Kendra R.; Parsutkar, Mahesh M.; Jing, Stanley M.; Mehta, Milauni M.; Gallucci, Judith C.; RajanBabu, T. V. Cationic Co(I)-Intermediates for Hydrofunctionalization Reactions: Regio- and Enantioselective Cobalt-Catalyzed 1,2-Hydroboration of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 7365-7375 |
| 4128702 | CIF | C24 H38 Fe2 O10 | P -1 | 8.3679; 9.3117; 10.5715 68.047; 81.979; 65.376 | 694.39 | Kim, Dongyoung; Rahaman, S. M. Wahidur; Mercado, Brandon Q.; Poli, Rinaldo; Holland, Patrick L. Roles of Iron Complexes in Catalytic Radical Alkene Cross-Coupling: A Computational and Mechanistic Study. Journal of the American Chemical Society, 2019, 141, 7473-7485 |
| 4128703 | CIF | C6 H12 N O4 Re | P m -3 m | 6.2087; 6.2087; 6.2087 90; 90; 90 | 239.33 | Harada, Jun; Kawamura, Yuto; Takahashi, Yukihiro; Uemura, Yohei; Hasegawa, Tatsuo; Taniguchi, Hiroki; Maruyama, Koji Plastic/Ferroelectric Crystals with Easily Switchable Polarization: Low-Voltage Operation, Unprecedentedly High Pyroelectric Performance, and Large Piezoelectric Effect in Polycrystalline Forms. Journal of the American Chemical Society, 2019, 141, 9349-9357 |
| 4128704 | CIF | C6 H12 N O4 Re | R 3 m :R | 6.1776; 6.1776; 6.1776 89.846; 89.846; 89.846 | 235.75 | Harada, Jun; Kawamura, Yuto; Takahashi, Yukihiro; Uemura, Yohei; Hasegawa, Tatsuo; Taniguchi, Hiroki; Maruyama, Koji Plastic/Ferroelectric Crystals with Easily Switchable Polarization: Low-Voltage Operation, Unprecedentedly High Pyroelectric Performance, and Large Piezoelectric Effect in Polycrystalline Forms. Journal of the American Chemical Society, 2019, 141, 9349-9357 |
| 4128705 | CIF | C6 H12 I N O4 | P m -3 m | 6.218; 6.218; 6.218 90; 90; 90 | 240.4 | Harada, Jun; Kawamura, Yuto; Takahashi, Yukihiro; Uemura, Yohei; Hasegawa, Tatsuo; Taniguchi, Hiroki; Maruyama, Koji Plastic/Ferroelectric Crystals with Easily Switchable Polarization: Low-Voltage Operation, Unprecedentedly High Pyroelectric Performance, and Large Piezoelectric Effect in Polycrystalline Forms. Journal of the American Chemical Society, 2019, 141, 9349-9357 |
| 4128706 | CIF | C64 H64 Si2 | P -1 | 8.3171; 8.7877; 17.784 90.246; 98.944; 103.627 | 1246.7 | Jousselin-Oba, Tanguy; Mamada, Masashi; Marrot, Jérôme; Maignan, Antoine; Adachi, Chihaya; Yassar, Abderrahim; Frigoli, Michel Excellent Semiconductors Based on Tetracenotetracene and Pentacenopentacene: From Stable Closed-Shell to Singlet Open-Shell. Journal of the American Chemical Society, 2019, 141, 9373-9381 |
| 4128707 | CIF | C41 H50 N6 O7 | P 1 21 1 | 9.892; 19.639; 10.615 90; 106.64; 90 | 1975.8 | Li, Bo; Li, Xinghua; Han, Boyang; Chen, Zhijie; Zhang, Xuekai; He, Gang; Chen, Gong Construction of Natural-Product-Like Cyclophane-Braced Peptide Macrocycles via sp<sup>3</sup> C-H Arylation. Journal of the American Chemical Society, 2019, 141, 9401-9407 |
| 4128708 | CIF | C30.5 H36 Cl N5 O6 | P 21 21 2 | 21.355; 12.8409; 11.1411 90; 90; 90 | 3055.08 | Li, Bo; Li, Xinghua; Han, Boyang; Chen, Zhijie; Zhang, Xuekai; He, Gang; Chen, Gong Construction of Natural-Product-Like Cyclophane-Braced Peptide Macrocycles via sp<sup>3</sup> C-H Arylation. Journal of the American Chemical Society, 2019, 141, 9401-9407 |
| 4128709 | CIF | C39 H50 N6 O6 | P 1 21 1 | 11.2412; 10.5448; 17.0505 90; 107.124; 90 | 1931.51 | Li, Bo; Li, Xinghua; Han, Boyang; Chen, Zhijie; Zhang, Xuekai; He, Gang; Chen, Gong Construction of Natural-Product-Like Cyclophane-Braced Peptide Macrocycles via sp<sup>3</sup> C-H Arylation. Journal of the American Chemical Society, 2019, 141, 9401-9407 |
| 4128710 | CIF | C16 H22 N2 O4 S | P -1 | 7.247; 10.734; 10.837 82.378; 86.98; 87.899 | 834 | Li, Hongze; Shen, Shou-Jie; Zhu, Cheng-Liang; Xu, Hao Direct Intermolecular Anti-Markovnikov Hydroazidation of Unactivated Olefins. Journal of the American Chemical Society, 2019, 141, 9415-9421 |
| 4128711 | CIF | C8 H2 Co3 O10 | C 1 2/m 1 | 9.2727; 12.891; 5.4962 90; 90.015; 90 | 657 | Li, Liangying; Guo, Lidong; Zhang, Zhiguo; Yang, Qiwei; Yang, Yiwen; Bao, Zongbi; Ren, Qilong; Li, Jing A Robust Squarate-Based Metal-Organic Framework Demonstrates Record-High Affinity and Selectivity for Xenon over Krypton. Journal of the American Chemical Society, 2019, 141, 9358-9364 |
| 4128712 | CIF | C38 H34 Cl8 Ga2 P2 Se2 | P 1 21/n 1 | 10.113; 17.305; 15.793 90; 93.473; 90 | 2759 | Wang, Wei; Zhu, Haofu; Liu, Shuya; Zhao, Zhiguo; Zhang, Liang; Hao, Jingcheng; Wang, Yao Chalcogen-Chalcogen Bonding Catalysis Enables Assembly of Discrete Molecules. Journal of the American Chemical Society, 2019, 141, 9175-9179 |
| 4128713 | CIF | C8 H7 F3 N2 O3 S2 | P 1 21/c 1 | 6.476; 11.412; 16.422 90; 99.474; 90 | 1197.1 | Wang, Wei; Zhu, Haofu; Liu, Shuya; Zhao, Zhiguo; Zhang, Liang; Hao, Jingcheng; Wang, Yao Chalcogen-Chalcogen Bonding Catalysis Enables Assembly of Discrete Molecules. Journal of the American Chemical Society, 2019, 141, 9175-9179 |
| 4128714 | CIF | C30 H31 N O6 | P 1 21/c 1 | 12.628; 11.193; 18.905 90; 105.154; 90 | 2579.2 | Wang, Wei; Zhu, Haofu; Liu, Shuya; Zhao, Zhiguo; Zhang, Liang; Hao, Jingcheng; Wang, Yao Chalcogen-Chalcogen Bonding Catalysis Enables Assembly of Discrete Molecules. Journal of the American Chemical Society, 2019, 141, 9175-9179 |
| 4128715 | CIF | C21 H21 N O3 | P 1 21/n 1 | 9.579; 17.1831; 11.6372 90; 114.236; 90 | 1746.62 | Wang, Wei; Zhu, Haofu; Liu, Shuya; Zhao, Zhiguo; Zhang, Liang; Hao, Jingcheng; Wang, Yao Chalcogen-Chalcogen Bonding Catalysis Enables Assembly of Discrete Molecules. Journal of the American Chemical Society, 2019, 141, 9175-9179 |
| 4128716 | CIF | C56 H42 Cl4 Ga P2 Se2 | P -1 | 13.843; 14.77; 16.408 98.002; 111.568; 91.861 | 3077 | Wang, Wei; Zhu, Haofu; Liu, Shuya; Zhao, Zhiguo; Zhang, Liang; Hao, Jingcheng; Wang, Yao Chalcogen-Chalcogen Bonding Catalysis Enables Assembly of Discrete Molecules. Journal of the American Chemical Society, 2019, 141, 9175-9179 |
| 4128717 | CIF | C21 H21 N O3 | P 1 21/c 1 | 13.521; 8.727; 16.583 90; 112.641; 90 | 1806 | Wang, Wei; Zhu, Haofu; Liu, Shuya; Zhao, Zhiguo; Zhang, Liang; Hao, Jingcheng; Wang, Yao Chalcogen-Chalcogen Bonding Catalysis Enables Assembly of Discrete Molecules. Journal of the American Chemical Society, 2019, 141, 9175-9179 |
| 4128718 | CIF | C76 H93 Cl4 F12 N8 O14.5 Rh4 S4 | P -1 | 12.2462; 18.9725; 20.7122 91.488; 100.961; 102.263 | 4605.6 | Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings. Journal of the American Chemical Society, 2019, 141, 9160-9164 |
| 4128719 | CIF | C104 H106.67 F12 N25.33 O28 Pd2 Rh4 S4 | P -1 | 22.226; 22.561; 23.443 61.751; 83.713; 67.618 | 9539 | Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings. Journal of the American Chemical Society, 2019, 141, 9160-9164 |
| 4128720 | CIF | C102 H120.67 F12 N12 O27.67 Rh4 S4 | P 1 21/n 1 | 22.109; 32.573; 23.984 90; 101.33; 90 | 16936 | Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings. Journal of the American Chemical Society, 2019, 141, 9160-9164 |
| 4128721 | CIF | C89 H102 Cl4 F12 N12 O24 Rh4 S4 | P 1 21/n 1 | 24.819; 15.641; 29.158 90; 103.341; 90 | 11014 | Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings. Journal of the American Chemical Society, 2019, 141, 9160-9164 |
| 4128722 | CIF | C104 H140 F12 N12 O38 Pd2 Rh4 S6 | C 1 2/c 1 | 42.412; 24.783; 37.548 90; 93.396; 90 | 39397 | Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings. Journal of the American Chemical Society, 2019, 141, 9160-9164 |
| 4128723 | CIF | C70 H86 Cl4 F12 N12 O14 Rh4 S4 | P 1 21/n 1 | 14.5778; 19.8862; 18.8713 90; 111.907; 90 | 5075.7 | Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings. Journal of the American Chemical Society, 2019, 141, 9160-9164 |
| 4128724 | CIF | C15 H16 N2 O2 | P 1 21/c 1 | 14.6899; 11.8518; 7.5864 90; 98.535; 90 | 1306.2 | Kim, Inwon; Kang, Gyumin; Lee, Kangjae; Park, Bohyun; Kang, Dahye; Jung, Hoimin; He, Yu-Tao; Baik, Mu-Hyun; Hong, Sungwoo Site-Selective Functionalization of Pyridinium Derivatives via Visible-Light-Driven Photocatalysis with Quinolinone. Journal of the American Chemical Society, 2019, 141, 9239-9248 |
| 4128725 | CIF | C18 H16 N O P | P 1 21/c 1 | 15.0243; 9.1417; 11.0063 90; 92.782; 90 | 1509.9 | Kim, Inwon; Kang, Gyumin; Lee, Kangjae; Park, Bohyun; Kang, Dahye; Jung, Hoimin; He, Yu-Tao; Baik, Mu-Hyun; Hong, Sungwoo Site-Selective Functionalization of Pyridinium Derivatives via Visible-Light-Driven Photocatalysis with Quinolinone. Journal of the American Chemical Society, 2019, 141, 9239-9248 |
| 4128726 | CIF | C23 H20 N O3 P | P -1 | 8.7457; 9.3045; 12.4461 104.345; 103.023; 90.34 | 953.93 | Kim, Inwon; Kang, Gyumin; Lee, Kangjae; Park, Bohyun; Kang, Dahye; Jung, Hoimin; He, Yu-Tao; Baik, Mu-Hyun; Hong, Sungwoo Site-Selective Functionalization of Pyridinium Derivatives via Visible-Light-Driven Photocatalysis with Quinolinone. Journal of the American Chemical Society, 2019, 141, 9239-9248 |
| 4128727 | CIF | C22 H18 N O P | P 1 21/c 1 | 8.8392; 17.5163; 11.7943 90; 109.285; 90 | 1723.6 | Kim, Inwon; Kang, Gyumin; Lee, Kangjae; Park, Bohyun; Kang, Dahye; Jung, Hoimin; He, Yu-Tao; Baik, Mu-Hyun; Hong, Sungwoo Site-Selective Functionalization of Pyridinium Derivatives via Visible-Light-Driven Photocatalysis with Quinolinone. Journal of the American Chemical Society, 2019, 141, 9239-9248 |
| 4128728 | CIF | C18 H6 Cu3 O13.5 | F m -3 m | 26.283; 26.283; 26.283 90; 90; 90 | 18156.2 | Scatena, Rebecca; Guntern, Yannick T.; Macchi, Piero Electron Density and Dielectric Properties of Highly Porous MOFs: Binding and Mobility of Guest Molecules in Cu<sub>3</sub>(BTC)<sub>2</sub> and Zn<sub>3</sub>(BTC)<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 9382-9390 |
| 4128729 | CIF | C18 H6 Cu3 O15 | F m -3 m | 26.3038; 26.3038; 26.3038 90; 90; 90 | 18199.3 | Scatena, Rebecca; Guntern, Yannick T.; Macchi, Piero Electron Density and Dielectric Properties of Highly Porous MOFs: Binding and Mobility of Guest Molecules in Cu<sub>3</sub>(BTC)<sub>2</sub> and Zn<sub>3</sub>(BTC)<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 9382-9390 |
| 4128730 | CIF | C18 H6 Cu3 O13 | F m -3 m | 26.279; 26.279; 26.279 90; 90; 90 | 18147.9 | Scatena, Rebecca; Guntern, Yannick T.; Macchi, Piero Electron Density and Dielectric Properties of Highly Porous MOFs: Binding and Mobility of Guest Molecules in Cu<sub>3</sub>(BTC)<sub>2</sub> and Zn<sub>3</sub>(BTC)<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 9382-9390 |
| 4128731 | CIF | C18 H6 Cu3 O12.5 | F m -3 m | 26.269; 26.269; 26.269 90; 90; 90 | 18127.2 | Scatena, Rebecca; Guntern, Yannick T.; Macchi, Piero Electron Density and Dielectric Properties of Highly Porous MOFs: Binding and Mobility of Guest Molecules in Cu<sub>3</sub>(BTC)<sub>2</sub> and Zn<sub>3</sub>(BTC)<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 9382-9390 |
| 4128732 | CIF | C32 H60 Br2 Cl4 F4 N2 O2 | P -1 | 8.6884; 9.4552; 14.6981 92.465; 104.135; 112.842 | 1066.17 | Kepler, Slade; Zeller, Matthias; Rosokha, Sergiy V. Anion-π Complexes of Halides with p-Benzoquinones: Structures, Thermodynamics, and Criteria of Charge Transfer to Electron Transfer Transition. Journal of the American Chemical Society, 2019, 141, 9338-9348 |
| 4128733 | CIF | C18 H28 F4 I N O2 | P -1 | 9.4008; 10.9112; 11.8382 105.366; 97.509; 110.255 | 1064.8 | Kepler, Slade; Zeller, Matthias; Rosokha, Sergiy V. Anion-π Complexes of Halides with p-Benzoquinones: Structures, Thermodynamics, and Criteria of Charge Transfer to Electron Transfer Transition. Journal of the American Chemical Society, 2019, 141, 9338-9348 |
| 4128734 | CIF | C19 H29 Br F4 N O4 | P -1 | 9.41; 9.4831; 12.9042 97.931; 90.411; 97.764 | 1129.66 | Kepler, Slade; Zeller, Matthias; Rosokha, Sergiy V. Anion-π Complexes of Halides with p-Benzoquinones: Structures, Thermodynamics, and Criteria of Charge Transfer to Electron Transfer Transition. Journal of the American Chemical Society, 2019, 141, 9338-9348 |
| 4128735 | CIF | C48 H56 Cl6 N8 O6 | P 1 21/c 1 | 10.2282; 12.5758; 19.9561 90; 97.358; 90 | 2545.8 | Kepler, Slade; Zeller, Matthias; Rosokha, Sergiy V. Anion-π Complexes of Halides with p-Benzoquinones: Structures, Thermodynamics, and Criteria of Charge Transfer to Electron Transfer Transition. Journal of the American Chemical Society, 2019, 141, 9338-9348 |
| 4128736 | CIF | C28 H28 Cl5 N5 O4 | P 1 21/n 1 | 15.2745; 10.2019; 20.6506 90; 96.098; 90 | 3199.8 | Kepler, Slade; Zeller, Matthias; Rosokha, Sergiy V. Anion-π Complexes of Halides with p-Benzoquinones: Structures, Thermodynamics, and Criteria of Charge Transfer to Electron Transfer Transition. Journal of the American Chemical Society, 2019, 141, 9338-9348 |
| 4128737 | CIF | C38 H64 N18 O24 P2 | C 1 2 1 | 20.778; 7.2406; 17.576 90; 98.794; 90 | 2613.1 | Zhou, Li; Retailleau, Pascal; Morel, Mathieu; Rudiuk, Sergii; Baigl, Damien Photoswitchable Fluorescent Crystals Obtained by the Photoreversible Coassembly of a Nucleobase and an Azobenzene Intercalator. Journal of the American Chemical Society, 2019, 141, 9321-9329 |
| 4128738 | CIF | C35 H49 Cl5 N4 O3 Th | P 1 21/c 1 | 11.3484; 20.8006; 17.0866 90; 102.202; 90 | 3942.2 | Cheisson, Thibault; Kersey, Kyle D.; Mahieu, Nolwenn; McSkimming, Alex; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Multiple Bonding in Lanthanides and Actinides: Direct Comparison of Covalency in Thorium(IV)- and Cerium(IV)-Imido Complexes. Journal of the American Chemical Society, 2019, 141, 9185-9190 |
| 4128739 | CIF | C37 H56 N4 O3 Si Th | P 1 21/n 1 | 9.712; 17.5161; 22.8464 90; 93.634; 90 | 3878.7 | Cheisson, Thibault; Kersey, Kyle D.; Mahieu, Nolwenn; McSkimming, Alex; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Multiple Bonding in Lanthanides and Actinides: Direct Comparison of Covalency in Thorium(IV)- and Cerium(IV)-Imido Complexes. Journal of the American Chemical Society, 2019, 141, 9185-9190 |
| 4128740 | CIF | C45 H57 F6 N5 O4 Th | P 1 21/n 1 | 12.0934; 17.895; 20.998 90; 97.346; 90 | 4506.9 | Cheisson, Thibault; Kersey, Kyle D.; Mahieu, Nolwenn; McSkimming, Alex; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Multiple Bonding in Lanthanides and Actinides: Direct Comparison of Covalency in Thorium(IV)- and Cerium(IV)-Imido Complexes. Journal of the American Chemical Society, 2019, 141, 9185-9190 |
| 4128741 | CIF | C49 H64 F6 Li N5 O5 Th | P 1 21/n 1 | 13.9171; 18.1649; 22.1946 90; 96.724; 90 | 5572.3 | Cheisson, Thibault; Kersey, Kyle D.; Mahieu, Nolwenn; McSkimming, Alex; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Multiple Bonding in Lanthanides and Actinides: Direct Comparison of Covalency in Thorium(IV)- and Cerium(IV)-Imido Complexes. Journal of the American Chemical Society, 2019, 141, 9185-9190 |
| 4128742 | CIF | C59 H84 F6 K N7 O9 Th | P -1 | 11.8126; 12.0421; 25.5193 94.897; 95.005; 118.644 | 3139.9 | Cheisson, Thibault; Kersey, Kyle D.; Mahieu, Nolwenn; McSkimming, Alex; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Multiple Bonding in Lanthanides and Actinides: Direct Comparison of Covalency in Thorium(IV)- and Cerium(IV)-Imido Complexes. Journal of the American Chemical Society, 2019, 141, 9185-9190 |
| 4128743 | CIF | C69 H67 B F24 N4 O4 Th | P 1 21/c 1 | 19.401; 19.4715; 18.6191 90; 97.543; 90 | 6972.8 | Cheisson, Thibault; Kersey, Kyle D.; Mahieu, Nolwenn; McSkimming, Alex; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Multiple Bonding in Lanthanides and Actinides: Direct Comparison of Covalency in Thorium(IV)- and Cerium(IV)-Imido Complexes. Journal of the American Chemical Society, 2019, 141, 9185-9190 |
| 4128744 | CIF | C11 H9 Cl O2 | P 1 21 1 | 5.5115; 9.7152; 8.7681 90; 96.864; 90 | 466.126 | Chandgude, Ajay L.; Ren, Xinkun; Fasan, Rudi Stereodivergent Intramolecular Cyclopropanation Enabled by Engineered Carbene Transferases. Journal of the American Chemical Society, 2019, 141, 9145-9150 |
| 4128745 | CIF | C11 H9 Br O2 | P 1 21 1 | 5.6119; 9.6719; 8.9813 90; 97.545; 90 | 483.264 | Chandgude, Ajay L.; Ren, Xinkun; Fasan, Rudi Stereodivergent Intramolecular Cyclopropanation Enabled by Engineered Carbene Transferases. Journal of the American Chemical Society, 2019, 141, 9145-9150 |
| 4128746 | CIF | C11 H10 O2 | P 1 21 1 | 5.5659; 9.7305; 7.6693 90; 92.853; 90 | 414.847 | Chandgude, Ajay L.; Ren, Xinkun; Fasan, Rudi Stereodivergent Intramolecular Cyclopropanation Enabled by Engineered Carbene Transferases. Journal of the American Chemical Society, 2019, 141, 9145-9150 |
| 4128747 | CIF | C6 H6 N4 Zn | P b c a | 13.49627; 9.884103; 9.164619 90; 90; 90 | 1222.55 | Widmer, Remo N.; Lampronti, Giulio I.; Chibani, Siwar; Wilson, Craig W.; Anzellini, Simone; Farsang, Stefan; Kleppe, Annette K.; Casati, Nicola P. M.; MacLeod, Simon G.; Redfern, Simon A. T.; Coudert, François-Xavier; Bennett, Thomas D. Rich Polymorphism of a Metal-Organic Framework in Pressure-Temperature Space. Journal of the American Chemical Society, 2019, 141, 9330-9337 |
| 4128748 | CIF | C6 H6 N4 Zn | P b c a | 14.56659; 14.44478; 15.45102 90; 90; 90 | 3251.07 | Widmer, Remo N.; Lampronti, Giulio I.; Chibani, Siwar; Wilson, Craig W.; Anzellini, Simone; Farsang, Stefan; Kleppe, Annette K.; Casati, Nicola P. M.; MacLeod, Simon G.; Redfern, Simon A. T.; Coudert, François-Xavier; Bennett, Thomas D. Rich Polymorphism of a Metal-Organic Framework in Pressure-Temperature Space. Journal of the American Chemical Society, 2019, 141, 9330-9337 |
| 4128749 | CIF | C60 H44 N8 O13 | P 1 21/c 1 | 18.6187; 15.7648; 17.9841 90; 103.318; 90 | 5136.7 | Wang, Zhifang; Sikdar, Nivedita; Wang, Shi-Qiang; Li, Xia; Yu, Meihui; Bu, Xian-He; Chang, Ze; Zou, Xiaolong; Chen, Yao; Cheng, Peng; Yu, Kuang; Zaworotko, Michael J.; Zhang, Zhenjie Soft Porous Crystal Based upon Organic Cages That Exhibit Guest-Induced Breathing and Selective Gas Separation. Journal of the American Chemical Society, 2019, 141, 9408-9414 |
| 4128750 | CIF | C62 H46 Cl4 N8 O12 | P 1 21/c 1 | 20.7759; 15.7504; 18.2205 90; 97.372; 90 | 5913 | Wang, Zhifang; Sikdar, Nivedita; Wang, Shi-Qiang; Li, Xia; Yu, Meihui; Bu, Xian-He; Chang, Ze; Zou, Xiaolong; Chen, Yao; Cheng, Peng; Yu, Kuang; Zaworotko, Michael J.; Zhang, Zhenjie Soft Porous Crystal Based upon Organic Cages That Exhibit Guest-Induced Breathing and Selective Gas Separation. Journal of the American Chemical Society, 2019, 141, 9408-9414 |
| 4128751 | CIF | C9 H16 Cl I O2 | P 1 21 1 | 5.7307; 8.2795; 24.749 90; 91.3419; 90 | 1174 | Michalak, Sharon E.; Nam, Sangkil; Kwon, David M.; Horne, David A.; Vanderwal, Christopher D. A Chlorine-Atom-Controlled Terminal-Epoxide-Initiated Bicyclization Cascade Enables a Synthesis of the Potent Cytotoxins Haterumaimides J and K. Journal of the American Chemical Society, 2019, 141, 9202-9206 |
| 4128752 | CIF | C11.5 H15.5 Cl1.5 O4.5 | P 21 21 21 | 9.1874; 13.9904; 20.1638 90; 90; 90 | 2591.76 | Schuppe, Alexander W.; Zhao, Yizhou; Liu, Yannan; Newhouse, Timothy R. Total Synthesis of (+)-Granatumine A and Related Bislactone Limonoid Alkaloids via a Pyran to Pyridine Interconversion. Journal of the American Chemical Society, 2019, 141, 9191-9196 |
| 4128753 | CIF | C26 H27 N O6 | P 1 | 9.3675; 9.8446; 12.9472 89.972; 69.566; 79.485 | 1097.47 | Schuppe, Alexander W.; Zhao, Yizhou; Liu, Yannan; Newhouse, Timothy R. Total Synthesis of (+)-Granatumine A and Related Bislactone Limonoid Alkaloids via a Pyran to Pyridine Interconversion. Journal of the American Chemical Society, 2019, 141, 9191-9196 |
| 4128754 | CIF | C15 H16 O3 | P 21 21 21 | 6.0064; 12.4392; 16.1835 90; 90; 90 | 1209.15 | Schuppe, Alexander W.; Zhao, Yizhou; Liu, Yannan; Newhouse, Timothy R. Total Synthesis of (+)-Granatumine A and Related Bislactone Limonoid Alkaloids via a Pyran to Pyridine Interconversion. Journal of the American Chemical Society, 2019, 141, 9191-9196 |
| 4128755 | CIF | C106 H86 F24 N4 O P4 | P 1 21/n 1 | 23.025; 14.4111; 35.128 90; 107.619; 90 | 11109.2 | Li, Yawen; Dong, Yunhong; Cheng, Lin; Qin, Chunyan; Nian, Hao; Zhang, Haiyang; Yu, Yang; Cao, Liping Aggregation-Induced Emission and Light-Harvesting Function of Tetraphenylethene-Based Tetracationic Dicyclophane. Journal of the American Chemical Society, 2019, 141, 8412-8415 |
| 4128756 | CIF | C20 H35 N O3 Si | P 21 21 21 | 6.2765; 11.7617; 28.306 90; 90; 90 | 2089.61 | Hugelshofer, Cedric L.; Palani, Vignesh; Sarpong, Richmond Calyciphylline B-Type Alkaloids: Total Syntheses of (-)-Daphlongamine H and (-)-Isodaphlongamine H. Journal of the American Chemical Society, 2019, 141, 8431-8435 |
| 4128757 | CIF | C27 H43 N O3 Si | P 1 21 1 | 8.19798; 7.89375; 20.23662 90; 99.2147; 90 | 1292.67 | Hugelshofer, Cedric L.; Palani, Vignesh; Sarpong, Richmond Calyciphylline B-Type Alkaloids: Total Syntheses of (-)-Daphlongamine H and (-)-Isodaphlongamine H. Journal of the American Chemical Society, 2019, 141, 8431-8435 |
| 4128758 | CIF | C43 H50 N2 O13 S | P 21 21 21 | 5.89374; 26.1462; 26.91187 90; 90; 90 | 4147.09 | Zeng, Jing; Wang, Ruobin; Zhang, Shuxin; Fang, Jing; Liu, Shanshan; Sun, Guangfei; Xu, Bingbing; Xiao, Ying; Fu, Dengxian; Zhang, Wenqi; Hu, Yixin; Wan, Qian Hydrogen-Bonding-Assisted Exogenous Nucleophilic Reagent Effect for β-Selective Glycosylation of Rare 3-Amino Sugars. Journal of the American Chemical Society, 2019, 141, 8509-8515 |
| 4128759 | CIF | C27 H36 N4 O13 S2 | P 21 21 21 | 7.62899; 8.62984; 47.2575 90; 90; 90 | 3111.29 | Zeng, Jing; Wang, Ruobin; Zhang, Shuxin; Fang, Jing; Liu, Shanshan; Sun, Guangfei; Xu, Bingbing; Xiao, Ying; Fu, Dengxian; Zhang, Wenqi; Hu, Yixin; Wan, Qian Hydrogen-Bonding-Assisted Exogenous Nucleophilic Reagent Effect for β-Selective Glycosylation of Rare 3-Amino Sugars. Journal of the American Chemical Society, 2019, 141, 8509-8515 |
| 4128760 | CIF | C27 H33 N4 O13 S2 | P 1 21 1 | 7.6865; 29.0486; 8.7393 90; 111.856; 90 | 1811.07 | Zeng, Jing; Wang, Ruobin; Zhang, Shuxin; Fang, Jing; Liu, Shanshan; Sun, Guangfei; Xu, Bingbing; Xiao, Ying; Fu, Dengxian; Zhang, Wenqi; Hu, Yixin; Wan, Qian Hydrogen-Bonding-Assisted Exogenous Nucleophilic Reagent Effect for β-Selective Glycosylation of Rare 3-Amino Sugars. Journal of the American Chemical Society, 2019, 141, 8509-8515 |
| 4128761 | CIF | C27 H36 Fe N2 | P -4 | 13.877; 13.877; 12.2284 90; 90; 90 | 2354.84 | Kennedy, C. Rose; Zhong, Hongyu; Macaulay, Rachel L.; Chirik, Paul J. Regio- and Diastereoselective Iron-Catalyzed [4+4]-Cycloaddition of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 8557-8573 |
| 4128762 | CIF | C30 H40 Fe N2 | P 1 21/c 1 | 10.7415; 30.1238; 8.1904 90; 96.802; 90 | 2631.55 | Kennedy, C. Rose; Zhong, Hongyu; Macaulay, Rachel L.; Chirik, Paul J. Regio- and Diastereoselective Iron-Catalyzed [4+4]-Cycloaddition of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 8557-8573 |
| 4128763 | CIF | C38 H48 Fe N4 | P -1 | 9.6392; 9.8763; 18.4278 88.863; 80.655; 77.495 | 1689.76 | Kennedy, C. Rose; Zhong, Hongyu; Macaulay, Rachel L.; Chirik, Paul J. Regio- and Diastereoselective Iron-Catalyzed [4+4]-Cycloaddition of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 8557-8573 |
| 4128764 | CIF | C34.5 H42 Fe N4 | C 1 2/c 1 | 17.2244; 23.3339; 14.9504 90; 97.969; 90 | 5950.7 | Kennedy, C. Rose; Zhong, Hongyu; Macaulay, Rachel L.; Chirik, Paul J. Regio- and Diastereoselective Iron-Catalyzed [4+4]-Cycloaddition of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 8557-8573 |
| 4128765 | CIF | C42 H52 Fe N4 | P 1 21/c 1 | 13.2598; 20.1582; 14.9573 90; 115.941; 90 | 3595.2 | Kennedy, C. Rose; Zhong, Hongyu; Macaulay, Rachel L.; Chirik, Paul J. Regio- and Diastereoselective Iron-Catalyzed [4+4]-Cycloaddition of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 8557-8573 |
| 4128766 | CIF | C27 H42 Fe N2 O Si2 | P 1 21/c 1 | 16.216; 11.9385; 16.7276 90; 117.879; 90 | 2862.5 | Kennedy, C. Rose; Zhong, Hongyu; Macaulay, Rachel L.; Chirik, Paul J. Regio- and Diastereoselective Iron-Catalyzed [4+4]-Cycloaddition of 1,3-Dienes. Journal of the American Chemical Society, 2019, 141, 8557-8573 |
| 4128767 | CIF | C I3 N2.857 Pb0.48 Sn0.521 | P m -3 m | 6.2983; 6.2983; 6.2983 90; 90; 90 | 249.845 | Ke, Weijun; Spanopoulos, Ioannis; Tu, Qing; Hadar, Ido; Li, Xiaotong; Shekhawat, Gajendra S.; Dravid, Vinayak P.; Kanatzidis, Mercouri G. Ethylenediammonium-Based "Hollow" Pb/Sn Perovskites with Ideal Band Gap Yield Solar Cells with Higher Efficiency and Stability. Journal of the American Chemical Society, 2019, 141, 8627-8637 |
| 4128768 | CIF | C20 H48 Br F6 N2 P5 Re | P 1 21/n 1 | 10.0988; 11.366; 14.0353 90; 108.385; 90 | 1528.78 | Shanahan, James P.; Szymczak, Nathaniel K. Hydrogen Bonding to a Dinitrogen Complex at Room Temperature: Impacts on N<sub>2</sub> Activation. Journal of the American Chemical Society, 2019, 141, 8550-8556 |
| 4128769 | CIF | C27 H50 N2 O3 P2 Ru | C 1 2/c 1 | 35.0246; 12.2516; 16.0092 90; 107.546; 90 | 6550.1 | Mathis, Cheryl L.; Geary, Jackson; Ardon, Yotam; Reese, Maxwell S.; Philliber, Mallory A.; VanderLinden, Ryan T.; Saouma, Caroline T. Thermodynamic Analysis of Metal-Ligand Cooperativity of PNP Ru Complexes: Implications for CO<sub>2</sub> Hydrogenation to Methanol and Catalyst Inhibition. Journal of the American Chemical Society, 2019, 141, 14317-14328 |
| 4128770 | CIF | C66 H118 K2 N2 O10 P4 Ru2 | P 1 21 1 | 16.3158; 12.7484; 18.5646 90; 91.285; 90 | 3860.5 | Mathis, Cheryl L.; Geary, Jackson; Ardon, Yotam; Reese, Maxwell S.; Philliber, Mallory A.; VanderLinden, Ryan T.; Saouma, Caroline T. Thermodynamic Analysis of Metal-Ligand Cooperativity of PNP Ru Complexes: Implications for CO<sub>2</sub> Hydrogenation to Methanol and Catalyst Inhibition. Journal of the American Chemical Society, 2019, 141, 14317-14328 |
| 4128771 | CIF | C16 H16 Cu N10 O4 | P 43 3 2 | 20.262; 20.262; 20.262 90; 90; 90 | 8318.5 | Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society, 2019, 141, 14306-14316 |
| 4128772 | CIF | C8 H15 Cu0.5 N5 O5.5 | P 43 3 2 | 20.12; 20.12; 20.12 90; 90; 90 | 8145 | Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society, 2019, 141, 14306-14316 |
| 4128773 | CIF | C16 H25.33 Cu N10 O8.67 | P 43 3 2 | 20.172; 20.172; 20.172 90; 90; 90 | 8208.2 | Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society, 2019, 141, 14306-14316 |
| 4128774 | CIF | C16 H28.67 Cu N10 O9.67 | P 43 3 2 | 20.1133; 20.1133; 20.1133 90; 90; 90 | 8136.7 | Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society, 2019, 141, 14306-14316 |
| 4128775 | CIF | C120 H60 Hf6 N12 O32 | P 63/m m c | 28.6282; 28.6282; 25.6439 90; 90; 120 | 18201.3 | Zhao, Yanming; Qi, Shibo; Niu, Zheng; Peng, Yunlei; Shan, Chuan; Verma, Gaurav; Wojtas, Lukasz; Zhang, Zhenjie; Zhang, Bao; Feng, Yaqing; Chen, Yu-Sheng; Ma, Shengqian Robust Corrole-Based Metal-Organic Frameworks with Rare 9-Connected Zr/Hf-Oxo Clusters. Journal of the American Chemical Society, 2019, 141, 14443-14450 |
| 4128776 | CIF | C120 H60 N12 O32 Zr6 | P 63/m m c | 28.6282; 28.6282; 25.6439 90; 90; 120 | 18201.3 | Zhao, Yanming; Qi, Shibo; Niu, Zheng; Peng, Yunlei; Shan, Chuan; Verma, Gaurav; Wojtas, Lukasz; Zhang, Zhenjie; Zhang, Bao; Feng, Yaqing; Chen, Yu-Sheng; Ma, Shengqian Robust Corrole-Based Metal-Organic Frameworks with Rare 9-Connected Zr/Hf-Oxo Clusters. Journal of the American Chemical Society, 2019, 141, 14443-14450 |
| 4128777 | CIF | C23 H24 F3 N2 O3 P S | P 21 21 21 | 7.2319; 16.6606; 19.395 90; 90; 90 | 2336.9 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
| 4128778 | CIF | C27 H24 F3 N2 O3 P S | P 21 21 21 | 8.7349; 15.7636; 19.3258 90; 90; 90 | 2661 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
| 4128779 | CIF | C20 H17 F2 N O2 S | P 21 21 21 | 6.4655; 11.5138; 23.247 90; 90; 90 | 1730.6 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
| 4128780 | CIF | C23 H20 F3 N2 O3 P S3 | P 21 21 21 | 7.8209; 14.103; 22.253 90; 90; 90 | 2454.5 | Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. Enantioselective Imine Reduction Catalyzed by Phosphenium Ions. Journal of the American Chemical Society, 2019, 141, 14083-14088 |
| 4128781 | CIF | C189 H268 Pb4 | P 1 21/n 1 | 18.3288; 23.6315; 20.2841 90; 104.271; 90 | 8514.7 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128782 | CIF | C84 H122 Br2 Pb2 | P 1 21/n 1 | 14.946; 19.052; 28.498 90; 98.929; 90 | 8016 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128783 | CIF | C60 H74 Pb2 | P -1 | 9.1688; 12.7083; 13.0164 64.295; 81.679; 69.572 | 1280.6 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128784 | CIF | C70 H100 O Pb2 Si2 | P 1 21/c 1 | 11.4812; 25.639; 12.8116 90; 114.588; 90 | 3429.3 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128785 | CIF | C66 H90 Br2 Pb2 Si2 | P -1 | 11.3682; 12.7595; 12.9493 94.563; 103.15; 114.102 | 1637.9 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128786 | CIF | C84 H122 Pb2 | C 1 2/c 1 | 20.3372; 18.4518; 38.674 90; 90.3948; 90 | 14512 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128787 | CIF | C84 H122 Br2 Pb2 | C 1 2/c 1 | 14.6489; 26.975; 22.733 90; 105.484; 90 | 8657 | Queen, Joshua D.; Bursch, Markus; Seibert, Jakob; Maurer, Leonard R.; Ellis, Bobby D.; Fettinger, James C.; Grimme, Stefan; Power, Philip P. Isolation and Computational Studies of a Series of Terphenyl Substituted Diplumbynes with Ligand Dependent Lead-Lead Multiple-Bonding Character. Journal of the American Chemical Society, 2019, 141, 14370-14383 |
| 4128788 | CIF | C44 H96 Cr Li2 O13 Si4 | P 21 21 21 | 13.826; 20.1133; 20.2739 90; 90; 90 | 5637.9 | Wind, Marie-Louise; Hoof, Santina; Braun-Cula, Beatrice; Herwig, Christian; Limberg, Christian Switching from a Chromium(IV) Peroxide to a Chromium(III) Superoxide upon Coordination of a Donor in the trans Position. Journal of the American Chemical Society, 2019, 141, 14068-14072 |
| 4128789 | CIF | C20 H48 Cl3 Cr Li5 O9 Si4 | P 1 21/n 1 | 11.1725; 17.4237; 18.9652 90; 90.838; 90 | 3691.5 | Wind, Marie-Louise; Hoof, Santina; Braun-Cula, Beatrice; Herwig, Christian; Limberg, Christian Switching from a Chromium(IV) Peroxide to a Chromium(III) Superoxide upon Coordination of a Donor in the trans Position. Journal of the American Chemical Society, 2019, 141, 14068-14072 |
| 4128790 | CIF | C40 H88 Cr Li2 O10 Si4 | P b c a | 17.014; 16.181; 18.608 90; 90; 90 | 5122.8 | Wind, Marie-Louise; Hoof, Santina; Braun-Cula, Beatrice; Herwig, Christian; Limberg, Christian Switching from a Chromium(IV) Peroxide to a Chromium(III) Superoxide upon Coordination of a Donor in the trans Position. Journal of the American Chemical Society, 2019, 141, 14068-14072 |
| 4128791 | CIF | C21 H33 N3 O4.25 S Si | P 1 21 1 | 13.949; 9.712; 19.552 90; 110.621; 90 | 2479.1 | Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives. Journal of the American Chemical Society, 2019, 141, 14411-14420 |
| 4128792 | CIF | C34 H48 N4 O5 S Si | P 1 21 1 | 7.9317; 15.4939; 13.8939 90; 92.123; 90 | 1706.3 | Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives. Journal of the American Chemical Society, 2019, 141, 14411-14420 |
| 4128793 | CIF | C37 H48 N4 O4 S Si | P 21 21 21 | 7.8618; 17.7249; 27.6554 90; 90; 90 | 3853.77 | Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives. Journal of the American Chemical Society, 2019, 141, 14411-14420 |
| 4128794 | CIF | C39 H45 N3 O8 | P 21 21 21 | 8.1852; 30.4869; 31.5036 90; 90; 90 | 7861.5 | Boon, Byron A.; Boger, Dale L. Triarylaminium Radical Cation Promoted Coupling of Catharanthine with Vindoline: Diastereospecific Synthesis of Anhydrovinblastine and Reaction Scope. Journal of the American Chemical Society, 2019, 141, 14349-14355 |
| 4128795 | CIF | C39 H47 N3 O9 | P 1 21 1 | 10.6544; 15.3909; 10.7835 90; 96.457; 90 | 1757.07 | Boon, Byron A.; Boger, Dale L. Triarylaminium Radical Cation Promoted Coupling of Catharanthine with Vindoline: Diastereospecific Synthesis of Anhydrovinblastine and Reaction Scope. Journal of the American Chemical Society, 2019, 141, 14349-14355 |
| 4128796 | CIF | C19 H28 O3 | P -1 | 6.678; 9.4722; 13.577 72.958; 83.61; 77.293 | 799.99 | Boyko, Yaroslav D.; Huck, Christopher J.; Sarlah, David Total Synthesis of Isomalabaricane Triterpenoids. Journal of the American Chemical Society, 2019, 141, 14131-14135 |
| 4128797 | CIF | C31 H54 O3 Si | P 1 21/n 1 | 7.2188; 10.7692; 39.2149 90; 93.005; 90 | 3044.4 | Boyko, Yaroslav D.; Huck, Christopher J.; Sarlah, David Total Synthesis of Isomalabaricane Triterpenoids. Journal of the American Chemical Society, 2019, 141, 14131-14135 |
| 4128798 | CIF | Li2.33 P Si0.17 | F m -3 m | 5.93927; 5.93927; 5.93927 90; 90; 90 | 209.507 | Strangmüller, Stefan; Eickhoff, Henrik; Müller, David; Klein, Wilhelm; Raudaschl-Sieber, Gabriele; Kirchhain, Holger; Sedlmeier, Christian; Baran, Volodymyr; Senyshyn, Anatoliy; Deringer, Volker L.; van Wüllen, Leo; Gasteiger, Hubert A.; Fässler, Thomas F Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li<sub>14</sub>SiP<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 14200-14209 |
| 4128799 | CIF | Li2.33 P Si0.17 | F m -3 m | 5.9253; 5.9253; 5.9253 90; 90; 90 | 208.03 | Strangmüller, Stefan; Eickhoff, Henrik; Müller, David; Klein, Wilhelm; Raudaschl-Sieber, Gabriele; Kirchhain, Holger; Sedlmeier, Christian; Baran, Volodymyr; Senyshyn, Anatoliy; Deringer, Volker L.; van Wüllen, Leo; Gasteiger, Hubert A.; Fässler, Thomas F Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li<sub>14</sub>SiP<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 14200-14209 |
| 4128800 | CIF | Li2.33 P Si0.17 | F m -3 m | 5.91566; 5.91566; 5.91566 90; 90; 90 | 207.019 | Strangmüller, Stefan; Eickhoff, Henrik; Müller, David; Klein, Wilhelm; Raudaschl-Sieber, Gabriele; Kirchhain, Holger; Sedlmeier, Christian; Baran, Volodymyr; Senyshyn, Anatoliy; Deringer, Volker L.; van Wüllen, Leo; Gasteiger, Hubert A.; Fässler, Thomas F Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li<sub>14</sub>SiP<sub>6</sub>. Journal of the American Chemical Society, 2019, 141, 14200-14209 |
| 4128801 | CIF | C38 H32 Cl2 Fe N8 O12 | P 1 21/n 1 | 16.5756; 15.8984; 17.2953 90; 118.081; 90 | 4021.2 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
| 4128802 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.8192; 15.8059; 17.0759 90; 117.852; 90 | 4013.6 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
| 4128803 | CIF | C38 H32 Cl2 Fe N8 O12 | P 1 21/n 1 | 16.3409; 15.5665; 16.8955 90; 117.187; 90 | 3822.9 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
| 4128804 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.4896; 16.0053; 16.6301 90; 116.615; 90 | 3924 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
| 4128805 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.5677; 16.0511; 16.6587 90; 116.445; 90 | 3966.5 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
| 4128806 | CIF | C36 H26 As2 Cl2 F12 Fe N8 O2 | P 1 21/n 1 | 16.876; 16.172; 17.2329 90; 117.797; 90 | 4160.5 | Nakanishi, Takumi; Hori, Yuta; Sato, Hiroyasu; Wu, Shu-Qi; Okazawa, Atsushi; Kojima, Norimichi; Yamamoto, Takashi; Einaga, Yasuaki; Hayami, Shinya; Horie, Yusuke; Okajima, Hajime; Sakamoto, Akira; Shiota, Yoshihito; Yoshizawa, Kazunari; Sato, Osamu Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex. Journal of the American Chemical Society, 2019, 141, 14384-14393 |
| 4128807 | CIF | C19 H17 N O3 | P 1 | 7.6636; 9.5929; 10.8499 86.249; 76.166; 79.11 | 760.39 | Spielmann, Kim; Xiang, Ming; Schwartz, Leyah A.; Krische, Michael J. Direct Conversion of Primary Alcohols to 1,2-Amino Alcohols: Enantioselective Iridium-Catalyzed Carbonyl Reductive Coupling of Phthalimido-Allene via Hydrogen Auto-Transfer. Journal of the American Chemical Society, 2019, 141, 14136-14141 |
| 4128808 | CIF | C16 H17 N O3 | P 1 21 1 | 8.3815; 22.425; 8.6781 90; 117.675; 90 | 1444.49 | Spielmann, Kim; Xiang, Ming; Schwartz, Leyah A.; Krische, Michael J. Direct Conversion of Primary Alcohols to 1,2-Amino Alcohols: Enantioselective Iridium-Catalyzed Carbonyl Reductive Coupling of Phthalimido-Allene via Hydrogen Auto-Transfer. Journal of the American Chemical Society, 2019, 141, 14136-14141 |
| 4128809 | CIF | C58 H55 Ir N2 O7 P2 | P 21 21 21 | 14.339; 17.764; 18.92 90; 90; 90 | 4819.3 | Spielmann, Kim; Xiang, Ming; Schwartz, Leyah A.; Krische, Michael J. Direct Conversion of Primary Alcohols to 1,2-Amino Alcohols: Enantioselective Iridium-Catalyzed Carbonyl Reductive Coupling of Phthalimido-Allene via Hydrogen Auto-Transfer. Journal of the American Chemical Society, 2019, 141, 14136-14141 |
| 4128810 | CIF | C176 H230 Au24 N Pt S18 | P -1 | 16.136; 17.35; 18.583 106.541; 105.313; 90.983 | 4786.1 | Suyama, Megumi; Takano, Shinjiro; Nakamura, Toshikazu; Tsukuda, Tatsuya Stoichiometric Formation of Open-Shell [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>-</sup> via Spontaneous Electron Proportionation between [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>2-</sup> and [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>0</sup>. Journal of the American Chemical Society, 2019, 141, 14048-14051 |
| 4128811 | CIF | C158 H178 Au24 Pt S18 | P -1 | 16.134; 17.69; 17.7811 65.139; 64.59; 81.463 | 4156 | Suyama, Megumi; Takano, Shinjiro; Nakamura, Toshikazu; Tsukuda, Tatsuya Stoichiometric Formation of Open-Shell [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>-</sup> via Spontaneous Electron Proportionation between [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>2-</sup> and [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>0</sup>. Journal of the American Chemical Society, 2019, 141, 14048-14051 |
| 4128812 | CIF | C208 H298 Au24 N2 Pt S18 | C 1 2/c 1 | 22.837; 34.096; 29.287 90; 90.867; 90 | 22802 | Suyama, Megumi; Takano, Shinjiro; Nakamura, Toshikazu; Tsukuda, Tatsuya Stoichiometric Formation of Open-Shell [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>-</sup> via Spontaneous Electron Proportionation between [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>2-</sup> and [PtAu<sub>24</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>18</sub>]<sup>0</sup>. Journal of the American Chemical Society, 2019, 141, 14048-14051 |
| 4128813 | CIF | C100 H120 B6 F24 N26 O6 Zn3 | P 21 21 2 | 52.6707; 18.785; 17.85193 90; 90; 90 | 17663 | Zhong, Jiankang; Zhang, Liang; August, David P.; Whitehead, George F. S.; Leigh, David A. Self-Sorting Assembly of Molecular Trefoil Knots of Single Handedness. Journal of the American Chemical Society, 2019, 141, 14249-14256 |
| 4128814 | CIF | C251 H287 B18 F72 N54 O18 Zn9 | P 21 21 2 | 51.9276; 18.8837; 18.2355 90; 90; 90 | 17881.5 | Zhong, Jiankang; Zhang, Liang; August, David P.; Whitehead, George F. S.; Leigh, David A. Self-Sorting Assembly of Molecular Trefoil Knots of Single Handedness. Journal of the American Chemical Society, 2019, 141, 14249-14256 |
| 4128815 | CIF | C98 H114 B3 Co3 F12 N22 O12 | C 1 2 1 | 17.4608; 20.0262; 17.657 90; 113.308; 90 | 5670.3 | Zhong, Jiankang; Zhang, Liang; August, David P.; Whitehead, George F. S.; Leigh, David A. Self-Sorting Assembly of Molecular Trefoil Knots of Single Handedness. Journal of the American Chemical Society, 2019, 141, 14249-14256 |
| 4128816 | CIF | C48 H24 O6 | P -1 | 13.0079; 14.5518; 18.7581 67.779; 76.113; 79.561 | 3174.7 | Martínez-Abadía, Marta; Stoppiello, Craig T.; Strutynski, Karol; Lerma-Berlanga, Belén; Martí-Gastaldo, Carlos; Saeki, Akinori; Melle-Franco, Manuel; Khlobystov, Andrei N.; Mateo-Alonso, Aurelio A Wavy Two-Dimensional Covalent Organic Framework from Core-Twisted Polycyclic Aromatic Hydrocarbons. Journal of the American Chemical Society, 2019, 141, 14403-14410 |
| 4128817 | CIF | C8 H4 Al O7.61 | I m m a | 16.188; 6.624; 13.52 90; 90; 90 | 1449.7 | Chen, Shoushun; Mukherjee, Soumya; Lucier, Bryan E. G.; Guo, Ying; Wong, Y. T. Angel; Terskikh, Victor V.; Zaworotko, Michael J.; Huang, Yining Cleaving Carboxyls: Understanding Thermally Triggered Hierarchical Pores in the Metal-Organic Framework MIL-121. Journal of the American Chemical Society, 2019, 141, 14257-14271 |
| 4128818 | CIF | Fe4 N0.42 Se4.48 | I 4/m m m | 3.8605; 3.8605; 15.8008 90; 90; 90 | 235.487 | Sun, Ruijin; Jin, Shifeng; Gu, Lin; Zhang, Qinghua; Huang, Qingzhen; Ying, Tianping; Peng, YiRan; Deng, Jun; Yin, Zhiping; Chen, Xiaolong Intercalating Anions between Terminated Anion Layers: Unusual Ionic S-Se Bonds and Hole-Doping Induced Superconductivity in S<sub>0.24</sub>(NH<sub>3</sub>)<sub>0.26</sub>Fe<sub>2</sub>Se<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 13849-13857 |
| 4128819 | CIF | Fe4 N0.48 S0.24 Se4 | I 4/m m m | 3.8528; 3.8528; 15.233 90; 90; 90 | 226.12 | Sun, Ruijin; Jin, Shifeng; Gu, Lin; Zhang, Qinghua; Huang, Qingzhen; Ying, Tianping; Peng, YiRan; Deng, Jun; Yin, Zhiping; Chen, Xiaolong Intercalating Anions between Terminated Anion Layers: Unusual Ionic S-Se Bonds and Hole-Doping Induced Superconductivity in S<sub>0.24</sub>(NH<sub>3</sub>)<sub>0.26</sub>Fe<sub>2</sub>Se<sub>2</sub>. Journal of the American Chemical Society, 2019, 141, 13849-13857 |
| 4128820 | CIF | C24 H33 N O4 | P 1 21/n 1 | 17.1722; 6.3329; 21.8632 90; 102.144; 90 | 2324.41 | Shu, Wei; García-Domínguez, Andrés; Quirós, M Teresa; Mondal, Rahul; Cárdenas, Diego J; Nevado, Cristina Ni-Catalyzed Reductive Dicarbofunctionalization of Nonactivated Alkenes: Scope and Mechanistic Insights. Journal of the American Chemical Society, 2019, 141, 13812-13821 |
| 4128821 | CIF | C35 H49 N O8 | P 1 n 1 | 16.03406; 5.88869; 18.24264 90; 91.1868; 90 | 1722.09 | Shu, Wei; García-Domínguez, Andrés; Quirós, M Teresa; Mondal, Rahul; Cárdenas, Diego J; Nevado, Cristina Ni-Catalyzed Reductive Dicarbofunctionalization of Nonactivated Alkenes: Scope and Mechanistic Insights. Journal of the American Chemical Society, 2019, 141, 13812-13821 |
| 4128822 | CIF | C77.88 H69.7 B2 Cl N4 | P -1 | 12.0361; 15.2317; 16.9141 94.8002; 102.961; 92.4223 | 3005.3 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128823 | CIF | C66 H55 B2 Cl F4 N4 | P 1 21/c 1 | 19.5364; 16.2465; 18.3739 90; 110.386; 90 | 5466.6 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128824 | CIF | C60 H50 B2 Cl F3 N4 | P -1 | 7.9791; 13.3099; 24.0035 88.605; 82.443; 87.184 | 2523.59 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128825 | CIF | C74 H77 B2 Cl2 N5 | P -1 | 14.2653; 15.3826; 15.3931 96.7682; 99.396; 107.461 | 3128.59 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128826 | CIF | C83.5 H75 B2 Cl N4 | P -1 | 11.6604; 15.3379; 19.2293 72.822; 81.704; 86.546 | 3250.7 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128827 | CIF | C66 H59 B2 Cl F6 N4 O | P 1 21/n 1 | 19.6907; 14.3623; 19.9646 90; 98.5582; 90 | 5583.2 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128828 | CIF | C61 H50 B2 Cl3 F5 N4 | P 1 21/c 1 | 19.0799; 16.0622; 18.6758 90; 110.76; 90 | 5351.9 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128829 | CIF | C60 H51 B2 Cl2 F N4 | P -1 | 7.9297; 13.2859; 23.9485 88.5324; 82.9959; 87.8142 | 2501.84 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128830 | CIF | C60 H53 B2 Cl N4 | P 1 21/n 1 | 11.7205; 28.0408; 15.0652 90; 93.355; 90 | 4942.7 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128831 | CIF | C70.85 H62.7 B2 Cl N4 | P -1 | 12.0725; 15.2456; 15.3727 102.786; 91.599; 93.628 | 2751.1 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128832 | CIF | C61 H50 B2 Cl4 F4 N4 | P 1 21/c 1 | 19.3413; 16.1624; 18.4816 90; 111.136; 90 | 5388.7 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128833 | CIF | C61 H64 B N5 | P -1 | 11.9887; 13.3305; 16.2603 90.7115; 100.257; 101.531 | 2502.4 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128834 | CIF | C54 H47 B2 Cl N4 | P -1 | 13.1184; 13.2082; 25.291 87.7958; 87.8829; 89.479 | 4375.8 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128835 | CIF | C82.5 H71 B2 Cl N4 | P -1 | 12.2016; 15.2052; 17.0465 96.263; 97.224; 92.9468 | 3112 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128836 | CIF | C61 H55 B2 Cl3 N4 | P 1 21/n 1 | 16.2643; 18.3466; 17.5397 90; 99.7639; 90 | 5157.9 | Su, Yuanting; Huan Do, Dinh Cao; Li, Yongxin; Kinjo, Rei Metal-Free Selective Borylation of Arenes by a Diazadiborinine via C-H/C-F Bond Activation and Dearomatization. Journal of the American Chemical Society, 2019, 141, 13729-13733 |
| 4128837 | CIF | C42 H28 N2 O2 | P 1 21/n 1 | 6.1503; 12.927; 21.54 90; 90.01; 90 | 1712.5 | Li, Yusen; Chen, Qing; Xu, Tiantian; Xie, Zhen; Liu, Jingjuan; Yu, Xiang; Ma, Shengqian; Qin, Tianshi; Chen, Long De Novo Design and Facile Synthesis of 2D Covalent Organic Frameworks: A Two-in-One Strategy. Journal of the American Chemical Society, 2019, 141, 13822-13828 |
| 4128838 | CIF | C28 H35 N O4 | P 1 21/n 1 | 12.73; 8.7313; 20.2583 90; 94.11; 90 | 2245.9 | Owens, Kyle R.; McCowen, Shelby V.; Blackford, Katherine A.; Ueno, Sohei; Hirooka, Yasuo; Weber, Manuel; Sarpong, Richmond Total Synthesis of the Diterpenoid Alkaloid Arcutinidine Using a Strategy Inspired by Chemical Network Analysis. Journal of the American Chemical Society, 2019, 141, 13713-13717 |
| 4128839 | CIF | C22 H19 N5 O | P 1 21/n 1 | 19.4305; 11.3245; 9.1511 90; 95.302; 90 | 2005 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128840 | CIF | C22 H19 N5 O | P -1 | 8.2116; 11.5104; 11.8746 102.001; 105.368; 102.349 | 1014.6 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128841 | CIF | C22 H19 N5 O | P -1 | 7.7119; 8.9111; 14.617 81.906; 78.799; 75.258 | 948.5 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128842 | CIF | C22 H19 N5 O | P 1 21/n 1 | 18.9981; 9.8532; 21.8829 90; 113.219; 90 | 3764.5 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128843 | CIF | C22 H19 N5 O | P 1 21/c 1 | 8.2599; 19.6072; 12.6913 90; 116.545; 90 | 1838.73 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128844 | CIF | C22 H19 N5 O | P 1 21/n 1 | 10.727; 14.4711; 12.705 90; 107.112; 90 | 1884.91 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128845 | CIF | C22 H19 N5 O | P -1 | 8.134; 12.62; 18.059 86.707; 100.094; 83.303 | 1806.9 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128846 | CIF | C22 H19 N5 O | P -1 | 8.5537; 11.3718; 11.5674 65.784; 105.495; 77.315 | 916.89 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128847 | CIF | C22 H19 N5 O | P 1 21/c 1 | 11.3011; 20.8473; 8.10637 90; 98.879; 90 | 1886.95 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128848 | CIF | C22 H19 N5 O | C 1 2/c 1 | 27.938; 8.0817; 22.004 90; 133.55; 90 | 3601 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128849 | CIF | C22 H19 N5 O | C 1 2/c 1 | 27.654; 8.108; 21.934 90; 133.41; 90 | 3573 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128850 | CIF | C23 H23 N5 O2 | P 1 21/n 1 | 8.0458; 22.6024; 11.2097 90; 106.274; 90 | 1956.85 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128851 | CIF | C24 H25 N5 O2 | P -1 | 8.082; 9.258; 15.525 73.338; 89.974; 84.594 | 1107.48 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128852 | CIF | C22 H21 N5 O2 | P 1 21/n 1 | 9.0505; 11.3624; 19.1323 90; 94.954; 90 | 1960.1 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128853 | CIF | C25 H27 N5 O2 | P -1 | 7.772; 11.8319; 12.8267 89.03; 74.293; 82.225 | 1124.8 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128854 | CIF | C26 H29 N5 O2 | P -1 | 8.1145; 12.0611; 12.5401 88.454; 79.842; 76.813 | 1176.1 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128855 | CIF | C26 H29 N5 O2 | P 1 | 8.1676; 11.9112; 12.7014 89.4745; 81.236; 75.9211 | 1184.05 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128856 | CIF | C27 H31 N5 O2 | P -1 | 8.0879; 12.3578; 12.8909 85.722; 77.875; 74.707 | 1214.83 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128857 | CIF | C30 H35 N5 O5 | P -1 | 10.6011; 11.6654; 12.5667 69.035; 86.603; 81.573 | 1435.49 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128858 | CIF | C24 H25 N5 O3 | P -1 | 7.7332; 11.4956; 12.1986 85.299; 84.505; 85.518 | 1073.11 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128859 | CIF | C26 H28 N6 O2 | P -1 | 8.6946; 10.964; 12.9344 77.737; 88.5612; 79.1558 | 1183.21 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128860 | CIF | C26 H27 N5 O2 | P -1 | 8.3929; 11.7452; 12.0347 92.483; 106.415; 97.071 | 1125.52 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128861 | CIF | C23 H21 Cl2 N5 O | P -1 | 8.4961; 10.3766; 12.7043 103.239; 91.904; 94.505 | 1085.37 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128862 | CIF | C26 H27 N5 O2 | P -1 | 9.8533; 11.2079; 11.5743 101.869; 105.813; 105.56 | 1129.91 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128863 | CIF | C26 H29 N5 O2 | P -1 | 8.184; 12.0219; 12.6533 89.543; 81.238; 75.349 | 1189.8 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128864 | CIF | C24 H25 N5 O2 | P -1 | 8.11; 11.6569; 12.7599 90.026; 99.248; 101.238 | 1167.15 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128865 | CIF | C24 H23 N5 O3 | P -1 | 9.5331; 10.9792; 11.6291 66.668; 65.944; 78.915 | 1019.9 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128866 | CIF | C25 H27 N5 O2 | P -1 | 8.048; 11.4825; 12.8727 89.28; 80.416; 79.313 | 1152.4 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128867 | CIF | C27 H28 N5 O2 | P -1 | 8.5823; 11.0257; 12.7778 101.925; 92.429; 97.579 | 1169.7 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128868 | CIF | C26 H27 N5 O2 | P 1 21/c 1 | 12.1495; 8.4511; 20.111 90; 93.551; 90 | 2061 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128869 | CIF | C27 H28 N6 O2 | P 1 21/c 1 | 9.966; 33.73; 7.3404 90; 106.892; 90 | 2361 | Bhardwaj, Rajni M.; McMahon, Jennifer A.; Nyman, Jonas; Price, Louise S.; Konar, Sumit; Oswald, Iain D. H.; Pulham, Colin R.; Price, Sarah L.; Reutzel-Edens, Susan M A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs. Journal of the American Chemical Society, 2019, 141, 13887-13897 |
| 4128870 | CIF | C25 H35 N O3 | P 21 21 21 | 7.2979; 12.0524; 23.9963 90; 90; 90 | 2110.65 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
| 4128871 | CIF | C25 H35 N O3 | P 21 21 21 | 11.5553; 21.4201; 26.2735 90; 90; 90 | 6503.1 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
| 4128872 | CIF | C19 H28 O4 | P 21 21 21 | 7.1018; 13.3284; 17.4801 90; 90; 90 | 1654.59 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
| 4128873 | CIF | C24 H33 N O3 | P 21 21 21 | 7.3364; 11.6884; 23.7649 90; 90; 90 | 2037.86 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
| 4128874 | CIF | C18 H22 O4 | P 21 21 21 | 7.644; 13.4193; 14.4712 90; 90; 90 | 1484.41 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
| 4128875 | CIF | C20 H28 N O2.5 | C 2 2 21 | 12.1921; 15.8104; 17.6415 90; 90; 90 | 3400.61 | Zhou, Shupeng; Xia, Kaifu; Leng, Xuebing; Li, Ang Asymmetric Total Synthesis of Arcutinidine, Arcutinine, and Arcutine. Journal of the American Chemical Society, 2019, 141, 13718-13723 |
| 4128876 | CIF | C23.25 H20.5 F2 N2 O5 | P 1 21/c 1 | 12.9425; 8.5046; 19.818 90; 96.031; 90 | 2169.3 | Wang, Xin-Gang; Li, Yuke; Liu, Hong-Chao; Zhang, Bo-Sheng; Gou, Xue-Ya; Wang, Qiang; Ma, Jun-Wei; Liang, Yong-Min Three-Component Ruthenium-Catalyzed Direct <i>Meta-</i>Selective C-H Activation of Arenes: A New Approach to the Alkylarylation of Alkenes. Journal of the American Chemical Society, 2019, 141, 13914-13922 |
| 4128877 | CIF | C19 H38 N3 Sc | P n a 21 | 21.47; 12.655; 7.559 90; 90; 90 | 2053.8 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
| 4128878 | CIF | C19 H55 Al4 Sc3 | P 1 21/n 1 | 9.9815; 40.493; 15.7504 90; 91.391; 90 | 6364.1 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
| 4128879 | CIF | C24 H42 Al Sc | P -1 | 11.21; 14.35; 14.56 84.12; 89.11; 88.79 | 2329 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
| 4128880 | CIF | C18 H39 Al2 Sc | P 21 21 21 | 14.335; 16.914; 54.801 90; 90; 90 | 13287 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
| 4128881 | CIF | C15 H45 Al4 Sc | P 1 21/n 1 | 7.3336; 19.8137; 17.4587 90; 95.903; 90 | 2523.4 | Barisic, Damir; Diether, Dominic; Maichle-Mössmer, Cäcilia; Anwander, Reiner Trimethylscandium. Journal of the American Chemical Society, 2019, 141, 13931-13940 |
| 4128882 | CIF | C18 H20 O2 | P 21 21 21 | 7.43535; 12.70493; 15.2334 90; 90; 90 | 1439.03 | Ma, Dengke; Miao, Chun-Bao; Sun, Jianwei Catalytic Enantioselective House-Meinwald Rearrangement: Efficient Construction of All-Carbon Quaternary Stereocenters. Journal of the American Chemical Society, 2019, 141, 13783-13787 |
| 4128883 | CIF | C19 H17 F3 O2 | P 21 21 21 | 9.81945; 10.42071; 15.41623 90; 90; 90 | 1577.48 | Ma, Dengke; Miao, Chun-Bao; Sun, Jianwei Catalytic Enantioselective House-Meinwald Rearrangement: Efficient Construction of All-Carbon Quaternary Stereocenters. Journal of the American Chemical Society, 2019, 141, 13783-13787 |
| 4128884 | CIF | C312 H160 N20 O60 Zn21 | P m -3 m | 43.4917; 43.4917; 43.4917 90; 90; 90 | 82266 | Qiu, Yu-Chen; Yuan, Shuai; Li, Xiao-Xin; Du, Dong-Ying; Wang, Cong; Qin, Jun-Sheng; Drake, Hannah F.; Lan, Ya-Qian; Jiang, Lei; Zhou, Hong-Cai Face-Sharing Archimedean Solids Stacking for the Construction of Mixed-Ligand Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 13841-13848 |
| 4128885 | CIF | C128 H80 N4 O32 Zr6 | P m -3 m | 27.4034; 27.4034; 27.4034 90; 90; 90 | 20578.5 | Qiu, Yu-Chen; Yuan, Shuai; Li, Xiao-Xin; Du, Dong-Ying; Wang, Cong; Qin, Jun-Sheng; Drake, Hannah F.; Lan, Ya-Qian; Jiang, Lei; Zhou, Hong-Cai Face-Sharing Archimedean Solids Stacking for the Construction of Mixed-Ligand Metal-Organic Frameworks. Journal of the American Chemical Society, 2019, 141, 13841-13848 |
| 4128886 | CIF | C27 H32 F N S | C 2 2 21 | 9.9111; 19.1719; 24.772 90; 90; 90 | 4707.04 | Roth, Aaron; Denmark, Scott E. Enantioselective, Lewis Base-Catalyzed, Intermolecular Sulfenoamination of Alkenes. Journal of the American Chemical Society, 2019, 141, 13767-13771 |
| 4128887 | CIF | C30 H102 Ba Cu6 N6 O56 S3 | P 63 | 17.9066; 17.9066; 13.218 90; 90; 120 | 3670.48 | Mon, Marta; Bruno, Rosaria; Tiburcio, Estefania; Viciano-Chumillas, Marta; Kalinke, Lucas H. G.; Ferrando-Soria, Jesús; Armentano, Donatella; Pardo, Emilio Multivariate Metal-Organic Frameworks for the Simultaneous Capture of Organic and Inorganic Contaminants from Water. Journal of the American Chemical Society, 2019, 141, 13601-13609 |
| 4128888 | CIF | C42 H70 Ca Cl3 Cu6 Hg N7 O30 S4 | P 63 | 17.969; 17.969; 12.949 90; 90; 120 | 3620.9 | Mon, Marta; Bruno, Rosaria; Tiburcio, Estefania; Viciano-Chumillas, Marta; Kalinke, Lucas H. G.; Ferrando-Soria, Jesús; Armentano, Donatella; Pardo, Emilio Multivariate Metal-Organic Frameworks for the Simultaneous Capture of Organic and Inorganic Contaminants from Water. Journal of the American Chemical Society, 2019, 141, 13601-13609 |
| 4128889 | CIF | C30 H100 Ca Cu6 N6 O55 S3 | P 63 | 17.7932; 17.7932; 12.7581 90; 90; 120 | 3498 | Mon, Marta; Bruno, Rosaria; Tiburcio, Estefania; Viciano-Chumillas, Marta; Kalinke, Lucas H. G.; Ferrando-Soria, Jesús; Armentano, Donatella; Pardo, Emilio Multivariate Metal-Organic Frameworks for the Simultaneous Capture of Organic and Inorganic Contaminants from Water. Journal of the American Chemical Society, 2019, 141, 13601-13609 |
| 4128890 | CIF | C15 H20 N4 O3 | P 1 21 1 | 10.1878; 7.9625; 19.59 90; 99.557; 90 | 1567.1 | Glachet, Thomas; Marzag, Hamid; Saraiva Rosa, Nathalie; Colell, Johannes F. P.; Zhang, Guannan; Warren, Warren S.; Franck, Xavier; Theis, Thomas; Reboul, Vincent Iodonitrene in Action: Direct Transformation of Amino Acids into Terminal Diazirines and <sup>15</sup>N<sub>2</sub>-Diazirines and Their Application as Hyperpolarized Markers. Journal of the American Chemical Society, 2019, 141, 13689-13696 |
| 4128891 | CIF | C125.82 H130.19 B Cl2.45 Fe4 N3 O1.27 P3 S4 | P 1 21/c 1 | 22.6783; 19.0664; 27.5418 90; 106.247; 90 | 11433.3 | Ye, Mengshan; Thompson, Niklas B.; Brown, Alexandra C.; Suess, Daniel L. M. A Synthetic Model of Enzymatic [Fe<sub>4</sub>S<sub>4</sub>]-Alkyl Intermediates. Journal of the American Chemical Society, 2019, 141, 13330-13335 |
| 4128892 | CIF | C130 H141 B Fe4 N3 O2 P3 S4 | P 1 21/n 1 | 16.597; 30.822; 22.933 90; 95.023; 90 | 11686 | Ye, Mengshan; Thompson, Niklas B.; Brown, Alexandra C.; Suess, Daniel L. M. A Synthetic Model of Enzymatic [Fe<sub>4</sub>S<sub>4</sub>]-Alkyl Intermediates. Journal of the American Chemical Society, 2019, 141, 13330-13335 |
| 4128893 | CIF | C80 H183 Mo2 N5 O60 Te W16 | R -3 :H | 44.713; 44.713; 47.217 90; 90; 120 | 81752 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128894 | CIF | C22 H119 Mo3 N11 Na O96 Se2 W21 | P n m a | 20.577; 21.446; 25.391 90; 90; 90 | 11205 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128895 | CIF | C20 H113 Mo3 N10 Na2 O96 P2 W21 | P n m a | 35.244; 21.9528; 15.0516 90; 90; 90 | 11645.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128896 | CIF | C22 H120 Mo3 N11 Na O96 P Te W21 | P n m a | 35.22; 22.1684; 15.0386 90; 90; 90 | 11741.7 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128897 | CIF | C14 H79 Mo2 N7 O70 Te W16 | R -3 m :H | 21.1678; 21.1678; 15.6954 90; 90; 120 | 6090.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128898 | CIF | C14 H79 Mo2 N7 O70 Se W16 | R -3 m :H | 21.169; 21.169; 15.8379 90; 90; 120 | 6146.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128899 | CIF | C20 H112 Mo2 N10 Na O96 P Se W22 | P a -3 | 22.557; 22.557; 22.557 90; 90; 90 | 11477.4 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128900 | CIF | C14 H90 Mo2 N7 O75 P W16 | R -3 m :H | 21.5987; 21.5987; 13.9195 90; 90; 120 | 5623.5 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128901 | CIF | C32 H161 Mo4 N16 O117 P3 W26 | C m c e | 21.7592; 26.906; 25.728 90; 90; 90 | 15063 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128902 | CIF | C60 H291 Mo4 N30 Na O251 Se7 W62 | P -1 | 17.7735; 20.1721; 22.3319 99.133; 102.654; 96.166 | 7628.6 | Zheng, Qi; Kupper, Manuel; Xuan, Weimin; Oki, Hirofumi; Tsunashima, Ryo; Long, De-Liang; Cronin, Leroy Anisotropic Polyoxometalate Cages Assembled via Layers of Heteroanion Templates. Journal of the American Chemical Society, 2019, 141, 13479-13486 |
| 4128903 | CIF | C33 H40 B F4 Fe O4 P | P -1 | 9.9636; 12.7003; 13.9821 80.831; 69.746; 70.594 | 1563.6 | Geeson, Michael B.; Transue, Wesley J.; Cummins, Christopher C. Organoiron- and Fluoride-Catalyzed Phosphinidene Transfer to Styrenic Olefins in a Stereoselective Synthesis of Unprotected Phosphiranes. Journal of the American Chemical Society, 2019, 141, 13336-13340 |
| 4128904 | CIF | C19 H22 B F4 Fe O2 P | P b c a | 13.826; 16.6549; 17.2897 90; 90; 90 | 3981.3 | Geeson, Michael B.; Transue, Wesley J.; Cummins, Christopher C. Organoiron- and Fluoride-Catalyzed Phosphinidene Transfer to Styrenic Olefins in a Stereoselective Synthesis of Unprotected Phosphiranes. Journal of the American Chemical Society, 2019, 141, 13336-13340 |
| 4128905 | CIF | C18 H21 N O6 | P 21 21 21 | 8.605; 19.697; 30.793 90; 90; 90 | 5219 | Zheng, Jian; Swords, Wesley B.; Jung, Hoimin; Skubi, Kazimer L.; Kidd, Jesse B.; Meyer, Gerald J.; Baik, Mu-Hyun; Yoon, Tehshik P. Enantioselective Intermolecular Excited-State Photoreactions Using a Chiral Ir Triplet Sensitizer: Separating Association from Energy Transfer in Asymmetric Photocatalysis. Journal of the American Chemical Society, 2019, 141, 13625-13634 |
| 4128906 | CIF | C16 H15 I N2 O4 | P 1 21 1 | 9.094; 7.248; 11.749 90; 96.62; 90 | 769.3 | Zheng, Jian; Swords, Wesley B.; Jung, Hoimin; Skubi, Kazimer L.; Kidd, Jesse B.; Meyer, Gerald J.; Baik, Mu-Hyun; Yoon, Tehshik P. Enantioselective Intermolecular Excited-State Photoreactions Using a Chiral Ir Triplet Sensitizer: Separating Association from Energy Transfer in Asymmetric Photocatalysis. Journal of the American Chemical Society, 2019, 141, 13625-13634 |
| 4128907 | CIF | C32 H16 N8 O16 Zr3 | P n n m | 30.977; 20.52; 22.213 90; 90; 90 | 14120 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
| 4128908 | CIF | C64 Cl22 N16 Ni14 O47 Zr6 | P n n m | 31.4535; 19.638; 21.9912 90; 90; 90 | 13583.6 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
| 4128909 | CIF | C32 H16 Br5 N8 Ni3 O26 Zr3 | P n n m | 31.698; 18.59; 22.055 90; 90; 90 | 12996 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
| 4128910 | CIF | C32 H16 N8 O16 Zr3 | P n n m | 31.368; 19.703; 22.4548 90; 90; 90 | 13878 | Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society, 2019, 141, 13654-13663 |
| 4128911 | CIF | C87 H88 O11 | P 1 21/n 1 | 13.5456; 35.6442; 15.5089 90; 107.09; 90 | 7157.4 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
| 4128912 | CIF | C85 H80 O10 | P 1 21/n 1 | 13.7735; 34.9942; 15.597 90; 107.447; 90 | 7171.79 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
| 4128913 | CIF | C87 H86 O10 | P 1 21/n 1 | 13.9839; 35.7918; 15.4191 90; 108.881; 90 | 7302.1 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
| 4128914 | CIF | C81 H62 O10 | P b c a | 12.7437; 31.7874; 32.5089 90; 90; 90 | 13169 | Li, Qi; Zhu, Huangtianzhi; Huang, Feihe Alkyl Chain Length-Selective Vapor-Induced Fluorochromism of Pillar[5]arene-Based Nonporous Adaptive Crystals. Journal of the American Chemical Society, 2019, 141, 13290-13294 |
| 4128915 | CIF | C40 H76 O5 S Si3 | P 1 21 1 | 9.5103; 34.984; 21.4829 90; 101.519; 90 | 7003.6 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
| 4128916 | CIF | C14 H16 O4 S | P 1 21/n 1 | 7.048; 10.4797; 18.4167 90; 97.094; 90 | 1349.86 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
| 4128917 | CIF | C12 H18 O S | P 21 21 21 | 5.843; 10.9977; 17.5865 90; 90; 90 | 1130.1 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
| 4128918 | CIF | C16 H15 N O4 S | P -1 | 7.6475; 8.1332; 13.0597 105.357; 102.201; 97.465 | 750.56 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
| 4128919 | CIF | C23 H21 N O3 | P 21 21 21 | 8.6617; 9.6496; 22.5991 90; 90; 90 | 1888.88 | Haut, Franz-Lucas; Habiger, Christoph; Speck, Klaus; Wurst, Klaus; Mayer, Peter; Korber, Johannes Nepomuk; Müller, Thomas; Magauer, Thomas Synthetic Entry to Polyfunctionalized Molecules through the [3+2]-Cycloaddition of Thiocarbonyl Ylides. Journal of the American Chemical Society, 2019, 141, 13352-13357 |
| 4128920 | CIF | C5 H6 O3 | P 1 21/c 1 | 6.1911; 7.129; 12.2554 90; 104.026; 90 | 524.78 | McGuire, Thomas M.; Pérale, Cécile; Castaing, Rémi; Kociok-Köhn, Gabriele; Buchard, Antoine Divergent Catalytic Strategies for the <i>Cis</i>/<i>Trans</i> Stereoselective Ring-Opening Polymerization of a Dual Cyclic Carbonate/Olefin Monomer. Journal of the American Chemical Society, 2019, 141, 13301-13305 |
| 4128921 | CIF | C26 H32 Fe O6 | P 1 21 1 | 8.169; 23.029; 12.208 90; 91.379; 90 | 2296 | Burns, Alexander S.; Rychnovsky, Scott D. Total Synthesis and Structure Revision of (-)-Illisimonin A, a Neuroprotective Sesquiterpenoid from the Fruits of <i>Illicium simonsii</i>. Journal of the American Chemical Society, 2019, 141, 13295-13300 |
| 4128922 | CIF | Co4 K3.5 Li1.5 Na O126.5 P5 W30 | I m m a | 52.0499; 21.5528; 26.1891 90; 90; 90 | 29379.5 | Turo, Michael J.; Chen, Linfeng; Moore, Curtis E.; Schimpf, Alina M. Co<sup>2+</sup>-Linked [NaP<sub>5</sub>W<sub>30</sub>O<sub>110</sub>]<sup>14-</sup>: A Redox-Active Metal Oxide Framework with High Electron Density. Journal of the American Chemical Society, 2019, 141, 4553-4557 |
| 4128923 | CIF | Co4 K3.5 Li1.5 Na O126.5 P5 W30 | I m m a | 52.037; 21.5548; 26.1839 90; 90; 90 | 29369.1 | Turo, Michael J.; Chen, Linfeng; Moore, Curtis E.; Schimpf, Alina M. Co<sup>2+</sup>-Linked [NaP<sub>5</sub>W<sub>30</sub>O<sub>110</sub>]<sup>14-</sup>: A Redox-Active Metal Oxide Framework with High Electron Density. Journal of the American Chemical Society, 2019, 141, 4553-4557 |
| 4128924 | CIF | C35 H35 F12 N11 O0.25 P2 | P 1 21/m 1 | 8.5334; 16.264; 14.678 90; 100.31; 90 | 2004.2 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
| 4128925 | CIF | C35 H37 F12 N9 O2 P2 | P -1 | 8.8999; 11.193; 20.76 99.53; 90.06; 105.42 | 1963.9 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
| 4128926 | CIF | C37 H43 N9 O10 | P b c a | 11.481; 22.243; 29.998 90; 90; 90 | 7661 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
| 4128927 | CIF | C31 H48 N9 O15.5 P2 | P -1 | 12.547; 18.324; 18.364 114.49; 103.77; 91.72 | 3692.1 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
| 4128928 | CIF | C34 H35.5 N10.5 O8 S2 | P -1 | 8.2235; 13.8316; 16.8675 99.887; 90.596; 102.897 | 1840 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
| 4128929 | CIF | C31 H39 N9 O11 P2 | P 1 21/c 1 | 18.1882; 20.6048; 9.6072 90; 104.356; 90 | 3488 | Yang, Jian; Dong, Chao-Chen; Chen, Xu-Lang; Sun, Xin; Wei, Jin-Yan; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Excimer Disaggregation Enhanced Emission: A Fluorescence "Turn-On" Approach to Oxoanion Recognition. Journal of the American Chemical Society, 2019, 141, 4597-4612 |
| 4128930 | CIF | C68 H87 Au2 F6 N5 O5 S3 | P -1 | 15.082; 17.405; 17.968 66.38; 80.662; 80.269 | 4235.9 | Mulks, Florian F.; Antoni, Patrick W.; Gross, Jürgen H; Graf, Jürgen; Rominger, Frank; Hashmi, A Stephen K 1,1-Digoldallylium Complexes: Diaurated Allylic Carbocations Indicate New Prospects of the Coordination Chemistry of Carbon. Journal of the American Chemical Society, 2019, 141, 4687-4695 |
| 4128931 | CIF | C20 H31 Co | P 1 21/n 1 | 8.07; 8.4605; 12.8684 90; 93.611; 90 | 876.86 | Chalkley, Matthew J.; Oyala, Paul H.; Peters, Jonas C. Cp* Noninnocence Leads to a Remarkably Weak C-H Bond via Metallocene Protonation. Journal of the American Chemical Society, 2019, 141, 4721-4729 |
| 4128932 | CIF | C21 H33 Co | P 1 21/c 1 | 12.8973; 9.6767; 15.1146 90; 92.956; 90 | 1883.84 | Chalkley, Matthew J.; Oyala, Paul H.; Peters, Jonas C. Cp* Noninnocence Leads to a Remarkably Weak C-H Bond via Metallocene Protonation. Journal of the American Chemical Society, 2019, 141, 4721-4729 |
| 4128933 | CIF | C33 H42 N2 O2 Si | P 1 21 1 | 25.919; 9.9765; 26.3509 90; 112.699; 90 | 6286.1 | Han, Ye-Qiang; Ding, Yi; Zhou, Tao; Yan, Sheng-Yi; Song, Hong; Shi, Bing-Feng Pd(II)-Catalyzed Enantioselective Alkynylation of Unbiased Methylene C(sp<sup>3</sup>)-H Bonds Using 3,3'-Fluorinated-BINOL as a Chiral Ligand. Journal of the American Chemical Society, 2019, 141, 4558-4563 |
| 4128934 | CIF | C123 H170 N21 O27 Zn4 | P -1 | 16.1706; 19.1783; 22.1386 89.034; 72.865; 80.624 | 6469.8 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
| 4128935 | CIF | C103 H127 N14 O19 Zn4 | P 1 2/n 1 | 21.5925; 12.2482; 41.9139 90; 96.438; 90 | 11015 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
| 4128936 | CIF | C246 H328 Co2 N38 O52 Zn8 | P 1 21/n 1 | 16.7237; 21.2669; 39.8228 90; 92.307; 90 | 14151.9 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
| 4128937 | CIF | C240 H334 N34 O44 Zn8 | P -1 | 15.7704; 19.0494; 22.544 67.594; 84.711; 76.268 | 6082.3 | Zhang, Huacheng; Lee, Juhoon; Brewster, 2nd, James T; Chi, Xiaodong; Lynch, Vincent M.; Sessler, Jonathan L. Cation-based Structural Tuning of Pyridine Dipyrrolate Cages and Morphological Control over Their Self-assembly. Journal of the American Chemical Society, 2019, 141, 4749-4755 |
| 4128938 | CIF | C16 H22 Br4 N4 O4 Pb | P 1 21/c 1 | 21.2912; 19.4228; 11.7888 90; 97.29; 90 | 4835.7 | Tremblay, Marie-Hélène; Thouin, Félix; Leisen, Johannes; Bacsa, John; Srimath Kandada, Ajay Ram; Hoffman, Justin M.; Kanatzidis, Mercouri G.; Mohite, Aditya D.; Silva, Carlos; Barlow, Stephen; Marder, Seth R. (4NPEA)<sub>2</sub>PbI<sub>4</sub> (4NPEA = 4-Nitrophenylethylammonium): Structural, NMR, and Optical Properties of a 3 ×3 Corrugated 2D Hybrid Perovskite. Journal of the American Chemical Society, 2019, 141, 4521-4525 |
| 4128939 | CIF | C16 H22 I4 N4 O4 Pb | P 1 21/c 1 | 21.0976; 19.8255; 12.6149 90; 98.2252; 90 | 5222.16 | Tremblay, Marie-Hélène; Thouin, Félix; Leisen, Johannes; Bacsa, John; Srimath Kandada, Ajay Ram; Hoffman, Justin M.; Kanatzidis, Mercouri G.; Mohite, Aditya D.; Silva, Carlos; Barlow, Stephen; Marder, Seth R. (4NPEA)<sub>2</sub>PbI<sub>4</sub> (4NPEA = 4-Nitrophenylethylammonium): Structural, NMR, and Optical Properties of a 3 ×3 Corrugated 2D Hybrid Perovskite. Journal of the American Chemical Society, 2019, 141, 4521-4525 |
| 4128940 | CIF | C11 H14 Cl N O2 | P 1 21 1 | 10.848; 4.7553; 11.5172 90; 111.111; 90 | 554.25 | Gao, Tao-Tao; Zhang, Wen-Wen; Sun, Xin; Lu, Hou-Xiang; Li, Bi-Jie Stereodivergent Synthesis through Catalytic Asymmetric Reversed Hydroboration. Journal of the American Chemical Society, 2019, 141, 4670-4677 |
| 4128941 | CIF | C24 H19 Br2 N O2 | R -3 c :H | 17.3148; 17.3148; 37.394 90; 90; 120 | 9708.8 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
| 4128942 | CIF | C12 H8 Br2 | P 1 21/n 1 | 7.8747; 11.6377; 11.6249 90; 107.095; 90 | 1018.28 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
| 4128943 | CIF | C24 H22 Br N O2 | P -1 | 8.5392; 8.8043; 15.5739 74.124; 89.573; 65.84 | 1020.2 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
| 4128944 | CIF | C15 H11 Br2 N O2 | P 1 21 1 | 9.102; 6.967; 10.962 90; 91.026; 90 | 695 | Niyas, M. A.; Ramakrishnan, Remya; Vijay, Vishnu; Sebastian, Ebin; Hariharan, Mahesh Anomalous Halogen-Halogen Interaction Assists Radial Chromophoric Assembly. Journal of the American Chemical Society, 2019, 141, 4536-4540 |
| 4128945 | CIF | C87 H62 Cl7 Ir N2 O5 P2 | P -1 | 11.7853; 14.6123; 22.8572 98.446; 92.842; 91.763 | 3885.88 | Isomura, Mayuko; Petrone, David A.; Carreira, Erick M. Coordination-Induced Stereocontrol over Carbocations: Asymmetric Reductive Deoxygenation of Racemic Tertiary Alcohols. Journal of the American Chemical Society, 2019, 141, 4738-4748 |
| 4128946 | CIF | C18 H15 Cl N2 O6 | P 1 | 9.9297; 13.7671; 14.1998 64.113; 87.206; 89.732 | 1744 | Isomura, Mayuko; Petrone, David A.; Carreira, Erick M. Coordination-Induced Stereocontrol over Carbocations: Asymmetric Reductive Deoxygenation of Racemic Tertiary Alcohols. Journal of the American Chemical Society, 2019, 141, 4738-4748 |
| 4128947 | CIF | C17 H27 N O4 | P 1 21/c 1 | 8.03546; 17.81899; 11.97478 90; 96.1556; 90 | 1704.71 | Isomura, Mayuko; Petrone, David A.; Carreira, Erick M. Coordination-Induced Stereocontrol over Carbocations: Asymmetric Reductive Deoxygenation of Racemic Tertiary Alcohols. Journal of the American Chemical Society, 2019, 141, 4738-4748 |
| 4128948 | CIF | C66 H50 F24 N16 O4 P4 Ru2 | P 1 21 1 | 12.4658; 16.2947; 21.744 90; 97.257; 90 | 4381.4 | Fairbanks, Simon D.; Robertson, Craig C.; Keene, F. Richard; Thomas, Jim A.; Williamson, Mike P. Structural Investigation into the Threading Intercalation of a Chiral Dinuclear Ruthenium(II) Polypyridyl Complex through a B-DNA Oligonucleotide. Journal of the American Chemical Society, 2019, 141, 4644-4652 |
| 4128949 | CIF | C64 H44 F24 N14 P4 Ru2 | P 1 21 1 | 12.5327; 16.3645; 21.809 90; 97.129; 90 | 4438.3 | Fairbanks, Simon D.; Robertson, Craig C.; Keene, F. Richard; Thomas, Jim A.; Williamson, Mike P. Structural Investigation into the Threading Intercalation of a Chiral Dinuclear Ruthenium(II) Polypyridyl Complex through a B-DNA Oligonucleotide. Journal of the American Chemical Society, 2019, 141, 4644-4652 |
| 4128950 | CIF | C64 H44 Cl4 N14 Ru2 | P -1 | 8.3032; 11.378; 18.25 95.542; 92.729; 95.095 | 1706.6 | Fairbanks, Simon D.; Robertson, Craig C.; Keene, F. Richard; Thomas, Jim A.; Williamson, Mike P. Structural Investigation into the Threading Intercalation of a Chiral Dinuclear Ruthenium(II) Polypyridyl Complex through a B-DNA Oligonucleotide. Journal of the American Chemical Society, 2019, 141, 4644-4652 |
| 4128951 | CIF | C12 H15 I O3 | P 1 21/c 1 | 8.4354; 9.8508; 14.8019 90; 99.955; 90 | 1211.45 | Yang, Ming; Yin, Fangjie; Fujino, Haruka; Snyder, Scott A. The Total Synthesis of Chalcitrin. Journal of the American Chemical Society, 2019, 141, 4515-4520 |
| 4128952 | CIF | C11 H8 Br I O3 | P 1 21/c 1 | 10.8432; 9.263; 11.9112 90; 108.277; 90 | 1136.01 | Yang, Ming; Yin, Fangjie; Fujino, Haruka; Snyder, Scott A. The Total Synthesis of Chalcitrin. Journal of the American Chemical Society, 2019, 141, 4515-4520 |
| 4128953 | CIF | C12 H8 Br I O4 | P 1 21/c 1 | 12.0937; 11.9771; 8.4124 90; 91.644; 90 | 1218.01 | Yang, Ming; Yin, Fangjie; Fujino, Haruka; Snyder, Scott A. The Total Synthesis of Chalcitrin. Journal of the American Chemical Society, 2019, 141, 4515-4520 |
| 4128954 | CIF | C43.5 H44.75 F18 Fe N8.25 O0.75 P2 | P 21 21 21 | 12.8763; 15.3531; 24.2529 90; 90; 90 | 4794.58 | Hong, Yubiao; Jarrige, Lucie; Harms, Klaus; Meggers, Eric Chiral-at-Iron Catalyst: Expanding the Chemical Space for Asymmetric Earth-Abundant Metal Catalysis. Journal of the American Chemical Society, 2019, 141, 4569-4572 |
| 4128955 | CIF | C108 H110 O4 | C 1 2/c 1 | 19.1455; 17.5082; 24.5014 90; 102.237; 90 | 8026.4 | Ikai, Tomoyuki; Yoshida, Takumu; Shinohara, Ken-Ichi; Taniguchi, Tsuyoshi; Wada, Yuya; Swager, Timothy M. Triptycene-Based Ladder Polymers with One-Handed Helical Geometry. Journal of the American Chemical Society, 2019, 141, 4696-4703 |
| 4128956 | CIF | C26.5 H26 Cl N5 O2 | P -1 | 10.9283; 13.7142; 17.0369 86.6245; 85.0011; 67.4709 | 2348.64 | Gallagher, Nolan; Zhang, Hui; Junghoefer, Tobias; Giangrisostomi, Erika; Ovsyannikov, Ruslan; Pink, Maren; Rajca, Suchada; Casu, Maria Benedetta; Rajca, Andrzej Thermally and Magnetically Robust Triplet Ground State Diradical. Journal of the American Chemical Society, 2019, 141, 4764-4774 |
| 4128957 | CIF | C17 H29 Cl2 N3 Ni S2 | P b c n | 14.5632; 12.3263; 23.3463 90; 90; 90 | 4190.9 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
| 4128958 | CIF | C17 H24 F3 N3 Ni S2 | P 1 21/c 1 | 12.698; 15.104; 10.542 90; 100.076; 90 | 1990.7 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
| 4128959 | CIF | C22 H32 B F4 Fe N3 Ni O3 S2 | P 1 21/c 1 | 19.8354; 9.975; 13.3013 90; 100.622; 90 | 2586.67 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
| 4128960 | CIF | C22 H28 B Cl2 F7 Fe N2 Ni O S2 | P 1 21/c 1 | 8.0122; 31.7923; 11.9134 90; 107.146; 90 | 2899.8 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
| 4128961 | CIF | C21.5 H29 B Cl4 F4 Fe N2 Ni O S2 | P c c n | 11.3768; 22.6888; 24.5582 90; 90; 90 | 6339.1 | Yang, Xuemei; Elrod, Lindy C.; Le, Trung; Vega, Valeria S.; Naumann, Haley; Rezenom, Yohannes; Reibenspies, Joseph H.; Hall, Michael B.; Darensbourg, Marcetta Y. Controlling O<sub>2</sub> Reactivity in Synthetic Analogues of [NiFeS]- and [NiFeSe]-Hydrogenase Active Sites. Journal of the American Chemical Society, 2019, 141, 15338-15347 |
| 4128962 | CIF | C24 H24 Br2 O2 | P 1 21 1 | 11.3708; 4.6026; 20.5978 90; 94.029; 90 | 1075.33 | Parsutkar, Mahesh M.; Pagar, Vinayak Vishnu; RajanBabu, T. V. Catalytic Enantioselective Synthesis of Cyclobutenes from Alkynes and Alkenyl Derivatives. Journal of the American Chemical Society, 2019, 141, 15367-15377 |
| 4128963 | CIF | C27 H34 Br2 Co N O P | P 1 21 1 | 11.0641; 22.4546; 11.081 90; 99.705; 90 | 2713.6 | Parsutkar, Mahesh M.; Pagar, Vinayak Vishnu; RajanBabu, T. V. Catalytic Enantioselective Synthesis of Cyclobutenes from Alkynes and Alkenyl Derivatives. Journal of the American Chemical Society, 2019, 141, 15367-15377 |
| 4128964 | CIF | C19 H15 F6 N4 O2 P Ru | P 21 21 21 | 11.7237; 13.3153; 13.7472 90; 90; 90 | 2146 | Jung, Hoimin; Schrader, Malte; Kim, Dongwook; Baik, Mu-Hyun; Park, Yoonsu; Chang, Sukbok Harnessing Secondary Coordination Sphere Interactions That Enable the Selective Amidation of Benzylic C-H Bonds. Journal of the American Chemical Society, 2019, 141, 15356-15366 |
| 4128965 | CIF | C69 H90 Ag2 F6 O14 | P -1 | 12.1081; 14.8255; 21.7369 104.402; 94.961; 111.996 | 3433.43 | Hua, Bin; Shao, Li; Zhang, Zhihua; Liu, Jiyong; Huang, Feihe Cooperative Silver Ion-Pair Recognition by Peralkylated Pillar[5]arenes. Journal of the American Chemical Society, 2019, 141, 15008-15012 |
| 4128966 | CIF | C59 H70 Ag2 F6 O14 | P 1 21/n 1 | 16.5674; 20.0237; 17.998 90; 92.654; 90 | 5964.3 | Hua, Bin; Shao, Li; Zhang, Zhihua; Liu, Jiyong; Huang, Feihe Cooperative Silver Ion-Pair Recognition by Peralkylated Pillar[5]arenes. Journal of the American Chemical Society, 2019, 141, 15008-15012 |
| 4128967 | CIF | C18 H30 F12 Fe N6 Sb2 | P 1 21/n 1 | 19.573; 8.226; 19.595 90; 117.913; 90 | 2787.9 | Dantignana, Valeria; Serrano-Plana, Joan; Draksharapu, Apparao; Magallón, Carla; Banerjee, Saikat; Fan, Ruixi; Gamba, Ilaria; Guo, Yisong; Que, Jr, Lawrence; Costas, Miquel; Company, Anna Spectroscopic and Reactivity Comparisons between Nonheme Oxoiron(IV) and Oxoiron(V) Species Bearing the Same Ancillary Ligand. Journal of the American Chemical Society, 2019, 141, 15078-15091 |
| 4128968 | CIF | C28 H30 Cl17 Co N5 | P 1 21/c 1 | 13.6143; 18.8932; 18.3407 90; 109.406; 90 | 4449.5 | Ghosh, Chandrani; Kim, Suyeon; Mena, Matthew R.; Kim, Jun-Hyeong; Pal, Raja; Rock, Christopher L.; Groy, Thomas L.; Baik, Mu-Hyun; Trovitch, Ryan J. Efficient Cobalt Catalyst for Ambient-Temperature Nitrile Dihydroboration, the Elucidation of a Chelate-Assisted Borylation Mechanism, and a New Synthetic Route to Amides. Journal of the American Chemical Society, 2019, 141, 15327-15337 |
| 4128969 | CIF | C23 H26 Co N5 | P -1 | 8.6432; 11.3302; 11.4891 105.192; 92.884; 107.735 | 1023.8 | Ghosh, Chandrani; Kim, Suyeon; Mena, Matthew R.; Kim, Jun-Hyeong; Pal, Raja; Rock, Christopher L.; Groy, Thomas L.; Baik, Mu-Hyun; Trovitch, Ryan J. Efficient Cobalt Catalyst for Ambient-Temperature Nitrile Dihydroboration, the Elucidation of a Chelate-Assisted Borylation Mechanism, and a New Synthetic Route to Amides. Journal of the American Chemical Society, 2019, 141, 15327-15337 |
| 4128970 | CIF | C27 H40 Co F4 N P2 | P -1 | 8.2188; 11.2255; 16.4158 84.354; 76.854; 69.023 | 1376.85 | Pabst, Tyler P.; Obligacion, Jennifer V.; Rochette, Étienne; Pappas, Iraklis; Chirik, Paul J. Cobalt-Catalyzed Borylation of Fluorinated Arenes: Thermodynamic Control of C(sp<sup>2</sup>)-H Oxidative Addition Results in <i>ortho</i>-to-Fluorine Selectivity. Journal of the American Chemical Society, 2019, 141, 15378-15389 |
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