Crystallography Open Database
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Searching volume of publication is 139
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4125978 | CIF | C39 H49 Mo N3 | P 1 21/c 1 | 21.7387; 16.3039; 9.2844 90; 95.558; 90 | 3275.2 | Margulieux, Grant W.; Bezdek, Máté J; Turner, Zoë R; Chirik, Paul J. Ammonia Activation, H2 Evolution and Nitride Formation from a Molybdenum Complex with a Chemically and Redox Noninnocent Ligand. Journal of the American Chemical Society, 2017, 139, 6110-6113 |
| 4125979 | CIF | C35 H47 Mo N4 | P -1 | 8.7438; 13.7953; 15.4416 106.183; 104.153; 104.603 | 1628.7 | Margulieux, Grant W.; Bezdek, Máté J; Turner, Zoë R; Chirik, Paul J. Ammonia Activation, H2 Evolution and Nitride Formation from a Molybdenum Complex with a Chemically and Redox Noninnocent Ligand. Journal of the American Chemical Society, 2017, 139, 6110-6113 |
| 4125981 | CIF | C19 H18 Br Cl3 O2 | P 1 21/n 1 | 5.677; 12.775; 27.3695 90; 94.076; 90 | 1979.92 | Tan, Yu; Luo, Shilong; Li, Dongmei; Zhang, Nan; Jia, Shiqi; Liu, Yidong; Qin, Wenling; Song, Choong Eui; Yan, Hailong Enantioselective Synthesis of anti-syn-Trihalides and anti-syn-anti-Tetrahalides via Asymmetric β-Elimination. Journal of the American Chemical Society, 2017, 139, 6431-6436 |
| 4125982 | CIF | C16 H13 Br3 O | P 1 21 1 | 6.7844; 7.0774; 17.2752 90; 100.264; 90 | 816.21 | Tan, Yu; Luo, Shilong; Li, Dongmei; Zhang, Nan; Jia, Shiqi; Liu, Yidong; Qin, Wenling; Song, Choong Eui; Yan, Hailong Enantioselective Synthesis of anti-syn-Trihalides and anti-syn-anti-Tetrahalides via Asymmetric β-Elimination. Journal of the American Chemical Society, 2017, 139, 6431-6436 |
| 4125983 | CIF | C17 H24 N2 O6 | P 21 21 2 | 13.7749; 21.091; 7.3456 90; 90; 90 | 2134.1 | Wang, Xiaoming; Gensch, Tobias; Lerchen, Andreas; Daniliuc, Constantin G.; Glorius, Frank Cp*Rh(III)/Bicyclic Olefin Cocatalyzed C-H Bond Amidation by Intramolecular Amide Transfer. Journal of the American Chemical Society, 2017, 139, 6506-6512 |
| 4125984 | CIF | C18 H22 N O2 Rh | P 1 21/n 1 | 12.492; 8.763; 15.2416 90; 103.801; 90 | 1620.29 | Wang, Xiaoming; Gensch, Tobias; Lerchen, Andreas; Daniliuc, Constantin G.; Glorius, Frank Cp*Rh(III)/Bicyclic Olefin Cocatalyzed C-H Bond Amidation by Intramolecular Amide Transfer. Journal of the American Chemical Society, 2017, 139, 6506-6512 |
| 4125985 | CIF | C36 H44 N2 O4 Rh2 | P 1 21/n 1 | 9.9285; 14.935; 10.6506 90; 90.57; 90 | 1579.22 | Wang, Xiaoming; Gensch, Tobias; Lerchen, Andreas; Daniliuc, Constantin G.; Glorius, Frank Cp*Rh(III)/Bicyclic Olefin Cocatalyzed C-H Bond Amidation by Intramolecular Amide Transfer. Journal of the American Chemical Society, 2017, 139, 6506-6512 |
| 4125986 | CIF | C24 H36 Cl2 Fe N12 O8 | C 1 2/c 1 | 23.916; 10.099; 16.81 90; 131.277; 90 | 3051.3 | Phan, Hoa; Hrudka, Jeremy J.; Igimbayeva, Dilyara; Lawson Daku, Latévi M; Shatruk, Michael A Simple Approach for Predicting the Spin State of Homoleptic Fe(II) Tris-diimine Complexes. Journal of the American Chemical Society, 2017, 139, 6437-6447 |
| 4125998 | CIF | C29.08 H24.45 N14.3 O4.6 Zn3 | F m -3 m | 72.2609; 72.2609; 72.2609 90; 90; 90 | 377320 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4125999 | CIF | C31.6 H22.95 N13.85 O3.7 Zn3 | F m -3 m | 72.205; 72.205; 72.205 90; 90; 90 | 376445 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126000 | CIF | C40 H23 Cl4 N20 O8 Zn4 | P 63/m m c | 31.731; 31.731; 28.412 90; 90; 120 | 24774 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126001 | CIF | C195 H77 Br13 N52 Zn13 | P 43 21 2 | 29.157; 29.157; 69.955 90; 90; 90 | 59471 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126002 | CIF | C33.5 H26.49 N13.81 O3.63 Zn3 | F m -3 m | 72.3673; 72.3673; 72.3673 90; 90; 90 | 378989 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126003 | CIF | C22 H13.5 Br2.5 N9 O2 Zn2 | P 6/m m m | 42.586; 42.586; 19.8692 90; 90; 120 | 31206 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126004 | CIF | C7.5 H7.4 N4.2 O0.4 Zn | P 63/m m c | 27.0807; 27.0807; 16.7619 90; 90; 120 | 10645.7 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126005 | CIF | C26.5 H22 B Cl F2 N2 O2 | P 1 21/n 1 | 17.3115; 6.4766; 20.9257 90; 107.061; 90 | 2242.9 | Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Savoie, Huguette; Flanagan, Keith J.; Sy, Cindy; Sitte, Elisabeth; Telitchko, Maxime; Laquai, Frédéric; Boyle, Ross W.; Senge, Mathias O. Generation of Triplet Excited States via Photoinduced Electron Transfer in meso-anthra-BODIPY: Fluorogenic Response toward Singlet Oxygen in Solution and in Vitro. Journal of the American Chemical Society, 2017, 139, 6282-6285 |
| 4126006 | CIF | C28 H25 B F2 N2 | P -1 | 7.2381; 9.7454; 16.9374 75.307; 83.691; 70.111 | 1086.37 | Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Savoie, Huguette; Flanagan, Keith J.; Sy, Cindy; Sitte, Elisabeth; Telitchko, Maxime; Laquai, Frédéric; Boyle, Ross W.; Senge, Mathias O. Generation of Triplet Excited States via Photoinduced Electron Transfer in meso-anthra-BODIPY: Fluorogenic Response toward Singlet Oxygen in Solution and in Vitro. Journal of the American Chemical Society, 2017, 139, 6282-6285 |
| 4126007 | CIF | C27 H25 B F2 N2 O5 | P -1 | 6.3949; 9.4233; 20.105 80.269; 83.793; 70.715 | 1125.33 | Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Savoie, Huguette; Flanagan, Keith J.; Sy, Cindy; Sitte, Elisabeth; Telitchko, Maxime; Laquai, Frédéric; Boyle, Ross W.; Senge, Mathias O. Generation of Triplet Excited States via Photoinduced Electron Transfer in meso-anthra-BODIPY: Fluorogenic Response toward Singlet Oxygen in Solution and in Vitro. Journal of the American Chemical Society, 2017, 139, 6282-6285 |
| 4126009 | CIF | C12 H20 Fe K N8 O2 | C 1 c 1 | 15.3166; 8.8618; 14.4531 90; 98.44; 90 | 1940.51 | Xu, Wei-Jian; Li, Peng-Fei; Tang, Yuan-Yuan; Zhang, Wei-Xiong; Xiong, Ren-Gen; Chen, Xiao-Ming A Molecular Perovskite with Switchable Coordination Bonds for High-Temperature Multiaxial Ferroelectrics. Journal of the American Chemical Society, 2017, 139, 6369-6375 |
| 4126011 | CIF | C43 H62 N2 Pb | P -1 | 12.2209; 12.6206; 14.2456 75.918; 77.453; 75.38 | 2033.52 | Schneider, Julia; Sindlinger, Christian P.; Eichele, Klaus; Schubert, Hartmut; Wesemann, Lars Low-Valent Lead Hydride and Its Extreme Low-Field (1)H NMR Chemical Shift. Journal of the American Chemical Society, 2017, 139, 6542-6545 |
| 4126012 | CIF | C20 H27 B O5 | P 21 21 21 | 6.1827; 16.2477; 18.7515 90; 90; 90 | 1883.68 | Yu, Songjie; Wu, Caizhi; Ge, Shaozhong Cobalt-Catalyzed Asymmetric Hydroboration/Cyclization of 1,6-Enynes with Pinacolborane. Journal of the American Chemical Society, 2017, 139, 6526-6529 |
| 4126013 | CIF | C19 H24 B F3 O3 | P 21 21 21 | 6.126; 12.1135; 24.9789 90; 90; 90 | 1853.6 | Yu, Songjie; Wu, Caizhi; Ge, Shaozhong Cobalt-Catalyzed Asymmetric Hydroboration/Cyclization of 1,6-Enynes with Pinacolborane. Journal of the American Chemical Society, 2017, 139, 6526-6529 |
| 4126014 | CIF | C19 H24 O4 | P 61 | 20.4847; 20.4847; 6.8358 90; 90; 120 | 2484.16 | Yu, Songjie; Wu, Caizhi; Ge, Shaozhong Cobalt-Catalyzed Asymmetric Hydroboration/Cyclization of 1,6-Enynes with Pinacolborane. Journal of the American Chemical Society, 2017, 139, 6526-6529 |
| 4126022 | CIF | C17 H15 N O4 | P 1 21/n 1 | 10.5608; 6.4181; 19.8406 90; 90.419; 90 | 1344.77 | Maier, Josef M.; Li, Ping; Vik, Erik C.; Yehl, Christopher J.; Strickland, Sharon M. S.; Shimizu, Ken D. Measurement of Solvent OH-π Interactions Using a Molecular Balance. Journal of the American Chemical Society, 2017, 139, 6550-6553 |
| 4126023 | CIF | C55.5 H49.5 N7.5 O13.5 | P 1 | 10.9086; 15.7319; 17.5116 83.6115; 79.6903; 70.5894 | 2784.3 | Kim, Dong Jun; Hermann, Keith R.; Prokofjevs, Aleksandrs; Otley, Michael T.; Pezzato, Cristian; Owczarek, Magdalena; Stoddart, J. Fraser Redox-Active Macrocycles for Organic Rechargeable Batteries. Journal of the American Chemical Society, 2017, 139, 6635-6643 |
| 4126024 | CIF | C190.5 H184 F40.5 Fe4 N40 O31.5 P5.5 S10.5 | F d d d | 18.6629; 64.266; 85.271 90; 90; 90 | 102273 | Zhang, Dawei; Ronson, Tanya K.; Mosquera, Jesús; Martinez, Alexandre; Guy, Laure; Nitschke, Jonathan R. Anion Binding in Water Drives Structural Adaptation in an Azaphosphatrane-Functionalized Fe(II)4L4 Tetrahedron. Journal of the American Chemical Society, 2017, 139, 6574-6577 |
| 4126027 | CIF | C15.21 Cl0.5 N1.4 O33.9 Zr6 | C 1 2/c 1 | 11.4489; 20.7494; 30.7865 90; 91.16; 90 | 7312.1 | Ji, Pengfei; Manna, Kuntal; Lin, Zekai; Feng, Xuanyu; Urban, Ania; Song, Yang; Lin, Wenbin Single-Site Cobalt Catalysts at New Zr12(μ3-O)8(μ3-OH)8(μ2-OH)6 Metal-Organic Framework Nodes for Highly Active Hydrogenation of Nitroarenes, Nitriles, and Isocyanides. Journal of the American Chemical Society, 2017, 139, 7004-7011 |
| 4126028 | CIF | C66 H0 Hf3 O18 | I 41/a | 33.087; 33.087; 21.564 90; 90; 90 | 23607 | Cao, Lingyun; Lin, Zekai; Shi, Wenjie; Wang, Zi; Zhang, Cankun; Hu, Xuefu; Wang, Cheng; Lin, Wenbin Exciton Migration and Amplified Quenching on Two-Dimensional Metal-Organic Layers. Journal of the American Chemical Society, 2017, 139, 7020-7029 |
| 4126029 | CIF | C66 O18 Zr3 | C 1 2/m 1 | 44.662; 21.571; 19.789 90; 113.282; 90 | 17512 | Cao, Lingyun; Lin, Zekai; Shi, Wenjie; Wang, Zi; Zhang, Cankun; Hu, Xuefu; Wang, Cheng; Lin, Wenbin Exciton Migration and Amplified Quenching on Two-Dimensional Metal-Organic Layers. Journal of the American Chemical Society, 2017, 139, 7020-7029 |
| 4126033 | CIF | C34 H43 Cl2 Cu N2 S | P b c a | 19.5368; 14.2533; 23.4566 90; 90; 90 | 6531.8 | Mailig, Melrose; Hazra, Avijit; Armstrong, Megan K.; Lalic, Gojko Catalytic Anti-Markovnikov Hydroallylation of Terminal and Functionalized Internal Alkynes: Synthesis of Skipped Dienes and Trisubstituted Alkenes. Journal of the American Chemical Society, 2017, 139, 6969-6977 |
| 4126034 | CIF | C46 H67 Li N2 O3 S2 | P 21 21 21 | 12.249; 17.855; 22.121 90; 90; 90 | 4838 | Wang, Yuzhong; Hickox, Hunter P.; Xie, Yaoming; Wei, Pingrong; Blair, Soshawn A.; Johnson, Michael K.; Schaefer, 3rd, Henry F; Robinson, Gregory H. A Stable Anionic Dithiolene Radical. Journal of the American Chemical Society, 2017, 139, 6859-6862 |
| 4126035 | CIF | C35 H50 Li N2 O2 S3 | P 1 21/n 1 | 12.332; 17.934; 16.802 90; 101.457; 90 | 3641.9 | Wang, Yuzhong; Hickox, Hunter P.; Xie, Yaoming; Wei, Pingrong; Blair, Soshawn A.; Johnson, Michael K.; Schaefer, 3rd, Henry F; Robinson, Gregory H. A Stable Anionic Dithiolene Radical. Journal of the American Chemical Society, 2017, 139, 6859-6862 |
| 4126036 | CIF | C76 H112 Cl Ge Li N4 O6 S6 | P 1 21/n 1 | 14.9377; 14.9604; 37.2578 90; 92.366; 90 | 8319.1 | Wang, Yuzhong; Hickox, Hunter P.; Xie, Yaoming; Wei, Pingrong; Blair, Soshawn A.; Johnson, Michael K.; Schaefer, 3rd, Henry F; Robinson, Gregory H. A Stable Anionic Dithiolene Radical. Journal of the American Chemical Society, 2017, 139, 6859-6862 |
| 4126037 | CIF | C16 H23 N O3 | P -1 | 8.499; 9.1139; 10.798 91.404; 104.88; 116.48 | 714.1 | Zhao, Xian-He; Zhang, Qing; Du, Ji-Yuan; Lu, Xin-Yun; Cao, Ye-Xing; Deng, Yu-Hua; Fan, Chun-An Total Synthesis of (±)-Lycojaponicumin D and Lycodoline-Type Lycopodium Alkaloids. Journal of the American Chemical Society, 2017, 139, 7095-7103 |
| 4126038 | CIF | C18 H24 Cl N O4 | P 1 21/c 1 | 7.483; 13.0673; 17.5715 90; 91.061; 90 | 1717.89 | Zhao, Xian-He; Zhang, Qing; Du, Ji-Yuan; Lu, Xin-Yun; Cao, Ye-Xing; Deng, Yu-Hua; Fan, Chun-An Total Synthesis of (±)-Lycojaponicumin D and Lycodoline-Type Lycopodium Alkaloids. Journal of the American Chemical Society, 2017, 139, 7095-7103 |
| 4126039 | CIF | C16 H25 N O2 | P 1 21/n 1 | 10.853; 7.9767; 16.4717 90; 107.414; 90 | 1360.6 | Zhao, Xian-He; Zhang, Qing; Du, Ji-Yuan; Lu, Xin-Yun; Cao, Ye-Xing; Deng, Yu-Hua; Fan, Chun-An Total Synthesis of (±)-Lycojaponicumin D and Lycodoline-Type Lycopodium Alkaloids. Journal of the American Chemical Society, 2017, 139, 7095-7103 |
| 4126040 | CIF | C38 H28 Cl F6 O6 P2 Pt S2 Sb | P -1 | 11.1369; 12.47; 17.657 77.331; 75.898; 66.044 | 2153.2 | You, Di; Gabbaï, François P Unmasking the Catalytic Activity of a Platinum Complex with a Lewis Acidic, Non-innocent Antimony Ligand. Journal of the American Chemical Society, 2017, 139, 6843-6846 |
| 4126041 | CIF | C351.35 H440.52 Cl12 N64.17 O73.75 S12 | P 1 | 16.2209; 16.867; 36.8707 79.205; 81.682; 88.126 | 9804.8 | Teng, Peng; Ma, Ning; Cerrato, Darrell Cole; She, Fengyu; Odom, Timothy; Wang, Xiang; Ming, Li-June; van der Vaart, Arjan; Wojtas, Lukasz; Xu, Hai; Cai, Jianfeng Right-Handed Helical Foldamers Consisting of De Novo d-AApeptides. Journal of the American Chemical Society, 2017, 139, 7363-7369 |
| 4126042 | CIF | C56 H103 N19 O23 S4 | C 2 2 21 | 19.623; 19.612; 36.77 90; 90; 90 | 14151 | Teng, Peng; Ma, Ning; Cerrato, Darrell Cole; She, Fengyu; Odom, Timothy; Wang, Xiang; Ming, Li-June; van der Vaart, Arjan; Wojtas, Lukasz; Xu, Hai; Cai, Jianfeng Right-Handed Helical Foldamers Consisting of De Novo d-AApeptides. Journal of the American Chemical Society, 2017, 139, 7363-7369 |
| 4126043 | CIF | C94 H121.5 Cl3 N15.5 O20.5 S3 | P 21 21 21 | 13.8067; 20.7486; 35.9788 90; 90; 90 | 10306.8 | Teng, Peng; Ma, Ning; Cerrato, Darrell Cole; She, Fengyu; Odom, Timothy; Wang, Xiang; Ming, Li-June; van der Vaart, Arjan; Wojtas, Lukasz; Xu, Hai; Cai, Jianfeng Right-Handed Helical Foldamers Consisting of De Novo d-AApeptides. Journal of the American Chemical Society, 2017, 139, 7363-7369 |
| 4126044 | CIF | C30 H26 N2 Si | P 1 21/c 1 | 16.29; 7.9432; 18.521 90; 105.826; 90 | 2305.7 | Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao B(C6F5)3-Catalyzed (Convergent) Disproportionation Reaction of Indoles. Journal of the American Chemical Society, 2017, 139, 7399-7407 |
| 4126045 | CIF | C21 H20 F N Si | P 1 21/n 1 | 10.6463; 19.807; 16.5261 90; 96.816; 90 | 3460.2 | Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao B(C6F5)3-Catalyzed (Convergent) Disproportionation Reaction of Indoles. Journal of the American Chemical Society, 2017, 139, 7399-7407 |
| 4126046 | CIF | C70 H68 N24 O4 | C 1 2/m 1 | 11.945; 26.364; 15.094 90; 98.517; 90 | 4701 | Lin, Yunxiao; Jiang, Xuanfeng; Kim, Samuel T.; Alahakoon, Sampath B.; Hou, Xisen; Zhang, Zhiyun; Thompson, Christina M.; Smaldone, Ronald A.; Ke, Chenfeng An Elastic Hydrogen-Bonded Cross-Linked Organic Framework for Effective Iodine Capture in Water. Journal of the American Chemical Society, 2017, 139, 7172-7175 |
| 4126047 | CIF | C36 H38 Mo N2 O P2 | P -1 | 9.1514; 10.2736; 18.5352 92.4907; 90.7171; 114.438 | 1584.13 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126048 | CIF | C32 H45 Cl Mo N2 O P2 | P 1 21/n 1 | 9.688; 22.724; 14.402 90; 96.751; 90 | 3148.6 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126049 | CIF | C32 H45 Cl5 Mo N2 O P2 | P 1 21/n 1 | 12.0391; 14.0027; 21.2754 90; 102.365; 90 | 3503.4 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126050 | CIF | C30 H42 Mo N2 O P2 | P -1 | 9.7947; 10.5732; 14.69 96.291; 109.186; 96.237 | 1411.1 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126051 | CIF | C64 H92 Mo2 N4 O2 P4 | P 1 21/n 1 | 11.2757; 16.421; 17.3077 90; 99.103; 90 | 3164.3 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126052 | CIF | C64 H57 B F24.03 Mo N2 O P2 | C 1 2/c 1 | 41.684; 13.0435; 27.362 90; 116.837; 90 | 13275 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126053 | CIF | C58 H61 B F23.97 Mo N2 O P2 | P 1 21/c 1 | 13.5265; 27.773; 16.8162 90; 106.004; 90 | 6072.5 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126054 | CIF | C62 H53 B F24 Mo N2 O P2 | P -1 | 13.2113; 13.651; 17.8513 92.944; 104.231; 91.563 | 3113.9 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126055 | CIF | C68 H49 B F24.28 Mo N2 O P2 | P -1 | 11.2286; 17.0101; 18.6624 80.605; 73.299; 74.608 | 3277.1 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126056 | CIF | C68 H51 B F24 Mo N2 O P2 | P -1 | 11.3495; 16.8735; 18.6417 89.961; 72.33; 74.987 | 3273.7 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126057 | CIF | C93 H69.5 B F28.5 Mo N2 O P2 | P -1 | 12.7123; 17.4489; 21.6927 68.854; 82.049; 73.29 | 4295 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126058 | CIF | C64 H59 B F24 Mo N2 O P2 | P 1 21/n 1 | 10.144; 23.5478; 27.059 90; 96.564; 90 | 6421.2 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126059 | CIF | C65 H57 B F24.5 Mo N2 O P2 | P -1 | 9.3013; 17.9188; 20.267 107.945; 96.254; 98.054 | 3140.1 | Zhang, Shaoguang; Appel, Aaron M.; Bullock, R. Morris Reversible Heterolytic Cleavage of the H-H Bond by Molybdenum Complexes: Controlling the Dynamics of Exchange Between Proton and Hydride. Journal of the American Chemical Society, 2017, 139, 7376-7387 |
| 4126060 | CIF | C43 H38 B Fe N6 P2 Rh | P 1 21/n 1 | 12.3134; 15.661; 20.705 90; 107.129; 90 | 3815.7 | Ye, Fei; Chen, Junting; Ritter, Tobias Rh-Catalyzed Anti-Markovnikov Hydrocyanation of Terminal Alkynes. Journal of the American Chemical Society, 2017, 139, 7184-7187 |
| 4126062 | CIF | C22 H32 O4 | P 1 | 6.4628; 12.406; 13.1362 70.445; 86.393; 76.913 | 966.61 | Kawamata, Yu; Yan, Ming; Liu, Zhiqing; Bao, Deng-Hui; Chen, Jinshan; Starr, Jeremy T.; Baran, Phil S. Scalable, Electrochemical Oxidation of Unactivated C-H Bonds. Journal of the American Chemical Society, 2017, 139, 7448-7451 |
| 4126063 | CIF | C26 H20 N4 O6 Zn | P 4/n :2 | 21.388; 21.388; 12.031 90; 90; 90 | 5504 | Pei, Wen-Yuan; Xu, Guohai; Yang, Jin; Wu, Hui; Chen, Banglin; Zhou, Wei; Ma, Jian-Fang Versatile Assembly of Metal-Coordinated Calix[4]resorcinarene Cavitands and Cages through Ancillary Linker Tuning. Journal of the American Chemical Society, 2017, 139, 7648-7656 |
| 4126064 | CIF | C122 H126 N22 O32 Zn4 | P 4/n :2 | 25.8236; 25.8236; 12.2441 90; 90; 90 | 8165.1 | Pei, Wen-Yuan; Xu, Guohai; Yang, Jin; Wu, Hui; Chen, Banglin; Zhou, Wei; Ma, Jian-Fang Versatile Assembly of Metal-Coordinated Calix[4]resorcinarene Cavitands and Cages through Ancillary Linker Tuning. Journal of the American Chemical Society, 2017, 139, 7648-7656 |
| 4126065 | CIF | C290 H282 N30 O62 Zn8 | P -1 | 19.3658; 19.5266; 27.211 85.809; 83.726; 64.922 | 9259.9 | Pei, Wen-Yuan; Xu, Guohai; Yang, Jin; Wu, Hui; Chen, Banglin; Zhou, Wei; Ma, Jian-Fang Versatile Assembly of Metal-Coordinated Calix[4]resorcinarene Cavitands and Cages through Ancillary Linker Tuning. Journal of the American Chemical Society, 2017, 139, 7648-7656 |
| 4126066 | CIF | C139 H123 N21 O29 Zn4 | P 4/n :2 | 26.2705; 26.2705; 12.6469 90; 90; 90 | 8728.1 | Pei, Wen-Yuan; Xu, Guohai; Yang, Jin; Wu, Hui; Chen, Banglin; Zhou, Wei; Ma, Jian-Fang Versatile Assembly of Metal-Coordinated Calix[4]resorcinarene Cavitands and Cages through Ancillary Linker Tuning. Journal of the American Chemical Society, 2017, 139, 7648-7656 |
| 4126067 | CIF | C113 H99 N15 O32 Zn4 | P 4/n :2 | 25.847; 25.847; 12.2338 90; 90; 90 | 8173 | Pei, Wen-Yuan; Xu, Guohai; Yang, Jin; Wu, Hui; Chen, Banglin; Zhou, Wei; Ma, Jian-Fang Versatile Assembly of Metal-Coordinated Calix[4]resorcinarene Cavitands and Cages through Ancillary Linker Tuning. Journal of the American Chemical Society, 2017, 139, 7648-7656 |
| 4126072 | CIF | C46 H28 N2 | P -1 | 9.7032; 11.2509; 14.4342 99.726; 91.809; 93.757 | 1548.33 | Aguilar-Granda, Andrés; Pérez-Estrada, Salvador; Sánchez-González, Elı; Álvarez, J Raziel; Rodríguez-Hernández, Joelis; Rodríguez, Mario; Roa, Arian E.; Hernández-Ortega, Simón; Ibarra, Ilich A.; Rodríguez-Molina, Braulio Transient Porosity in Densely Packed Crystalline Carbazole-(p-Diethynylphenylene)-Carbazole Rotors: CO2 and Acetone Sorption Properties. Journal of the American Chemical Society, 2017, 139, 7549-7557 |
| 4126092 | CIF | C144 H52 F24 Hf6 O32 | F d -3 m | 39.828; 39.828; 39.828 90; 90; 90 | 63178 | Marshall, Ross J.; Kalinovskyy, Yaroslav; Griffin, Sarah L.; Wilson, Claire; Blight, Barry A.; Forgan, Ross S. Functional Versatility of a Series of Zr Metal-Organic Frameworks Probed by Solid-State Photoluminescence Spectroscopy. Journal of the American Chemical Society, 2017, 139, 6253-6260 |
| 4126093 | CIF | C30 H26 F2 N2 O6 | P -1 | 9.5707; 11.0072; 13.723 74.409; 74.79; 75.265 | 1317.16 | Marshall, Ross J.; Kalinovskyy, Yaroslav; Griffin, Sarah L.; Wilson, Claire; Blight, Barry A.; Forgan, Ross S. Functional Versatility of a Series of Zr Metal-Organic Frameworks Probed by Solid-State Photoluminescence Spectroscopy. Journal of the American Chemical Society, 2017, 139, 6253-6260 |
| 4126094 | CIF | C26 H14 F4 O4 | P 1 21/c 1 | 17.248; 4.784; 12.021 90; 93.881; 90 | 989.6 | Marshall, Ross J.; Kalinovskyy, Yaroslav; Griffin, Sarah L.; Wilson, Claire; Blight, Barry A.; Forgan, Ross S. Functional Versatility of a Series of Zr Metal-Organic Frameworks Probed by Solid-State Photoluminescence Spectroscopy. Journal of the American Chemical Society, 2017, 139, 6253-6260 |
| 4126095 | CIF | C144 H64 F12 O32 Zr6 | F d -3 m | 39.83167; 39.83167; 39.83167 90; 90; 90 | 63195.4 | Marshall, Ross J.; Kalinovskyy, Yaroslav; Griffin, Sarah L.; Wilson, Claire; Blight, Barry A.; Forgan, Ross S. Functional Versatility of a Series of Zr Metal-Organic Frameworks Probed by Solid-State Photoluminescence Spectroscopy. Journal of the American Chemical Society, 2017, 139, 6253-6260 |
| 4126096 | CIF | C51 H34 Fe3 N6 O13 | R -3 c | 27.696; 27.696; 72.829 90; 90; 120 | 48380 | Zhang, Feng-Ming; Dong, Long-Zhang; Qin, Jun-Sheng; Guan, Wei; Liu, Jiang; Li, Shun-Li; Lu, Meng; Lan, Ya-Qian; Su, Zhong-Min; Zhou, Hong-Cai Effect of Imidazole Arrangements on Proton-Conductivity in Metal-Organic Frameworks. Journal of the American Chemical Society, 2017, 139, 6183-6189 |
| 4126097 | CIF | C23 H18 Br N O | P 1 21 1 | 6.3437; 16.5128; 9.2201 90; 109.431; 90 | 910.82 | Panda, Santanu; Ready, Joseph M. Palladium Catalyzed Asymmetric Three-Component Coupling of Boronic Esters, Indoles, and Allylic Acetates. Journal of the American Chemical Society, 2017, 139, 6038-6041 |
| 4126098 | CIF | C21 H19 Br2 N | P 1 21 1 | 19.8748; 9.4591; 20.538 90; 108.334; 90 | 3665.1 | Panda, Santanu; Ready, Joseph M. Palladium Catalyzed Asymmetric Three-Component Coupling of Boronic Esters, Indoles, and Allylic Acetates. Journal of the American Chemical Society, 2017, 139, 6038-6041 |
| 4126099 | CIF | C27 H34 B N O2 | P -1 | 9.5214; 10.1954; 12.8363 100.977; 110.01; 90.035 | 1146.5 | Panda, Santanu; Ready, Joseph M. Palladium Catalyzed Asymmetric Three-Component Coupling of Boronic Esters, Indoles, and Allylic Acetates. Journal of the American Chemical Society, 2017, 139, 6038-6041 |
| 4126100 | CIF | C8 H8 B N | P 1 21/c 1 | 7.85; 6.0119; 7.995 90; 112.37; 90 | 348.92 | Liu, Zhiqiang; Ishibashi, Jacob S. A.; Darrigan, Clovis; Dargelos, Alain; Chrostowska, Anna; Li, Bo; Vasiliu, Monica; Dixon, David A.; Liu, Shih-Yuan The Least Stable Isomer of BN Naphthalene: Toward Predictive Trends for the Optoelectronic Properties of BN Acenes. Journal of the American Chemical Society, 2017, 139, 6082-6085 |
| 4126101 | CIF | C8 H7 B F N | P 1 c 1 | 7.465; 14.687; 6.709 90; 103.79; 90 | 714.4 | Liu, Zhiqiang; Ishibashi, Jacob S. A.; Darrigan, Clovis; Dargelos, Alain; Chrostowska, Anna; Li, Bo; Vasiliu, Monica; Dixon, David A.; Liu, Shih-Yuan The Least Stable Isomer of BN Naphthalene: Toward Predictive Trends for the Optoelectronic Properties of BN Acenes. Journal of the American Chemical Society, 2017, 139, 6082-6085 |
| 4126102 | CIF | C28 H30 F8 N2 Ni O3 | P 1 21/c 1 | 13.09343; 10.40312; 19.9446 90; 93.8233; 90 | 2710.66 | Chong, Eugene; Kampf, Jeff W.; Ariafard, Alireza; Canty, Allan J.; Sanford, Melanie S. Oxidatively Induced C-H Activation at High Valent Nickel. Journal of the American Chemical Society, 2017, 139, 6058-6061 |
| 4126103 | CIF | C19 H11 F9 N2 Ni | P n m a | 15.88344; 12.97082; 8.60488 90; 90; 90 | 1772.79 | Chong, Eugene; Kampf, Jeff W.; Ariafard, Alireza; Canty, Allan J.; Sanford, Melanie S. Oxidatively Induced C-H Activation at High Valent Nickel. Journal of the American Chemical Society, 2017, 139, 6058-6061 |
| 4126104 | CIF | C31 H50 O7 Si2 | P 21 21 21 | 10.161; 11.489; 30.374 90; 90; 90 | 3545.9 | Chen, Dezhi; Evans, P. Andrew A Concise, Efficient and Scalable Total Synthesis of Thapsigargin and Nortrilobolide from (R)-(-)-Carvone. Journal of the American Chemical Society, 2017, 139, 6046-6049 |
| 4126105 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.2432; 5.1818; 7.3296 90; 100.94; 90 | 829.46 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126106 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.2521; 5.1837; 7.3301 90; 101.04; 90 | 829.87 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126107 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.251; 5.1888; 7.3397 90; 100.933; 90 | 832.03 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126108 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.2551; 5.1918; 7.3461 90; 100.931; 90 | 833.4 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126109 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.2721; 5.1991; 7.3568 90; 100.904; 90 | 836.5 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126110 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.2938; 5.2044; 7.3649 90; 100.915; 90 | 839.06 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126111 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.3078; 5.2074; 7.367 90; 100.931; 90 | 840.26 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126112 | CIF | C8 H24 Br3 N4 O4 Pd | C 1 2 1 | 22.351; 5.2166; 7.3765 90; 101.008; 90 | 844.25 | Mian, Mohammad Rasel; Iguchi, Hiroaki; Takaishi, Shinya; Murasugi, Hideaki; Miyamoto, Tatsuya; Okamoto, Hiroshi; Tanaka, Hisaaki; Kuroda, Shin-Ichi; Breedlove, Brian K.; Yamashita, Masahiro Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability. Journal of the American Chemical Society, 2017, 139, 6562-6565 |
| 4126113 | CIF | C37 H23 Cl9 D3 N O4 | P -1 | 9.8055; 13.4551; 15.5005 67.404; 88.581; 83.35 | 1874.9 | Maier, Josef M.; Li, Ping; Vik, Erik C.; Yehl, Christopher J.; Strickland, Sharon M. S.; Shimizu, Ken D. Measurement of Solvent OH-π Interactions Using a Molecular Balance. Journal of the American Chemical Society, 2017, 139, 6550-6553 |
| 4126114 | CIF | C32 H24 N4 O8 | P 1 | 6.9466; 7.5493; 13.1221 97.113; 100.141; 104.254 | 646.39 | Kim, Dong Jun; Hermann, Keith R.; Prokofjevs, Aleksandrs; Otley, Michael T.; Pezzato, Cristian; Owczarek, Magdalena; Stoddart, J. Fraser Redox-Active Macrocycles for Organic Rechargeable Batteries. Journal of the American Chemical Society, 2017, 139, 6635-6643 |
| 4126115 | CIF | C22 H24 N2 O4 | P 1 21/n 1 | 27.492; 5.2268; 27.504 90; 112.44; 90 | 3652.9 | Kim, Dong Jun; Hermann, Keith R.; Prokofjevs, Aleksandrs; Otley, Michael T.; Pezzato, Cristian; Owczarek, Magdalena; Stoddart, J. Fraser Redox-Active Macrocycles for Organic Rechargeable Batteries. Journal of the American Chemical Society, 2017, 139, 6635-6643 |
| 4126116 | CIF | C39 H57 Pb | P 1 21/c 1 | 13.2953; 15.9523; 16.985 90; 104.356; 90 | 3489.87 | Schneider, Julia; Sindlinger, Christian P.; Eichele, Klaus; Schubert, Hartmut; Wesemann, Lars Low-Valent Lead Hydride and Its Extreme Low-Field (1)H NMR Chemical Shift. Journal of the American Chemical Society, 2017, 139, 6542-6545 |
| 4126117 | CIF | C21 H14 Au N | P 1 21/n 1 | 16.9857; 5.9677; 17.1136 90; 112.883; 90 | 1598.21 | Seki, Tomohiro; Tokodai, Noriaki; Omagari, Shun; Nakanishi, Takayuki; Hasegawa, Yasuchika; Iwasa, Takeshi; Taketsugu, Tetsuya; Ito, Hajime Luminescent Mechanochromic 9-Anthryl Gold(I) Isocyanide Complex with an Emission Maximum at 900 nm after Mechanical Stimulation. Journal of the American Chemical Society, 2017, 139, 6514-6517 |
| 4126118 | CIF | C27 H34 B N4 O2 P | P -1 | 10.7971; 11.4825; 12.3601 89.49; 65.116; 71.217 | 1301.7 | Lin, Yi-Chun; Hatzakis, Emmanuel; McCarthy, Sean M.; Reichl, Kyle D.; Lai, Ting-Yi; Yennawar, Hemant P.; Radosevich, Alexander T. P-N Cooperative Borane Activation and Catalytic Hydroboration by a Distorted Phosphorous Triamide Platform. Journal of the American Chemical Society, 2017, 139, 6008-6016 |
| 4126119 | CIF | C26 H35 B O2 | I 1 2/a 1 | 18.021; 10.4127; 50.4404 90; 90.378; 90 | 9464.8 | Lik, Artur; Fritze, Lars; Müller, Lars; Helten, Holger Catalytic B-C Coupling by Si/B Exchange: A Versatile Route to π-Conjugated Organoborane Molecules, Oligomers, and Polymers. Journal of the American Chemical Society, 2017, 139, 5692-5695 |
| 4126120 | CIF | C30 H39 B | P 1 21/n 1 | 8.987; 10.2; 27.625 90; 93.447; 90 | 2527.7 | Lik, Artur; Fritze, Lars; Müller, Lars; Helten, Holger Catalytic B-C Coupling by Si/B Exchange: A Versatile Route to π-Conjugated Organoborane Molecules, Oligomers, and Polymers. Journal of the American Chemical Society, 2017, 139, 5692-5695 |
| 4126121 | CIF | C60 H135 Ag Au20 S15 | P 1 2/c 1 | 26.2225; 14.9508; 29.2628 90; 99.579; 90 | 11312.4 | Yang, Sha; Chai, Jinsong; Song, Yongbo; Fan, Jiqiang; Chen, Tao; Wang, Shuxin; Yu, Haizhu; Li, Xiaowu; Zhu, Manzhou In Situ Two-Phase Ligand Exchange: A New Method for the Synthesis of Alloy Nanoclusters with Precise Atomic Structures. Journal of the American Chemical Society, 2017, 139, 5668-5671 |
| 4126122 | CIF | C60 H135 Ag5.2 Au15.81 S15 | P 1 2/c 1 | 26.1635; 15.0108; 29.0512 90; 99.1239; 90 | 11265.1 | Yang, Sha; Chai, Jinsong; Song, Yongbo; Fan, Jiqiang; Chen, Tao; Wang, Shuxin; Yu, Haizhu; Li, Xiaowu; Zhu, Manzhou In Situ Two-Phase Ligand Exchange: A New Method for the Synthesis of Alloy Nanoclusters with Precise Atomic Structures. Journal of the American Chemical Society, 2017, 139, 5668-5671 |
| 4126123 | CIF | C22 H25 N3 O6 | P 1 21/c 1 | 17.4243; 9.9387; 11.9804 90; 90.039; 90 | 2074.7 | Ma, Xiaoshen; Dang, Hester; Rose, John A.; Rablen, Paul; Herzon, Seth B. Hydroheteroarylation of Unactivated Alkenes Using N-Methoxyheteroarenium Salts. Journal of the American Chemical Society, 2017, 139, 5998-6007 |
| 4126124 | CIF | C22 H25 N3 O6 | P 1 21/c 1 | 29.723; 5.8059; 38.396 90; 110.525; 90 | 6205.3 | Ma, Xiaoshen; Dang, Hester; Rose, John A.; Rablen, Paul; Herzon, Seth B. Hydroheteroarylation of Unactivated Alkenes Using N-Methoxyheteroarenium Salts. Journal of the American Chemical Society, 2017, 139, 5998-6007 |
| 4126125 | CIF | C10 H11 N O3 | P 1 21/c 1 | 20.0813; 7.5198; 12.1237 90; 91.565; 90 | 1830.09 | Schäfer, Mathias; Peckelsen, Katrin; Paul, Mathias; Martens, Jonathan; Oomens, Jos; Berden, Giel; Berkessel, Albrecht; Meijer, Anthony J. H. M. Hydrogen Tunneling above Room Temperature Evidenced by Infrared Ion Spectroscopy. Journal of the American Chemical Society, 2017, 139, 5779-5786 |
| 4126126 | CIF | C45 H39 Cl F6 N O6 P2 Pt S2 Sb | P n m a | 27.051; 16.451; 10.734 90; 90; 90 | 4777 | You, Di; Gabbaï, François P Unmasking the Catalytic Activity of a Platinum Complex with a Lewis Acidic, Non-innocent Antimony Ligand. Journal of the American Chemical Society, 2017, 139, 6843-6846 |
| 4126127 | CIF | C21 H20 F N O2 S | P 1 | 8.9044; 10.1505; 11.649 84.652; 70.657; 67.909 | 919.9 | Wang, Dinghai; Wu, Lianqian; Wang, Fei; Wan, Xiaolong; Chen, Pinhong; Lin, Zhenyang; Liu, Guosheng Asymmetric Copper-Catalyzed Intermolecular Aminoarylation of Styrenes: Efficient Access to Optical 2,2-Diarylethylamines. Journal of the American Chemical Society, 2017, 139, 6811-6814 |
| 4126128 | CIF | C68 Hf6 O29 | F m m 2 | 42.669; 21.909; 24.6933 90; 90; 90 | 23084 | Cao, Lingyun; Lin, Zekai; Shi, Wenjie; Wang, Zi; Zhang, Cankun; Hu, Xuefu; Wang, Cheng; Lin, Wenbin Exciton Migration and Amplified Quenching on Two-Dimensional Metal-Organic Layers. Journal of the American Chemical Society, 2017, 139, 7020-7029 |
| 4126129 | CIF | C99.62 H162.25 Br Fe Mg O0.38 P2 Si3 | P 1 21/n 1 | 16.1139; 27.702; 22.922 90; 90.854; 90 | 10231 | Kneebone, Jared L.; Brennessel, William W.; Neidig, Michael L. Intermediates and Reactivity in Iron-Catalyzed Cross-Couplings of Alkynyl Grignards with Alkyl Halides. Journal of the American Chemical Society, 2017, 139, 6988-7003 |
| 4126130 | CIF | C95 H151 Br Fe Mg N2 P2 Si3 | P 1 21/n 1 | 13.9106; 25.8957; 26.9693 90; 95.6239; 90 | 9668.2 | Kneebone, Jared L.; Brennessel, William W.; Neidig, Michael L. Intermediates and Reactivity in Iron-Catalyzed Cross-Couplings of Alkynyl Grignards with Alkyl Halides. Journal of the American Chemical Society, 2017, 139, 6988-7003 |
| 4126131 | CIF | C90 H144 Br2 Fe Mg P2 Si2 | P -1 | 12.944; 13.667; 29.998 84.342; 87.967; 63.56 | 4728.4 | Kneebone, Jared L.; Brennessel, William W.; Neidig, Michael L. Intermediates and Reactivity in Iron-Catalyzed Cross-Couplings of Alkynyl Grignards with Alkyl Halides. Journal of the American Chemical Society, 2017, 139, 6988-7003 |
| 4126132 | CIF | C77 H120 Br Fe O P2 Si | P 1 21/c 1 | 14.4563; 30.137; 18.788 90; 110.4; 90 | 7672 | Kneebone, Jared L.; Brennessel, William W.; Neidig, Michael L. Intermediates and Reactivity in Iron-Catalyzed Cross-Couplings of Alkynyl Grignards with Alkyl Halides. Journal of the American Chemical Society, 2017, 139, 6988-7003 |
| 4126133 | CIF | C84 H130 Br Fe P2 Si2 | P 1 21/n 1 | 16.36; 19.2117; 27.0378 90; 90.482; 90 | 8497.8 | Kneebone, Jared L.; Brennessel, William W.; Neidig, Michael L. Intermediates and Reactivity in Iron-Catalyzed Cross-Couplings of Alkynyl Grignards with Alkyl Halides. Journal of the American Chemical Society, 2017, 139, 6988-7003 |
| 4126134 | CIF | C82 H116 Br2 Fe Mg2 O2 P2 | P -1 | 14.174; 17.662; 22.244 75.415; 86.088; 70.328 | 5073.8 | Kneebone, Jared L.; Brennessel, William W.; Neidig, Michael L. Intermediates and Reactivity in Iron-Catalyzed Cross-Couplings of Alkynyl Grignards with Alkyl Halides. Journal of the American Chemical Society, 2017, 139, 6988-7003 |
| 4126135 | CIF | C45 H65 Cu N2 O Si | P 1 21/c 1 | 14.0458; 20.6508; 14.499 90; 93.587; 90 | 4197.3 | Mailig, Melrose; Hazra, Avijit; Armstrong, Megan K.; Lalic, Gojko Catalytic Anti-Markovnikov Hydroallylation of Terminal and Functionalized Internal Alkynes: Synthesis of Skipped Dienes and Trisubstituted Alkenes. Journal of the American Chemical Society, 2017, 139, 6969-6977 |
| 4126136 | CIF | C16 H27 N O3 | P 1 21/n 1 | 12.477; 8.3561; 15.4163 90; 106.701; 90 | 1539.49 | Zhao, Xian-He; Zhang, Qing; Du, Ji-Yuan; Lu, Xin-Yun; Cao, Ye-Xing; Deng, Yu-Hua; Fan, Chun-An Total Synthesis of (±)-Lycojaponicumin D and Lycodoline-Type Lycopodium Alkaloids. Journal of the American Chemical Society, 2017, 139, 7095-7103 |
| 4126137 | CIF | C77 H74.5 N8 O8.5 | C 1 2/c 1 | 18.5033; 10.5908; 68.072 90; 91.094; 90 | 13337.3 | Leigh, David A.; Marcos, Vanesa; Nalbantoglu, Tugrul; Vitorica-Yrezabal, Iñigo J; Yasar, F. Tuba; Zhu, Xiaokang Pyridyl-Acyl Hydrazone Rotaxanes and Molecular Shuttles. Journal of the American Chemical Society, 2017, 139, 7104-7109 |
| 4126138 | CIF | C14 H12 N2 O3 S | P 1 c 1 | 12.916; 7.5579; 25.872 90; 99.551; 90 | 2490.6 | Kornahrens, Anne F.; Cognetta, 3rd, Armand B; Brody, Daniel M.; Matthews, Megan L.; Cravatt, Benjamin F.; Boger, Dale L. Design of Benzoxathiazin-3-one 1,1-Dioxides as a New Class of Irreversible Serine Hydrolase Inhibitors: Discovery of a Uniquely Selective PNPLA4 Inhibitor. Journal of the American Chemical Society, 2017, 139, 7052-7061 |
| 4126139 | CIF | C15 H10 N2 O4 S | P 1 21/n 1 | 7.3868; 11.9333; 15.7316 90; 98.146; 90 | 1372.73 | Kornahrens, Anne F.; Cognetta, 3rd, Armand B; Brody, Daniel M.; Matthews, Megan L.; Cravatt, Benjamin F.; Boger, Dale L. Design of Benzoxathiazin-3-one 1,1-Dioxides as a New Class of Irreversible Serine Hydrolase Inhibitors: Discovery of a Uniquely Selective PNPLA4 Inhibitor. Journal of the American Chemical Society, 2017, 139, 7052-7061 |
| 4126140 | CIF | C14 H12 N2 O3 S | P 1 21/c 1 | 6.3237; 13.019; 15.609 90; 91.713; 90 | 1284.5 | Kornahrens, Anne F.; Cognetta, 3rd, Armand B; Brody, Daniel M.; Matthews, Megan L.; Cravatt, Benjamin F.; Boger, Dale L. Design of Benzoxathiazin-3-one 1,1-Dioxides as a New Class of Irreversible Serine Hydrolase Inhibitors: Discovery of a Uniquely Selective PNPLA4 Inhibitor. Journal of the American Chemical Society, 2017, 139, 7052-7061 |
| 4126141 | CIF | C62 H80 Cl14 F24 N8 P4 Rh2 Sb4 | P 1 21/n 1 | 13.2883; 13.0485; 26.3951 90; 92.308; 90 | 4573 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126142 | CIF | C28 H22 | C 1 2/c 1 | 27.455; 8.9353; 19.0572 90; 125.169; 90 | 3821.7 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126143 | CIF | C37 H44 B2 Cl2 F8 N4 P2 | P 1 21/c 1 | 19.5245; 12.172; 17.6079 90; 102.298; 90 | 4088.5 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126144 | CIF | C29 H36 Cl2 F12 I2 N4 P2 Pt Sb2 | P 1 21/c 1 | 17.976; 14.1503; 17.202 90; 100.4; 90 | 4304 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126145 | CIF | C54 H72 B2 Cl3 Cu3 N4 | P c c n | 14.408; 15.791; 24.221 90; 90; 90 | 5510.7 | Braunschweig, Holger; Dellermann, Theresa; Dewhurst, Rian D.; Hupp, Benjamin; Kramer, Thomas; Mattock, James D.; Mies, Jan; Phukan, Ashwini K.; Steffen, Andreas; Vargas, Alfredo Strongly Phosphorescent Transition Metal π-Complexes of Boron-Boron Triple Bonds. Journal of the American Chemical Society, 2017, 139, 4887-4893 |
| 4126146 | CIF | C64 H90 B2 Cu2 N4 Si2 | P 1 21/c 1 | 21.5235; 12.3413; 25.5747 90; 110.501; 90 | 6363.1 | Braunschweig, Holger; Dellermann, Theresa; Dewhurst, Rian D.; Hupp, Benjamin; Kramer, Thomas; Mattock, James D.; Mies, Jan; Phukan, Ashwini K.; Steffen, Andreas; Vargas, Alfredo Strongly Phosphorescent Transition Metal π-Complexes of Boron-Boron Triple Bonds. Journal of the American Chemical Society, 2017, 139, 4887-4893 |
| 4126147 | CIF | C60 H78 B2 Cl2 Cu2 N4 | P 1 21/c 1 | 14.58; 16.059; 24.981 90; 93.26; 90 | 5840 | Braunschweig, Holger; Dellermann, Theresa; Dewhurst, Rian D.; Hupp, Benjamin; Kramer, Thomas; Mattock, James D.; Mies, Jan; Phukan, Ashwini K.; Steffen, Andreas; Vargas, Alfredo Strongly Phosphorescent Transition Metal π-Complexes of Boron-Boron Triple Bonds. Journal of the American Chemical Society, 2017, 139, 4887-4893 |
| 4126148 | CIF | C84 H87 N9 | R 3 c :H | 33.1271; 33.1271; 10.8586 90; 90; 120 | 10319.8 | Ke, Xian-Sheng; Kim, Taeyeon; Brewster, 2nd, James T; Lynch, Vincent M.; Kim, Dongho; Sessler, Jonathan L. Expanded Rosarin: A Versatile Fullerene (C60) Receptor. Journal of the American Chemical Society, 2017, 139, 4627-4630 |
| 4126149 | CIF | C217.5 H196 B3 Co3 F72 N12 O15.5 | P -1 | 19.2543; 20.7309; 29.5488 85.803; 82.661; 74.247 | 11249.5 | Akine, Shigehisa; Miyashita, Masato; Nabeshima, Tatsuya A Metallo-molecular Cage That Can Close the Apertures with Coordination Bonds. Journal of the American Chemical Society, 2017, 139, 4631-4634 |
| 4126150 | CIF | C103 La2 S6 | P 1 21/n 1 | 15.119; 20.012; 17.444 90; 96.09; 90 | 5248.1 | Zhao, Shasha; Zhao, Pei; Cai, Wenting; Bao, Lipiao; Chen, Muqing; Xie, Yunpeng; Zhao, Xiang; Lu, Xing Stabilization of Giant Fullerenes C2(41)-C90, D3(85)-C92, C1(132)-C94, C2(157)-C96, and C1(175)-C98 by Encapsulation of a Large La2C2 Cluster: The Importance of Cluster-Cage Matching. Journal of the American Chemical Society, 2017, 139, 4724-4728 |
| 4126151 | CIF | C84 Cl32.12 O1.07 V0.71 | P -1 | 17.2709; 19.3481; 22.494 85.767; 80.923; 84.766 | 7378 | Jin, Fei; Yang, Shangfeng; Kemnitz, Erhard; Troyanov, Sergey I. Skeletal Transformation of a Classical Fullerene C88 into a Nonclassical Fullerene Chloride C84Cl30 Bearing Quaternary Sequentially Fused Pentagons. Journal of the American Chemical Society, 2017, 139, 4651-4654 |
| 4126152 | CIF | C19 H20 N2 O4 | P 21 21 21 | 10.89189; 11.24945; 14.39801 90; 90; 90 | 1764.16 | Sanchez-Sanchez, Ana; Rivilla, Ivan; Agirre, Maddalen; Basterretxea, Andere; Etxeberria, Agustin; Veloso, Antonio; Sardon, Haritz; Mecerreyes, David; Cossío, Fernando P Enantioselective Ring-Opening Polymerization of rac-Lactide Dictated by Densely Substituted Amino Acids. Journal of the American Chemical Society, 2017, 139, 4805-4814 |
| 4126153 | CIF | C57 H63 O P2 Rh S Si | P 21 21 2 | 22.12; 22.8814; 9.7523 90; 90; 90 | 4936 | Lee, Taegyo; Hartwig, John F. Mechanistic Studies on Rhodium-Catalyzed Enantioselective Silylation of Aryl C-H Bonds. Journal of the American Chemical Society, 2017, 139, 4879-4886 |
| 4126154 | CIF | C30.44 H68.49 Mn4.39 N8 O1.17 | C m c 21 | 17.2315; 12.7392; 19.4043 90; 90; 90 | 4259.5 | Vaddypally, Shivaiah; Kondaveeti, Sandeep K.; Karki, Santosh; Van Vliet, Megan M.; Levis, Robert J.; Zdilla, Michael J. Reactive Pendant Mn═O in a Synthetic Structural Model of a Proposed S4 State in the Photosynthetic Oxygen Evolving Complex. Journal of the American Chemical Society, 2017, 139, 4675-4681 |
| 4126155 | CIF | C28 H64 Mn4 N8 | R 3 m :H | 34.7647; 34.7647; 10.8425 90; 90; 120 | 11348.5 | Vaddypally, Shivaiah; Kondaveeti, Sandeep K.; Karki, Santosh; Van Vliet, Megan M.; Levis, Robert J.; Zdilla, Michael J. Reactive Pendant Mn═O in a Synthetic Structural Model of a Proposed S4 State in the Photosynthetic Oxygen Evolving Complex. Journal of the American Chemical Society, 2017, 139, 4675-4681 |
| 4126156 | CIF | C48 H34 Cu2 F8 N10 O4 S2 | P 1 21/n 1 | 9.801; 29.7197; 16.1655 90; 95.389; 90 | 4687.92 | Ziegler, Micah S.; Lakshmi, K. V.; Tilley, T. Don Dicopper Cu(I)Cu(I) and Cu(I)Cu(II) Complexes in Copper-Catalyzed Azide-Alkyne Cycloaddition. Journal of the American Chemical Society, 2017, 139, 5378-5386 |
| 4126157 | CIF | C16 H17 F4 N O4 S | P 21 21 21 | 5.1711; 8.6014; 38.2861 90; 90; 90 | 1702.92 | Zhang, Zhongyin; Wang, Jinxin; Li, Jian; Yang, Fan; Liu, Guodu; Tang, Wenjun; He, Weiwei; Fu, Jian-Jun; Shen, Yun-Heng; Li, Ang; Zhang, Wei-Dong Total Synthesis and Stereochemical Assignment of Delavatine A: Rh-Catalyzed Asymmetric Hydrogenation of Indene-Type Tetrasubstituted Olefins and Kinetic Resolution through Pd-Catalyzed Triflamide-Directed C-H Olefination. Journal of the American Chemical Society, 2017, 139, 5558-5567 |
| 4126158 | CIF | C23 H35 O6 P | P 1 21 1 | 5.8162; 14.731; 14.1976 90; 95.494; 90 | 1210.8 | Zhang, Zhongyin; Wang, Jinxin; Li, Jian; Yang, Fan; Liu, Guodu; Tang, Wenjun; He, Weiwei; Fu, Jian-Jun; Shen, Yun-Heng; Li, Ang; Zhang, Wei-Dong Total Synthesis and Stereochemical Assignment of Delavatine A: Rh-Catalyzed Asymmetric Hydrogenation of Indene-Type Tetrasubstituted Olefins and Kinetic Resolution through Pd-Catalyzed Triflamide-Directed C-H Olefination. Journal of the American Chemical Society, 2017, 139, 5558-5567 |
| 4126159 | CIF | C25 H20 Cl N3 O5 | P 21 21 21 | 11.5579; 13.5603; 14.1952 90; 90; 90 | 2224.79 | Rombola, Michael; Sumaria, Chintan S.; Montgomery, Thomas D.; Rawal, Viresh H. Development of Chiral, Bifunctional Thiosquaramides: Enantioselective Michael Additions of Barbituric Acids to Nitroalkenes. Journal of the American Chemical Society, 2017, 139, 5297-5300 |
| 4126160 | CIF | C34 H46 N6 O9 | P -1 | 12.1129; 12.7793; 13.0678 69.583; 68.112; 75.921 | 1744.1 | Shen, Jie; Ren, Changliang; Zeng, Huaqiang Surprisingly High Selectivity and High Affinity in Mercury Recognition by H-Bonded Cavity-Containing Aromatic Foldarands. Journal of the American Chemical Society, 2017, 139, 5387-5396 |
| 4126161 | CIF | C10 H8 F3 N O2 | P 1 21 1 | 8.0948; 6.72581; 9.5368 90; 110.999; 90 | 484.74 | Tinoco, Antonio; Steck, Viktoria; Tyagi, Vikas; Fasan, Rudi Highly Diastereo- and Enantioselective Synthesis of Trifluoromethyl-Substituted Cyclopropanes via Myoglobin-Catalyzed Transfer of Trifluoromethylcarbene. Journal of the American Chemical Society, 2017, 139, 5293-5296 |
| 4126162 | CIF | C40.75 H10.75 B Cl2.25 F12 N11 | P 21 21 21 | 8.3602; 20.2111; 23.8869 90; 90; 90 | 4036.1 | Winterfeld, Kim A.; Lavarda, Giulia; Guilleme, Julia; Sekita, Michael; Guldi, Dirk M.; Torres, Tomás; Bottari, Giovanni Subphthalocyanines Axially Substituted with a Tetracyanobuta-1,3-diene-Aniline Moiety: Synthesis, Structure, and Physicochemical Properties. Journal of the American Chemical Society, 2017, 139, 5520-5529 |
| 4126163 | CIF | C12 H39 Fe2 N P2 Si2 | P 1 21/c 1 | 12.4697; 11.1813; 16.959 90; 101.431; 90 | 2317.6 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126164 | CIF | C25 H43 Fe2 N P2 Si2 | P 1 21/n 1 | 12.2; 12.193; 21.38 90; 96.986; 90 | 3156.76 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126165 | CIF | C36 H102 Fe4 N2 P4 Si4 | P 1 21/c 1 | 12.824; 19.427; 12.822 90; 119.741; 90 | 2773.6 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126166 | CIF | C15 H51 Fe3 P5 | P 1 21/n 1 | 9.093; 17.649; 18.004 90; 104.213; 90 | 2800.9 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126167 | CIF | C31 H82 Fe4 N4 Si8 | C 1 2/c 1 | 56.57; 9.416; 20.221 90; 109.6; 90 | 10147 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126168 | CIF | C36.5 H46 Fe2 P2 S | P -1 | 11.6275; 12.8701; 13.8878 68.049; 80.992; 84.412 | 1902.1 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126169 | CIF | C55 H94 Fe4 N2 O P2 Si6 | P 1 21/n 1 | 17.01; 14.8254; 27.41 90; 104.343; 90 | 6696.8 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126170 | CIF | C42 H114 Fe6.4 N6 Si12 | P -1 | 14.5261; 14.9231; 19.419 87.674; 84.043; 62.903 | 3727.1 | Araake, Ryoichi; Sakadani, Kazuki; Tada, Mizuki; Sakai, Yoichi; Ohki, Yasuhiro [Fe4] and [Fe6] Hydride Clusters Supported by Phosphines: Synthesis, Characterization, and Application in N2 Reduction. Journal of the American Chemical Society, 2017, 139, 5596-5606 |
| 4126171 | CIF | C26 H32 Cl2 Co3 Mn N3 O14 | P 1 21/c 1 | 9.961; 14.995; 23.36 90; 101.013; 90 | 3425 | Nguyen, Andy I.; Suess, Daniel L. M.; Darago, Lucy E.; Oyala, Paul H.; Levine, Daniel S.; Ziegler, Micah S.; Britt, R. David; Tilley, T. Don Manganese-Cobalt Oxido Cubanes Relevant to Manganese-Doped Water Oxidation Catalysts. Journal of the American Chemical Society, 2017, 139, 5579-5587 |
| 4126172 | CIF | C23 H0 Cl Co3 Mn N3 O12 | P 1 21/c 1 | 14.9291; 19.8299; 23.3866 90; 95.45; 90 | 6892.1 | Nguyen, Andy I.; Suess, Daniel L. M.; Darago, Lucy E.; Oyala, Paul H.; Levine, Daniel S.; Ziegler, Micah S.; Britt, R. David; Tilley, T. Don Manganese-Cobalt Oxido Cubanes Relevant to Manganese-Doped Water Oxidation Catalysts. Journal of the American Chemical Society, 2017, 139, 5579-5587 |
| 4126173 | CIF | C13.5 H17.5 Cl4 Co1.5 Mn0.5 N2.5 O8 | P n m a | 17.957; 11.196; 21.836 90; 90; 90 | 4390 | Nguyen, Andy I.; Suess, Daniel L. M.; Darago, Lucy E.; Oyala, Paul H.; Levine, Daniel S.; Ziegler, Micah S.; Britt, R. David; Tilley, T. Don Manganese-Cobalt Oxido Cubanes Relevant to Manganese-Doped Water Oxidation Catalysts. Journal of the American Chemical Society, 2017, 139, 5579-5587 |
| 4126174 | CIF | C30 H36 Cl4 Co3 F6 Mn N4 O12 P | C 1 2/c 1 | 11.348; 25.096; 15.243 90; 99.341; 90 | 4283 | Nguyen, Andy I.; Suess, Daniel L. M.; Darago, Lucy E.; Oyala, Paul H.; Levine, Daniel S.; Ziegler, Micah S.; Britt, R. David; Tilley, T. Don Manganese-Cobalt Oxido Cubanes Relevant to Manganese-Doped Water Oxidation Catalysts. Journal of the American Chemical Society, 2017, 139, 5579-5587 |
| 4126175 | CIF | C12 H13 Cl3 O | P 1 21 1 | 9.8618; 6.3632; 11.405 90; 112.453; 90 | 661.44 | Tan, Yu; Luo, Shilong; Li, Dongmei; Zhang, Nan; Jia, Shiqi; Liu, Yidong; Qin, Wenling; Song, Choong Eui; Yan, Hailong Enantioselective Synthesis of anti-syn-Trihalides and anti-syn-anti-Tetrahalides via Asymmetric β-Elimination. Journal of the American Chemical Society, 2017, 139, 6431-6436 |
| 4126176 | CIF | C44 H39 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.6982; 30.0863; 13.1081 90; 103.64; 90 | 4100.1 | Phan, Hoa; Hrudka, Jeremy J.; Igimbayeva, Dilyara; Lawson Daku, Latévi M; Shatruk, Michael A Simple Approach for Predicting the Spin State of Homoleptic Fe(II) Tris-diimine Complexes. Journal of the American Chemical Society, 2017, 139, 6437-6447 |
| 4126177 | CIF | C28 H40 Cl3 N2 Nb | P 1 21/n 1 | 13.464; 16.332; 13.454 90; 96.9226; 90 | 2936.9 | Nishiyama, Haruka; Ikeda, Hideaki; Saito, Teruhiko; Kriegel, Benjamin; Tsurugi, Hayato; Arnold, John; Mashima, Kazushi Structural and Electronic Noninnocence of α-Diimine Ligands on Niobium for Reductive C-Cl Bond Activation and Catalytic Radical Addition Reactions. Journal of the American Chemical Society, 2017, 139, 6494-6505 |
| 4126178 | CIF | C26 H36 Cl3 N2 Nb | P 1 21/n 1 | 10.3441; 12.4185; 21.662 90; 90.088; 90 | 2782.7 | Nishiyama, Haruka; Ikeda, Hideaki; Saito, Teruhiko; Kriegel, Benjamin; Tsurugi, Hayato; Arnold, John; Mashima, Kazushi Structural and Electronic Noninnocence of α-Diimine Ligands on Niobium for Reductive C-Cl Bond Activation and Catalytic Radical Addition Reactions. Journal of the American Chemical Society, 2017, 139, 6494-6505 |
| 4126179 | CIF | C28 H40 Cl4 N2 Nb | P 1 | 8.9239; 8.9564; 10.7523 83.181; 71.363; 67.662 | 753.21 | Nishiyama, Haruka; Ikeda, Hideaki; Saito, Teruhiko; Kriegel, Benjamin; Tsurugi, Hayato; Arnold, John; Mashima, Kazushi Structural and Electronic Noninnocence of α-Diimine Ligands on Niobium for Reductive C-Cl Bond Activation and Catalytic Radical Addition Reactions. Journal of the American Chemical Society, 2017, 139, 6494-6505 |
| 4126180 | CIF | C26 H36 Cl4 N2 Nb | P -1 | 10.4231; 12.6112; 21.4888 90.1387; 90.051; 90.043 | 2824.6 | Nishiyama, Haruka; Ikeda, Hideaki; Saito, Teruhiko; Kriegel, Benjamin; Tsurugi, Hayato; Arnold, John; Mashima, Kazushi Structural and Electronic Noninnocence of α-Diimine Ligands on Niobium for Reductive C-Cl Bond Activation and Catalytic Radical Addition Reactions. Journal of the American Chemical Society, 2017, 139, 6494-6505 |
| 4126181 | CIF | C42 H72 Cl4 N3 Nb | P 1 21/c 1 | 15.1156; 13.154; 24.238 90; 104.615; 90 | 4663.3 | Nishiyama, Haruka; Ikeda, Hideaki; Saito, Teruhiko; Kriegel, Benjamin; Tsurugi, Hayato; Arnold, John; Mashima, Kazushi Structural and Electronic Noninnocence of α-Diimine Ligands on Niobium for Reductive C-Cl Bond Activation and Catalytic Radical Addition Reactions. Journal of the American Chemical Society, 2017, 139, 6494-6505 |
| 4126182 | CIF | C18.8 H14.1 N9.7 O3.4 Zn2 | I m -3 m | 35.943; 35.943; 35.943 90; 90; 90 | 46435 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126183 | CIF | C7.25 H5.75 N4.25 O0.5 Zn | P m -3 m | 22.688; 22.688; 22.688 90; 90; 90 | 11679 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126184 | CIF | C7.5 H4 Cl0.5 N4.25 O0.5 Zn | R -3 | 26.9457; 26.9457; 26.763 90; 90; 120 | 16828.5 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126185 | CIF | C11 H7 Cl N4 O Zn | P 63/m m c | 25.9453; 25.9453; 19.5015 90; 90; 120 | 11368.8 | Yang, Jingjing; Zhang, Yue-Biao; Liu, Qi; Trickett, Christopher A.; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Cong, Hengjiang; Aldossary, Abdulrahman; Deng, Hexiang; Yaghi, Omar M. Principles of Designing Extra-Large Pore Openings and Cages in Zeolitic Imidazolate Frameworks. Journal of the American Chemical Society, 2017, 139, 6448-6455 |
| 4126186 | CIF | C28 H25 B F2 N2 O2 | C 1 c 1 | 14.912; 21.0584; 7.2943 90; 101.1; 90 | 2247.73 | Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Savoie, Huguette; Flanagan, Keith J.; Sy, Cindy; Sitte, Elisabeth; Telitchko, Maxime; Laquai, Frédéric; Boyle, Ross W.; Senge, Mathias O. Generation of Triplet Excited States via Photoinduced Electron Transfer in meso-anthra-BODIPY: Fluorogenic Response toward Singlet Oxygen in Solution and in Vitro. Journal of the American Chemical Society, 2017, 139, 6282-6285 |
| 4126187 | CIF | C31 H34 Cl14 P2 Sb2 | P 1 21/n 1 | 14.258; 17.7595; 18.3616 90; 106.098; 90 | 4467.1 | Schevenels, Florian T.; Shen, Minxing; Snyder, Scott A. Isolable and Readily Handled Halophosphonium Pre-reagents for Hydro- and Deuteriohalogenation. Journal of the American Chemical Society, 2017, 139, 6329-6337 |
| 4126188 | CIF | C27 H23 N Si | P 1 21/n 1 | 9.845; 17.109; 12.769 90; 98.083; 90 | 2129.4 | Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao B(C6F5)3-Catalyzed (Convergent) Disproportionation Reaction of Indoles. Journal of the American Chemical Society, 2017, 139, 7399-7407 |
| 4126189 | CIF | C20 H30 O4 | P 21 21 21 | 6.5876; 11.5796; 23.9814 90; 90; 90 | 1829.3 | Slutskyy, Yuriy; Jamison, Christopher R.; Zhao, Peng; Lee, Juyeol; Rhee, Young Ho; Overman, Larry E. Versatile Construction of 6-Substituted cis-2,8-Dioxabicyclo[3.3.0]octan-3-ones: Short Enantioselective Total Syntheses of Cheloviolenes A and B and Dendrillolide C. Journal of the American Chemical Society, 2017, 139, 7192-7195 |
| 4126190 | CIF | C17 H10 N3 O2 | P -1 | 5.9182; 11.437; 23.063 84.78; 89.98; 74.96 | 1500.9 | Ott, Amy A.; Goshey, Charles S.; Topczewski, Joseph J. Dynamic Kinetic Resolution of Allylic Azides via Asymmetric Dihydroxylation. Journal of the American Chemical Society, 2017, 139, 7737-7740 |
| 4126191 | CIF | C17 H19 N3 O2 | P 1 21 1 | 6.029; 10.7498; 11.652 90; 92.969; 90 | 754.16 | Ott, Amy A.; Goshey, Charles S.; Topczewski, Joseph J. Dynamic Kinetic Resolution of Allylic Azides via Asymmetric Dihydroxylation. Journal of the American Chemical Society, 2017, 139, 7737-7740 |
| 4126192 | CIF | C720 H816 Cu24 N48 O152 Zn32 | F 41 3 2 | 41.7868; 41.7868; 41.7868 90; 90; 90 | 72965.5 | Xia, Qingchun; Li, Zijian; Tan, Chunxia; Liu, Yan; Gong, Wei; Cui, Yong Multivariate Metal-Organic Frameworks as Multifunctional Heterogeneous Asymmetric Catalysts for Sequential Reactions. Journal of the American Chemical Society, 2017, 139, 8259-8266 |
| 4126193 | CIF | C77 H24 Cu12 N28 O39 Zn12 | P 42/m m c | 25.4241; 25.4241; 30.4446 90; 90; 90 | 19678.9 | Tu, Binbin; Pang, Qingqing; Xu, Huoshu; Li, Xiaomin; Wang, Yulin; Ma, Zhen; Weng, Linhong; Li, Qiaowei Reversible Redox Activity in Multicomponent Metal-Organic Frameworks Constructed from Trinuclear Copper Pyrazolate Building Blocks. Journal of the American Chemical Society, 2017, 139, 7998-8007 |
| 4126194 | CIF | C144 H72 Cu24 N46 O91 Zn24 | P 63/m | 38.3063; 38.3063; 47.3759 90; 90; 120 | 60204 | Tu, Binbin; Pang, Qingqing; Xu, Huoshu; Li, Xiaomin; Wang, Yulin; Ma, Zhen; Weng, Linhong; Li, Qiaowei Reversible Redox Activity in Multicomponent Metal-Organic Frameworks Constructed from Trinuclear Copper Pyrazolate Building Blocks. Journal of the American Chemical Society, 2017, 139, 7998-8007 |
| 4126195 | CIF | C14 H10 N2 O2 S2 | P -1 | 3.8141; 5.585; 14.3443 95.385; 96.169; 94.844 | 301.07 | Liu, Xuncheng; He, Bo; Anderson, Christopher L.; Kang, Jun; Chen, Teresa; Chen, Jinxiang; Feng, Shizhen; Zhang, Lianjie; Kolaczkowski, Matthew A.; Teat, Simon J.; Brady, Michael A.; Zhu, Chenhui; Wang, Lin-Wang; Chen, Junwu; Liu, Yi para-Azaquinodimethane: A Compact Quinodimethane Variant as an Ambient Stable Building Block for High-Performance Low Band Gap Polymers. Journal of the American Chemical Society, 2017, 139, 8355-8363 |
| 4126196 | CIF | C38 H44 Br2 N2 O2 S4 | P -1 | 5.5076; 11.903; 14.5103 86.927; 81.604; 76.84 | 916.14 | Liu, Xuncheng; He, Bo; Anderson, Christopher L.; Kang, Jun; Chen, Teresa; Chen, Jinxiang; Feng, Shizhen; Zhang, Lianjie; Kolaczkowski, Matthew A.; Teat, Simon J.; Brady, Michael A.; Zhu, Chenhui; Wang, Lin-Wang; Chen, Junwu; Liu, Yi para-Azaquinodimethane: A Compact Quinodimethane Variant as an Ambient Stable Building Block for High-Performance Low Band Gap Polymers. Journal of the American Chemical Society, 2017, 139, 8355-8363 |
| 4126198 | CIF | C47 H74 Cl N32 O21 | P 1 21/c 1 | 24.246; 13.201; 20.956 90; 110.86; 90 | 6268 | Reany, Ofer; Li, Amanda; Yefet, Maayan; Gilson, Michael K.; Keinan, Ehud Attractive Interactions between Heteroallenes and the Cucurbituril Portal. Journal of the American Chemical Society, 2017, 139, 8138-8145 |
| 4126199 | CIF | C48 H86 Cl2 N32 O24 | P 1 21/c 1 | 12.707; 13.39; 20.362 90; 103.126; 90 | 3374.01 | Reany, Ofer; Li, Amanda; Yefet, Maayan; Gilson, Michael K.; Keinan, Ehud Attractive Interactions between Heteroallenes and the Cucurbituril Portal. Journal of the American Chemical Society, 2017, 139, 8138-8145 |
| 4126200 | CIF | C660 H570 Eu10 N90 O60 | I 21 3 | 61.483; 61.483; 61.483 90; 90; 90 | 232416 | Li, Xiao-Zhen; Zhou, Li-Peng; Yan, Liang-Liang; Yuan, Da-Qiang; Lin, Chen-Sheng; Sun, Qing-Fu Evolution of Luminescent Supramolecular Lanthanide M2nL3n Complexes from Helicates and Tetrahedra to Cubes. Journal of the American Chemical Society, 2017, 139, 8237-8244 |
| 4126201 | CIF | C31 H35 Cl N O P Pd | P 21 21 21 | 9.333; 11.991; 24.067 90; 90; 90 | 2693 | Lim, Kelvin Meng-Hui; Hayashi, Tamio Dynamic Kinetic Resolution in Rhodium-Catalyzed Asymmetric Arylation of Phospholene Oxides. Journal of the American Chemical Society, 2017, 139, 8122-8125 |
| 4126206 | CIF | C21 H22 Cl3 N3 O3 | P 63 | 19.4252; 19.4252; 12.1355 90; 90; 120 | 3965.7 | Sun, Bo; Balaji, Pandur Venkatesan; Kumagai, Naoya; Shibasaki, Masakatsu α-Halo Amides as Competent Latent Enolates: Direct Catalytic Asymmetric Mannich-Type Reaction. Journal of the American Chemical Society, 2017, 139, 8295-8301 |
| 4126207 | CIF | C21 H23 Cl F N3 O3 | P 63 | 19.4558; 19.4558; 11.4079 90; 90; 120 | 3739.68 | Sun, Bo; Balaji, Pandur Venkatesan; Kumagai, Naoya; Shibasaki, Masakatsu α-Halo Amides as Competent Latent Enolates: Direct Catalytic Asymmetric Mannich-Type Reaction. Journal of the American Chemical Society, 2017, 139, 8295-8301 |
| 4126208 | CIF | C21 H23 Cl2 N3 O3 | P 21 21 21 | 9.6942; 10.5648; 20.0832 90; 90; 90 | 2056.87 | Sun, Bo; Balaji, Pandur Venkatesan; Kumagai, Naoya; Shibasaki, Masakatsu α-Halo Amides as Competent Latent Enolates: Direct Catalytic Asymmetric Mannich-Type Reaction. Journal of the American Chemical Society, 2017, 139, 8295-8301 |
| 4126209 | CIF | C180 H566 Cu24 N84 O253 | R 3 :H | 38.2768; 38.2768; 34.6107 90; 90; 120 | 43915 | Mon, Marta; Ferrando-Soria, Jesús; Verdaguer, Michel; Train, Cyrille; Paillard, Charles; Dkhil, Brahim; Versace, Carlo; Bruno, Rosaria; Armentano, Donatella; Pardo, Emilio Postsynthetic Approach for the Rational Design of Chiral Ferroelectric Metal-Organic Frameworks. Journal of the American Chemical Society, 2017, 139, 8098-8101 |
| 4126212 | CIF | C76 H127 Ca14 O76 | P 1 21 1 | 24.3868; 13.2612; 24.971 90; 90.327; 90 | 8075.4 | Yang, Jingjing; Trickett, Christopher A.; Alahmadi, Salman B.; Alshammari, Ahmad S.; Yaghi, Omar M. Calcium l-Lactate Frameworks as Naturally Degradable Carriers for Pesticides. Journal of the American Chemical Society, 2017, 139, 8118-8121 |
| 4126213 | CIF | C24 H27 N O4 | P -1 | 8.78; 9.429; 14.132 104.7; 92.47; 109.332 | 1057.4 | Zhang, Fa-Guang; Marek, Ilan Brook Rearrangement as Trigger for Carbene Generation: Synthesis of Stereodefined and Fully Substituted Cyclobutenes. Journal of the American Chemical Society, 2017, 139, 8364-8370 |
| 4126214 | CIF | C130 H158 Co2 N18 Na4 O20 | P 1 21/n 1 | 13.4591; 24.504; 19.268 90; 98.583; 90 | 6283.5 | Andrez, Julie; Guidal, Valentin; Scopelliti, Rosario; Pécaut, Jacques; Gambarelli, Serge; Mazzanti, Marinella Ligand and Metal Based Multielectron Redox Chemistry of Cobalt Supported by Tetradentate Schiff Bases. Journal of the American Chemical Society, 2017, 139, 8628-8638 |
| 4126215 | CIF | C90 H124 Co2 N8 Na4 O26 | P 1 21/c 1 | 22.0036; 14.5281; 28.4397 90; 94.568; 90 | 9062.5 | Andrez, Julie; Guidal, Valentin; Scopelliti, Rosario; Pécaut, Jacques; Gambarelli, Serge; Mazzanti, Marinella Ligand and Metal Based Multielectron Redox Chemistry of Cobalt Supported by Tetradentate Schiff Bases. Journal of the American Chemical Society, 2017, 139, 8628-8638 |
| 4126216 | CIF | C26 H26 Co K N2 O5 | P 1 21/c 1 | 13.0057; 15.1594; 12.1103 90; 99.971; 90 | 2351.59 | Andrez, Julie; Guidal, Valentin; Scopelliti, Rosario; Pécaut, Jacques; Gambarelli, Serge; Mazzanti, Marinella Ligand and Metal Based Multielectron Redox Chemistry of Cobalt Supported by Tetradentate Schiff Bases. Journal of the American Chemical Society, 2017, 139, 8628-8638 |
| 4126217 | CIF | C24 H22 Co K N2 O3 | C 1 c 1 | 18.65; 15.4996; 7.5174 90; 93.098; 90 | 2169.9 | Andrez, Julie; Guidal, Valentin; Scopelliti, Rosario; Pécaut, Jacques; Gambarelli, Serge; Mazzanti, Marinella Ligand and Metal Based Multielectron Redox Chemistry of Cobalt Supported by Tetradentate Schiff Bases. Journal of the American Chemical Society, 2017, 139, 8628-8638 |
| 4126224 | CIF | C44 H51 Cu2 F6 N8 O8.5 S2 | P c a 21 | 14.5045; 32.977; 20.6961 90; 90; 90 | 9899.3 | Koepke, Sara J.; Light, Kenneth M.; VanNatta, Peter E.; Wiley, Keaton M.; Kieber-Emmons, Matthew T Electrocatalytic Water Oxidation by a Homogeneous Copper Catalyst Disfavors Single-Site Mechanisms. Journal of the American Chemical Society, 2017, 139, 8586-8600 |
| 4126225 | CIF | C20 H27 N O6 | P 21 21 21 | 10.6716; 11.1383; 34.5954 90; 90; 90 | 4112.13 | Bartlett, Samuel L.; Sohtome, Yoshihiro; Hashizume, Daisuke; White, Peter S.; Sawamura, Miki; Johnson, Jeffrey S.; Sodeoka, Mikiko Catalytic Enantioselective [3 + 2] Cycloaddition of α-Keto Ester Enolates and Nitrile Oxides. Journal of the American Chemical Society, 2017, 139, 8661-8666 |
| 4126227 | CIF | C26 H47 B O Si | P 1 21/c 1 | 10.3814; 8.5313; 30.7969 90; 99.6603; 90 | 2688.91 | Sanzone, Jillian R.; Hu, Chunhua T.; Woerpel, K. A. Uncatalyzed Carboboration of Seven-Membered-Ring trans-Alkenes: Formation of Air-Stable Trialkylboranes. Journal of the American Chemical Society, 2017, 139, 8404-8407 |
| 4126228 | CIF | C28 H49 B O Si | P 1 21 1 | 9.1353; 14.1491; 11.2404 90; 108.677; 90 | 1376.4 | Sanzone, Jillian R.; Hu, Chunhua T.; Woerpel, K. A. Uncatalyzed Carboboration of Seven-Membered-Ring trans-Alkenes: Formation of Air-Stable Trialkylboranes. Journal of the American Chemical Society, 2017, 139, 8404-8407 |
| 4126231 | CIF | C20 H31 N O13 | P 1 21 1 | 9.2809; 24.198; 11.1739 90; 104.854; 90 | 2425.6 | Cecioni, Samy; Vocadlo, David J. Carbohydrate Bis-acetal-Based Substrates as Tunable Fluorescence-Quenched Probes for Monitoring exo-Glycosidase Activity. Journal of the American Chemical Society, 2017, 139, 8392-8395 |
| 4126232 | CIF | C20 H30 Br N O12 | P 21 21 21 | 9.1328; 22.1807; 26.2782 90; 90; 90 | 5323.2 | Cecioni, Samy; Vocadlo, David J. Carbohydrate Bis-acetal-Based Substrates as Tunable Fluorescence-Quenched Probes for Monitoring exo-Glycosidase Activity. Journal of the American Chemical Society, 2017, 139, 8392-8395 |
| 4126236 | CIF | C134 H150 Cl9 N8 Ni2 O | P -1 | 15.6525; 20.125; 21.372 89.65; 69.675; 89.297 | 6312.7 | Fukui, Norihito; Kim, Taeyeon; Kim, Dongho; Osuka, Atsuhiro Porphyrin Arch-Tapes: Synthesis, Contorted Structures, and Full Conjugation. Journal of the American Chemical Society, 2017, 139, 9075-9088 |
| 4126246 | CIF | C33 H44 Cu F6 N2 O | P -1 | 11.5773; 19.2314; 23.096 76.137; 85.509; 89.792 | 4976.5 | Kundu, Subrata; Greene, Christine; Williams, Kamille D.; Salvador, Tolani K.; Bertke, Jeffery A.; Cundari, Thomas R.; Warren, Timothy H. Three-Coordinate Copper(II) Aryls: Key Intermediates in C-O Bond Formation. Journal of the American Chemical Society, 2017, 139, 9112-9115 |
| 4126247 | CIF | C27 H19 Cu F11 N3 O | P -1 | 8.1196; 11.6482; 14.8107 77.997; 86.159; 75.192 | 1324.5 | Kundu, Subrata; Greene, Christine; Williams, Kamille D.; Salvador, Tolani K.; Bertke, Jeffery A.; Cundari, Thomas R.; Warren, Timothy H. Three-Coordinate Copper(II) Aryls: Key Intermediates in C-O Bond Formation. Journal of the American Chemical Society, 2017, 139, 9112-9115 |
| 4126248 | CIF | C37 H29 Co Cu F11 N2 | P 1 21/c 1 | 11.6396; 25.554; 12.6371 90; 115.688; 90 | 3387.3 | Kundu, Subrata; Greene, Christine; Williams, Kamille D.; Salvador, Tolani K.; Bertke, Jeffery A.; Cundari, Thomas R.; Warren, Timothy H. Three-Coordinate Copper(II) Aryls: Key Intermediates in C-O Bond Formation. Journal of the American Chemical Society, 2017, 139, 9112-9115 |
| 4126266 | CIF | C236 H170 F48 Fe4 N25 O5 S2 Sb7 | P 1 21/n 1 | 33.5373; 36.1722; 50.1922 90; 107.83; 90 | 57965 | Ronson, Tanya K.; Meng, Wenjing; Nitschke, Jonathan R. Design Principles for the Optimization of Guest Binding in Aromatic-Paneled Fe(II)4L6 Cages. Journal of the American Chemical Society, 2017, 139, 9698-9707 |
| 4126267 | CIF | C243 H157.5 F48 Fe4 N31.5 O28 P S14 | R -3 :H | 80.9755; 80.9755; 30.813 90; 90; 120 | 174973 | Ronson, Tanya K.; Meng, Wenjing; Nitschke, Jonathan R. Design Principles for the Optimization of Guest Binding in Aromatic-Paneled Fe(II)4L6 Cages. Journal of the American Chemical Society, 2017, 139, 9698-9707 |
| 4126268 | CIF | C270.67 H204 As4.67 F48 Fe4 N27.33 O13.33 S6.67 | C 1 2/c 1 | 42.055; 16.872; 42.2649 90; 98.284; 90 | 29676 | Ronson, Tanya K.; Meng, Wenjing; Nitschke, Jonathan R. Design Principles for the Optimization of Guest Binding in Aromatic-Paneled Fe(II)4L6 Cages. Journal of the American Chemical Society, 2017, 139, 9698-9707 |
| 4126295 | CIF | C28.25 H34.5 Cl0.5 F12 N4 P2 Sb2 | P 1 21/c 1 | 15.3374; 37.0863; 13.4231 90; 104.892; 90 | 7378.7 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126296 | CIF | C32 H34 Cl D6 F12 N6 P2 Rh Sb2 | P 1 21/c 1 | 17.492; 15.774; 17.985 90; 111.088; 90 | 4630.1 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126297 | CIF | C38 H45 B2 Cl F8 N5 P2 Rh | P 1 21/n 1 | 17.7583; 12.1947; 18.3067 90; 91.115; 90 | 3963.7 | Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes. Journal of the American Chemical Society, 2017, 139, 4948-4953 |
| 4126308 | CIF | C260 H180 As8 F48 Fe4 N28 | I 41/a | 24.8124; 24.8124; 47.889 90; 90; 90 | 29483.1 | Ronson, Tanya K.; Meng, Wenjing; Nitschke, Jonathan R. Design Principles for the Optimization of Guest Binding in Aromatic-Paneled Fe(II)4L6 Cages. Journal of the American Chemical Society, 2017, 139, 9698-9707 |
| 4126321 | CIF | C44 H62 Cl2 N32 O16 | P b c a | 12.281; 20.641; 21.993 90; 90; 90 | 5575.1 | Reany, Ofer; Li, Amanda; Yefet, Maayan; Gilson, Michael K.; Keinan, Ehud Attractive Interactions between Heteroallenes and the Cucurbituril Portal. Journal of the American Chemical Society, 2017, 139, 8138-8145 |
| 4126322 | CIF | C44 H46 Br2 Fe N2 P4 | P 1 21/c 1 | 11.2513; 15.1785; 46.44 90; 96.374; 90 | 7881.9 | Prokopchuk, Demyan E.; Wiedner, Eric S.; Walter, Eric D.; Popescu, Codrina V.; Piro, Nicholas A.; Kassel, W. Scott; Bullock, R. Morris; Mock, Michael T. Catalytic N2 Reduction to Silylamines and Thermodynamics of N2 Binding at Square Planar Fe. Journal of the American Chemical Society, 2017, 139, 9291-9301 |
| 4126323 | CIF | C174 H184 N12 Ni3 O2 | P -1 | 20.499; 22.937; 23.325 74.83; 83.7; 80.25 | 10407 | Fukui, Norihito; Kim, Taeyeon; Kim, Dongho; Osuka, Atsuhiro Porphyrin Arch-Tapes: Synthesis, Contorted Structures, and Full Conjugation. Journal of the American Chemical Society, 2017, 139, 9075-9088 |
| 4126324 | CIF | C17 H16 Br F O3 | P 21 21 21 | 5.7041; 7.4617; 35.703 90; 90; 90 | 1519.6 | van der Mei, Farid W.; Qin, Changming; Morrison, Ryan J.; Hoveyda, Amir H. Practical, Broadly Applicable, α-Selective, Z-Selective, Diastereoselective, and Enantioselective Addition of Allylboron Compounds to Mono-, Di-, Tri-, and Polyfluoroalkyl Ketones. Journal of the American Chemical Society, 2017, 139, 9053-9065 |
| 4126325 | CIF | C102 H130 Co3 N6 Na6 O18 | C 1 2/c 1 | 18.508; 29.695; 18.979 90; 100.017; 90 | 10272 | Andrez, Julie; Guidal, Valentin; Scopelliti, Rosario; Pécaut, Jacques; Gambarelli, Serge; Mazzanti, Marinella Ligand and Metal Based Multielectron Redox Chemistry of Cobalt Supported by Tetradentate Schiff Bases. Journal of the American Chemical Society, 2017, 139, 8628-8638 |
| 4126326 | CIF | C31 H24 N2 O | C 1 2/c 1 | 42.558; 7.4566; 15.434 90; 99.516; 90 | 4830.4 | Zhang, Wen; Chen, Pinhong; Liu, Guosheng Copper-Catalyzed Arylation of Benzylic C-H bonds with Alkylarenes as the Limiting Reagents. Journal of the American Chemical Society, 2017, 139, 7709-7712 |
| 4126355 | CIF | C408 H384 Cl18 N72 Nd8 O120 | R -3 :H | 27.279; 27.279; 84.656 90; 90; 120 | 54556 | Li, Xiao-Zhen; Zhou, Li-Peng; Yan, Liang-Liang; Yuan, Da-Qiang; Lin, Chen-Sheng; Sun, Qing-Fu Evolution of Luminescent Supramolecular Lanthanide M2nL3n Complexes from Helicates and Tetrahedra to Cubes. Journal of the American Chemical Society, 2017, 139, 8237-8244 |
| 4126356 | CIF | C23 H25 N O4 | P 1 21/c 1 | 14.414; 5.522; 28.116 90; 113.245; 90 | 2056.21 | Zhang, Fa-Guang; Marek, Ilan Brook Rearrangement as Trigger for Carbene Generation: Synthesis of Stereodefined and Fully Substituted Cyclobutenes. Journal of the American Chemical Society, 2017, 139, 8364-8370 |
| 4126357 | CIF | C21 H23 Cl2 N3 O3 | P 63 | 19.4525; 19.4525; 11.7848 90; 90; 120 | 3861.92 | Sun, Bo; Balaji, Pandur Venkatesan; Kumagai, Naoya; Shibasaki, Masakatsu α-Halo Amides as Competent Latent Enolates: Direct Catalytic Asymmetric Mannich-Type Reaction. Journal of the American Chemical Society, 2017, 139, 8295-8301 |
| 4126358 | CIF | C21 H30 Cl N3 O3 | P 21 21 21 | 11.3109; 16.8486; 21.942 90; 90; 90 | 4181.55 | Sun, Bo; Balaji, Pandur Venkatesan; Kumagai, Naoya; Shibasaki, Masakatsu α-Halo Amides as Competent Latent Enolates: Direct Catalytic Asymmetric Mannich-Type Reaction. Journal of the American Chemical Society, 2017, 139, 8295-8301 |
| 4126359 | CIF | C62 H80 B2 Fe N10 O8 | P -1 | 14.5285; 14.8368; 14.9997 100.432; 104.367; 92.736 | 3065.79 | Cecot, Giacomo; Marmier, Mathieu; Geremia, Silvano; De Zorzi, Rita; Vologzhanina, Anna V.; Pattison, Philip; Solari, Euro; Fadaei Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay The Intricate Structural Chemistry of M(II)2nLn-Type Assemblies. Journal of the American Chemical Society, 2017, 139, 8371-8381 |
| 4126360 | CIF | C510 H582 B8 F30 Fe4 N42 O54 P16 Pt8 S10 | P -1 | 29.342; 31.461; 42.629 88.248; 70.021; 69.405 | 34440 | Cecot, Giacomo; Marmier, Mathieu; Geremia, Silvano; De Zorzi, Rita; Vologzhanina, Anna V.; Pattison, Philip; Solari, Euro; Fadaei Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay The Intricate Structural Chemistry of M(II)2nLn-Type Assemblies. Journal of the American Chemical Society, 2017, 139, 8371-8381 |
| 4126361 | CIF | C430 H412 B8 F48 Fe4 N40 O72 P16 Pt8 S16 | P 42 n m | 47.92; 47.92; 37.29 90; 90; 90 | 85630 | Cecot, Giacomo; Marmier, Mathieu; Geremia, Silvano; De Zorzi, Rita; Vologzhanina, Anna V.; Pattison, Philip; Solari, Euro; Fadaei Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay The Intricate Structural Chemistry of M(II)2nLn-Type Assemblies. Journal of the American Chemical Society, 2017, 139, 8371-8381 |
| 4126362 | CIF | C144 H142 B4 N21 O18 Zn4 | P -1 | 22.9158; 23.8401; 34.0163 69.7864; 70.5451; 88.877 | 16347.3 | Cecot, Giacomo; Marmier, Mathieu; Geremia, Silvano; De Zorzi, Rita; Vologzhanina, Anna V.; Pattison, Philip; Solari, Euro; Fadaei Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay The Intricate Structural Chemistry of M(II)2nLn-Type Assemblies. Journal of the American Chemical Society, 2017, 139, 8371-8381 |
| 4126363 | CIF | C600 H660 N54 O24 Zn6 | P n -3 n | 39.819; 39.819; 39.819 90; 90; 90 | 63135 | Benke, Bahiru Punja; Aich, Pulakesh; Kim, Younghoon; Kim, Kyung Lock; Rohman, Md Rumum; Hong, Soonsang; Hwang, In-Chul; Lee, Eun Hui; Roh, Joon Ho; Kim, Kimoon Iodide-Selective Synthetic Ion Channels Based on Shape-Persistent Organic Cages. Journal of the American Chemical Society, 2017, 139, 7432-7435 |
| 4126364 | CIF | C43 H64 | P 21 3 | 19.8599; 19.8599; 19.8599 90; 90; 90 | 7833.1 | Rösel, Sören; Quanz, Henrik; Logemann, Christian; Becker, Jonathan; Mossou, Estelle; Cañadillas-Delgado, Laura; Caldeweyher, Eike; Grimme, Stefan; Schreiner, Peter R. London Dispersion Enables the Shortest Intermolecular Hydrocarbon H···H Contact. Journal of the American Chemical Society, 2017, 139, 7428-7431 |
| 4126365 | CIF | C27 H19 Cu F11 N2 | P 1 21/n 1 | 7.6083; 24.5638; 14.4862 90; 102.522; 90 | 2642.91 | Kundu, Subrata; Greene, Christine; Williams, Kamille D.; Salvador, Tolani K.; Bertke, Jeffery A.; Cundari, Thomas R.; Warren, Timothy H. Three-Coordinate Copper(II) Aryls: Key Intermediates in C-O Bond Formation. Journal of the American Chemical Society, 2017, 139, 9112-9115 |
| 4126366 | CIF | C19 H17 N3 O2 | P 1 21/c 1 | 5.96113; 18.7722; 14.4957 90; 100.51; 90 | 1594.9 | Qian, Hai; Pramanik, Susnata; Aprahamian, Ivan Photochromic Hydrazone Switches with Extremely Long Thermal Half-Lives. Journal of the American Chemical Society, 2017, 139, 9140-9143 |
| 4126367 | CIF | C36 H47 Ir P2 | P -1 | 9.9152; 11.9825; 14.1511 92.263; 107.127; 91.127 | 1604.6 | Wilklow-Marnell, Miles; Li, Bo; Zhou, Tian; Krogh-Jespersen, Karsten; Brennessel, William W.; Emge, Thomas J.; Goldman, Alan S.; Jones, William D. Catalytic Dehydrogenative C-C Coupling by a Pincer-Ligated Iridium Complex. Journal of the American Chemical Society, 2017, 139, 8977-8989 |
| 4126368 | CIF | C16 H21 N O4 | P 21 21 21 | 6.0729; 8.3117; 30.5846 90; 90; 90 | 1543.79 | Bartlett, Samuel L.; Sohtome, Yoshihiro; Hashizume, Daisuke; White, Peter S.; Sawamura, Miki; Johnson, Jeffrey S.; Sodeoka, Mikiko Catalytic Enantioselective [3 + 2] Cycloaddition of α-Keto Ester Enolates and Nitrile Oxides. Journal of the American Chemical Society, 2017, 139, 8661-8666 |
| 4126369 | CIF | C33 H42 B F2 N6 O3 | P -1 | 9.011; 10.8873; 17.883 98.641; 90.004; 112.949 | 1593.9 | Wang, Zhijia; Zhao, Jianzhang; Barbon, Antonio; Toffoletti, Antonio; Liu, Yan; An, Yonglin; Xu, Liang; Karatay, Ahmet; Yaglioglu, Halime Gul; Yildiz, Elif Akhüseyin; Hayvali, Mustafa Radical-Enhanced Intersystem Crossing in New Bodipy Derivatives and Application for Efficient Triplet-Triplet Annihilation Upconversion. Journal of the American Chemical Society, 2017, 139, 7831-7842 |
| 4126370 | CIF | C20 H16 F6 N4 O6 S2 Si Zn | I b a m | 10.092; 19.277; 15.171 90; 90; 90 | 2951 | Lin, Rui-Biao; Li, Libo; Wu, Hui; Arman, Hadi; Li, Bin; Lin, Rong-Guang; Zhou, Wei; Chen, Banglin Optimized Separation of Acetylene from Carbon Dioxide and Ethylene in a Microporous Material. Journal of the American Chemical Society, 2017, 139, 8022-8028 |
| 4126371 | CIF | C40 H20 Cu9 N20 O24 Zn6 | I 4/m | 30.22; 30.22; 34.323 90; 90; 90 | 31345 | Tu, Binbin; Pang, Qingqing; Xu, Huoshu; Li, Xiaomin; Wang, Yulin; Ma, Zhen; Weng, Linhong; Li, Qiaowei Reversible Redox Activity in Multicomponent Metal-Organic Frameworks Constructed from Trinuclear Copper Pyrazolate Building Blocks. Journal of the American Chemical Society, 2017, 139, 7998-8007 |
| 4126372 | CIF | C24.19 H16 Cu D2.92 F6 N4 O6 S2 | C 1 2/c 1 | 27.499; 14.9307; 16.565 90; 110.55; 90 | 6368 | Li, Libo; Lin, Rui-Biao; Krishna, Rajamani; Wang, Xiaoqing; Li, Bin; Wu, Hui; Li, Jinping; Zhou, Wei; Chen, Banglin Flexible-Robust Metal-Organic Framework for Efficient Removal of Propyne from Propylene. Journal of the American Chemical Society, 2017, 139, 7733-7736 |
| 4131212 | CIF | C52 H108 Si13 | C 1 2/c 1 | 36.907; 19.699; 20.897 90; 117.035; 90 | 13533 | Kosai, Tomoyuki; Ishida, Shintaro; Iwamoto, Takeaki Pentasila-1,4-diene: Homoconjugation between Si═Si Double Bonds via a SiMe(2) Unit. Journal of the American Chemical Society, 2017, 139, 99-102 |
| 4131213 | CIF | C54 H114 Si14 | P 1 21/a 1 | 9.7545; 24.247; 16.831 90; 96.034; 90 | 3958.8 | Kosai, Tomoyuki; Ishida, Shintaro; Iwamoto, Takeaki Pentasila-1,4-diene: Homoconjugation between Si═Si Double Bonds via a SiMe(2) Unit. Journal of the American Chemical Society, 2017, 139, 99-102 |
| 4131214 | CIF | C28 H60 Si7 | P -1 | 11.439; 11.5269; 16.3097 76.425; 84.285; 61.813 | 1842.4 | Kosai, Tomoyuki; Ishida, Shintaro; Iwamoto, Takeaki Pentasila-1,4-diene: Homoconjugation between Si═Si Double Bonds via a SiMe(2) Unit. Journal of the American Chemical Society, 2017, 139, 99-102 |
| 4131215 | CIF | C35 H76 K O5 Si6 | P 1 21/n 1 | 14.701; 15.065; 22.31 90; 105.87; 90 | 4752.7 | Kosai, Tomoyuki; Ishida, Shintaro; Iwamoto, Takeaki Pentasila-1,4-diene: Homoconjugation between Si═Si Double Bonds via a SiMe(2) Unit. Journal of the American Chemical Society, 2017, 139, 99-102 |
| 4131216 | CIF | C25 H51 Cl3 Si6 | P 1 21/c 1 | 20.2103; 8.9161; 20.7174 90; 99.885; 90 | 3677.8 | Kosai, Tomoyuki; Ishida, Shintaro; Iwamoto, Takeaki Pentasila-1,4-diene: Homoconjugation between Si═Si Double Bonds via a SiMe(2) Unit. Journal of the American Chemical Society, 2017, 139, 99-102 |
| 4131217 | CIF | C85.24 H72.7 Cl4.76 Ir N2 O6.74 P2 | P 21 21 21 | 15.8812; 19.5634; 22.8793 90; 90; 90 | 7108.4 | Rössler, Simon L; Krautwald, Simon; Carreira, Erick M. Study of Intermediates in Iridium-(Phosphoramidite,Olefin)-Catalyzed Enantioselective Allylic Substitution. Journal of the American Chemical Society, 2017, 139, 3603-3606 |
| 4131218 | CIF | C82.15 H62.62 Cl9.53 Ir N2 O5.58 P2 | P 1 21 1 | 11.1166; 22.3594; 15.6267 90; 91.739; 90 | 3882.4 | Rössler, Simon L; Krautwald, Simon; Carreira, Erick M. Study of Intermediates in Iridium-(Phosphoramidite,Olefin)-Catalyzed Enantioselective Allylic Substitution. Journal of the American Chemical Society, 2017, 139, 3603-3606 |
| 4131219 | CIF | C83 H57 Cl16 F3 Ir N3 O9 P2 S | P -1 | 15.7403; 17.473; 18.238 91.892; 108.143; 115.526 | 4218.8 | Rössler, Simon L; Krautwald, Simon; Carreira, Erick M. Study of Intermediates in Iridium-(Phosphoramidite,Olefin)-Catalyzed Enantioselective Allylic Substitution. Journal of the American Chemical Society, 2017, 139, 3603-3606 |
| 4131220 | CIF | C68 H44 Cl Ir N2 O4 P2 | P 21 21 2 | 15.3515; 21.677; 8.8389 90; 90; 90 | 2941.4 | Rössler, Simon L; Krautwald, Simon; Carreira, Erick M. Study of Intermediates in Iridium-(Phosphoramidite,Olefin)-Catalyzed Enantioselective Allylic Substitution. Journal of the American Chemical Society, 2017, 139, 3603-3606 |
| 4131221 | CIF | C224 H164 Cl39 Ir3 N6 O20 P6 | P 32 | 32.9074; 32.9074; 17.7716 90; 90; 120 | 16666.5 | Rössler, Simon L; Krautwald, Simon; Carreira, Erick M. Study of Intermediates in Iridium-(Phosphoramidite,Olefin)-Catalyzed Enantioselective Allylic Substitution. Journal of the American Chemical Society, 2017, 139, 3603-3606 |
| 4131222 | CIF | C34 H22 N O2 P | P 1 21 1 | 12.0233; 7.5855; 13.9981 90; 96.03; 90 | 1269.6 | Rössler, Simon L; Krautwald, Simon; Carreira, Erick M. Study of Intermediates in Iridium-(Phosphoramidite,Olefin)-Catalyzed Enantioselective Allylic Substitution. Journal of the American Chemical Society, 2017, 139, 3603-3606 |
| 4131223 | CIF | C128 H53 I0 N4 Ni O0 S2 Th | C 1 2/m 1 | 27.1225; 17.0996; 17.6908 90; 106.759; 90 | 7856.2 | Wang, Yaofeng; Morales-Martínez, Roser; Zhang, Xingxing; Yang, Wei; Wang, Yaxing; Rodríguez-Fortea, Antonio; Poblet, Josep M.; Feng, Lai; Wang, Shuao; Chen, Ning Unique Four-Electron Metal-to-Cage Charge Transfer of Th to a C<sub>82</sub> Fullerene Cage: Complete Structural Characterization of Th@C<sub>3v</sub>(8)-C<sub>82</sub>. Journal of the American Chemical Society, 2017, 139, 5110-5116 |
| 4131224 | CIF | C47 H76 Cu N4 O4 | P 1 21/n 1 | 11.429; 25.345; 18.453 90; 93.369; 90 | 5336 | Spaeth, Andrew D.; Gagnon, Nicole L.; Dhar, Debanjan; Yee, Gereon M.; Tolman, William B. Determination of the Cu(III)-OH Bond Distance by Resonance Raman Spectroscopy Using a Normalized Version of Badger's Rule. Journal of the American Chemical Society, 2017, 139, 4477-4485 |
| 4131225 | CIF | C42 H41 B F4 N3 O P Pd | P 21 21 21 | 10.938; 13.7755; 24.4883 90; 90; 90 | 3689.81 | Guo, Chang; Janssen-Müller, Daniel; Fleige, Mirco; Lerchen, Andreas; Daniliuc, Constantin G.; Glorius, Frank Mechanistic Studies on a Cooperative NHC Organocatalysis/Palladium Catalysis System: Uncovering Significant Lessons for Mixed Chiral Pd(NHC)(PR<sub>3</sub>) Catalyst Design. Journal of the American Chemical Society, 2017, 139, 4443-4451 |
| 4131226 | CIF | C57 H74 O10 | P 1 21/a 1 | 22.639; 11.4146; 40.733 90; 91.374; 90 | 10523 | Ogoshi, Tomoki; Shimada, Yasuo; Sakata, Yoko; Akine, Shigehisa; Yamagishi, Tada-Aki Alkane-Shape-Selective Vapochromic Behavior Based on Crystal-State Host-Guest Complexation of Pillar[5]arene Containing One Benzoquinone Unit. Journal of the American Chemical Society, 2017, 139, 5664-5667 |
| 4131227 | CIF | C11 H8 Cl3 Fe N O6 | P -3 1 m | 13.5835; 13.5835; 8.6796 90; 90; 120 | 1386.9 | DeGayner, Jordan A.; Jeon, Ie-Rang; Sun, Lei; Dincă, Mircea; Harris, T. David 2D Conductive Iron-Quinoid Magnets Ordering up to T<sub>c</sub> = 105 K via Heterogenous Redox Chemistry. Journal of the American Chemical Society, 2017, 139, 4175-4184 |
| 4131228 | CIF | C28 H24 F3 Mn N4 O8 S2 | P -1 | 8.4555; 12.6145; 14.6274 105.622; 90.044; 100.517 | 1475.26 | G, Upendar Reddy; Axthelm, Jörg; Hoffmann, Patrick; Taye, Nandaraj; Gläser, Steve; Görls, Helmar; Hopkins, Samantha L.; Plass, Winfried; Neugebauer, Ute; Bonnet, Sylvestre; Schiller, Alexander Co-Registered Molecular Logic Gate with a CO-Releasing Molecule Triggered by Light and Peroxide. Journal of the American Chemical Society, 2017, 139, 4991-4994 |
| 4131229 | CIF | C17 H15 F3 Mn N3 O6 S | C 1 c 1 | 18.8866; 11.3425; 11.6682 90; 128.13; 90 | 1966.2 | G, Upendar Reddy; Axthelm, Jörg; Hoffmann, Patrick; Taye, Nandaraj; Gläser, Steve; Görls, Helmar; Hopkins, Samantha L.; Plass, Winfried; Neugebauer, Ute; Bonnet, Sylvestre; Schiller, Alexander Co-Registered Molecular Logic Gate with a CO-Releasing Molecule Triggered by Light and Peroxide. Journal of the American Chemical Society, 2017, 139, 4991-4994 |
| 4131230 | CIF | C42 H30 N4 O | P b c a | 20.5502; 7.9367; 37.7229 90; 90; 90 | 6152.6 | Tsujimoto, Hiroyuki; Ha, Dong-Gwang; Markopoulos, Georgios; Chae, Hyun Sik; Baldo, Marc A.; Swager, Timothy M. Thermally Activated Delayed Fluorescence and Aggregation Induced Emission with Through-Space Charge Transfer. Journal of the American Chemical Society, 2017, 139, 4894-4900 |
| 4131231 | CIF | C39 H42 Mn N3 P2 | P -1 | 10.6382; 17.4039; 18.8993 79.892; 87.553; 77.84 | 3367.5 | Mukhopadhyay, Tufan K.; Rock, Christopher L.; Hong, Mannkyu; Ashley, Daniel C.; Groy, Thomas L.; Baik, Mu-Hyun; Trovitch, Ryan J. Mechanistic Investigation of Bis(imino)pyridine Manganese Catalyzed Carbonyl and Carboxylate Hydrosilylation. Journal of the American Chemical Society, 2017, 139, 4901-4915 |
| 4131232 | CIF | C118 H140 F6 Mn2 N6 O8 P4 | P -1 | 14.5008; 14.7881; 15.1141 92.0219; 115.433; 109.457 | 2698.6 | Mukhopadhyay, Tufan K.; Rock, Christopher L.; Hong, Mannkyu; Ashley, Daniel C.; Groy, Thomas L.; Baik, Mu-Hyun; Trovitch, Ryan J. Mechanistic Investigation of Bis(imino)pyridine Manganese Catalyzed Carbonyl and Carboxylate Hydrosilylation. Journal of the American Chemical Society, 2017, 139, 4901-4915 |
| 4131233 | CIF | C28 H22 Br2 N4 O2.66 S2 | P -1 | 7.5646; 12.0747; 16.7895 106.725; 98.214; 98.25 | 1425.78 | Woodward, Alexis N.; Kolesar, Justin M.; Hall, Sara R.; Saleh, Nemah-Allah; Jones, Daniel S.; Walter, Michael G. Thiazolothiazole Fluorophores Exhibiting Strong Fluorescence and Viologen-Like Reversible Electrochromism. Journal of the American Chemical Society, 2017, 139, 8467-8473 |
| 4131234 | CIF | C12 H12 B Br F N O2 | P 1 21/c 1 | 7.5193; 18.3049; 9.5705 90; 107.611; 90 | 1255.55 | Axthelm, Jörg; Askes, Sven H. C.; Elstner, Martin; G, Upendar Reddy; Görls, Helmar; Bellstedt, Peter; Schiller, Alexander Fluorinated Boronic Acid-Appended Pyridinium Salts and <sup>19</sup>F NMR Spectroscopy for Diol Sensing. Journal of the American Chemical Society, 2017, 139, 11413-11420 |
| 4131235 | CIF | C13 H12 B Br F3 N O2 | P -1 | 6.5845; 7.2237; 15.3914 82.136; 79.133; 89.205 | 712.14 | Axthelm, Jörg; Askes, Sven H. C.; Elstner, Martin; G, Upendar Reddy; Görls, Helmar; Bellstedt, Peter; Schiller, Alexander Fluorinated Boronic Acid-Appended Pyridinium Salts and <sup>19</sup>F NMR Spectroscopy for Diol Sensing. Journal of the American Chemical Society, 2017, 139, 11413-11420 |
| 4131236 | CIF | C12 H12 B Br F N O2 | P 1 21/c 1 | 7.5296; 17.754; 9.5971 90; 103.537; 90 | 1247.3 | Axthelm, Jörg; Askes, Sven H. C.; Elstner, Martin; G, Upendar Reddy; Görls, Helmar; Bellstedt, Peter; Schiller, Alexander Fluorinated Boronic Acid-Appended Pyridinium Salts and <sup>19</sup>F NMR Spectroscopy for Diol Sensing. Journal of the American Chemical Society, 2017, 139, 11413-11420 |
| 4131237 | CIF | C4 H14 Br4 N2 Pb | P b c a | 18.901; 11.782; 23.68 90; 90; 90 | 5273.3 | Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Wasielewski, Michael R.; Kanatzidis, Mercouri G. White-Light Emission and Structural Distortion in New Corrugated Two-Dimensional Lead Bromide Perovskites. Journal of the American Chemical Society, 2017, 139, 5210-5215 |
| 4131238 | CIF | C4 H14 Br4 N2 Pb | P 1 21/c 1 | 17.625; 11.982; 18.724 90; 90.44; 90 | 3954.1 | Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Wasielewski, Michael R.; Kanatzidis, Mercouri G. White-Light Emission and Structural Distortion in New Corrugated Two-Dimensional Lead Bromide Perovskites. Journal of the American Chemical Society, 2017, 139, 5210-5215 |
| 4131239 | CIF | C5 H16 Br4 N2 Pb | P 1 21/c 1 | 10.7169; 11.7355; 12.1266 90; 111.534; 90 | 1418.7 | Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Wasielewski, Michael R.; Kanatzidis, Mercouri G. White-Light Emission and Structural Distortion in New Corrugated Two-Dimensional Lead Bromide Perovskites. Journal of the American Chemical Society, 2017, 139, 5210-5215 |
| 4131240 | CIF | C6 H18 Br4 N2 Pb | A e a 2 | 41.685; 23.962; 12 90; 90; 90 | 11986 | Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Wasielewski, Michael R.; Kanatzidis, Mercouri G. White-Light Emission and Structural Distortion in New Corrugated Two-Dimensional Lead Bromide Perovskites. Journal of the American Chemical Society, 2017, 139, 5210-5215 |
| 4131241 | CIF | C3 H12 Cu3 I3 N6 S3 | P 61 | 12.46018; 12.46018; 19.9836 90; 90; 120 | 2686.91 | Ye, Senyun; Rao, Haixia; Zhao, Ziran; Zhang, Linjuan; Bao, Hongliang; Sun, Weihai; Li, Yunlong; Gu, Feidan; Wang, Jianqiang; Liu, Zhiwei; Bian, Zuqiang; Huang, Chunhui A Breakthrough Efficiency of 19.9% Obtained in Inverted Perovskite Solar Cells by Using an Efficient Trap State Passivator Cu(thiourea)I. Journal of the American Chemical Society, 2017, 139, 7504-7512 |
| 4131242 | CIF | C16.5 H27 Cl O2 | P 1 21 1 | 8.96; 18.1329; 9.739 90; 92.047; 90 | 1581.29 | Hu, Pengfei; Snyder, Scott A. Enantiospecific Total Synthesis of the Highly Strained (-)-Presilphiperfolan-8-ol via a Pd-Catalyzed Tandem Cyclization. Journal of the American Chemical Society, 2017, 139, 5007-5010 |
| 4131243 | CIF | C88.4 H84 Cl0.6 N9 O10 Ru | P -1 | 14.8148; 17.1489; 17.8927 110.132; 91.24; 106.843 | 4047.5 | Kuss-Petermann, Martin; Orazietti, Margherita; Neuburger, Markus; Hamm, Peter; Wenger, Oliver S. Intramolecular Light-Driven Accumulation of Reduction Equivalents by Proton-Coupled Electron Transfer. Journal of the American Chemical Society, 2017, 139, 5225-5232 |
| 4131244 | CIF | Ag Bi Br6 Cs2 | F m -3 m | 11.2322; 11.2322; 11.2322 90; 90; 90 | 1417.08 | Slavney, Adam H.; Leppert, Linn; Bartesaghi, Davide; Gold-Parker, Aryeh; Toney, Michael F.; Savenije, Tom J.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Defect-Induced Band-Edge Reconstruction of a Bismuth-Halide Double Perovskite for Visible-Light Absorption. Journal of the American Chemical Society, 2017, 139, 5015-5018 |
| 4131245 | CIF | C2 H12 Ag0.2 Bi Br6 N2 Tl0.8 | F m -3 m | 11.8941; 11.8941; 11.8941 90; 90; 90 | 1682.65 | Slavney, Adam H.; Leppert, Linn; Bartesaghi, Davide; Gold-Parker, Aryeh; Toney, Michael F.; Savenije, Tom J.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Defect-Induced Band-Edge Reconstruction of a Bismuth-Halide Double Perovskite for Visible-Light Absorption. Journal of the American Chemical Society, 2017, 139, 5015-5018 |
| 4131246 | CIF | C2 H12 Bi Br6 N2 Tl | F m -3 m | 11.9173; 11.9173; 11.9173 90; 90; 90 | 1692.5 | Slavney, Adam H.; Leppert, Linn; Bartesaghi, Davide; Gold-Parker, Aryeh; Toney, Michael F.; Savenije, Tom J.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Defect-Induced Band-Edge Reconstruction of a Bismuth-Halide Double Perovskite for Visible-Light Absorption. Journal of the American Chemical Society, 2017, 139, 5015-5018 |
| 4131247 | CIF | C17 H16 F3 N O | P 1 21 1 | 12.5921; 5.3064; 22.4242 90; 99.002; 90 | 1479.9 | Poremba, Kelsey E.; Kadunce, Nathaniel T.; Suzuki, Naoyuki; Cherney, Alan H.; Reisman, Sarah E. Nickel-Catalyzed Asymmetric Reductive Cross-Coupling To Access 1,1-Diarylalkanes. Journal of the American Chemical Society, 2017, 139, 5684-5687 |
| 4131248 | CIF | C23 H22 B N O2 | P 1 21/n 1 | 9.8642; 12.484; 15.7552 90; 98.445; 90 | 1919.1 | Chapin, Brette M.; Metola, Pedro; Vankayala, Sai Lakshmana; Woodcock, H. Lee; Mooibroek, Tiddo J.; Lynch, Vincent M.; Larkin, Joseph D.; Anslyn, Eric V. Disaggregation is a Mechanism for Emission Turn-On of ortho-Aminomethylphenylboronic Acid-Based Saccharide Sensors. Journal of the American Chemical Society, 2017, 139, 5568-5578 |
| 4131249 | CIF | C72 H62 B2 N2 | P c c n | 17.6869; 17.5134; 17.6063 90; 90; 90 | 5453.7 | Santos, Willy G.; Budkina, Darya S.; Deflon, Victor M.; Tarnovsky, Alexander N.; Cardoso, Daniel R.; Forbes, Malcolm D. E. Photoinduced Charge Shifts and Electron Transfer in Viologen-Tetraphenylborate Complexes: Push-Pull Character of the Exciplex. Journal of the American Chemical Society, 2017, 139, 7681-7684 |
| 4131250 | CIF | C64 H60 B2 N4 | P -1 | 8.9299; 13.6476; 21.9545 89.957; 83.601; 88.427 | 2658 | Santos, Willy G.; Budkina, Darya S.; Deflon, Victor M.; Tarnovsky, Alexander N.; Cardoso, Daniel R.; Forbes, Malcolm D. E. Photoinduced Charge Shifts and Electron Transfer in Viologen-Tetraphenylborate Complexes: Push-Pull Character of the Exciplex. Journal of the American Chemical Society, 2017, 139, 7681-7684 |
| 4131251 | CIF | C18 H22 Cl2 N4 Ni O8 S2 | P 1 21/n 1 | 14.414; 11.965; 32.171 90; 101.231; 90 | 5442 | Hong, Dachao; Tsukakoshi, Yuto; Kotani, Hiroaki; Ishizuka, Tomoya; Kojima, Takahiko Visible-Light-Driven Photocatalytic CO<sub>2</sub> Reduction by a Ni(II) Complex Bearing a Bioinspired Tetradentate Ligand for Selective CO Production. Journal of the American Chemical Society, 2017, 139, 6538-6541 |
| 4131252 | CIF | C36 H28 Cl3 P2 Pd Sb | P 1 21/n 1 | 14.6603; 12.7003; 17.8348 90; 94.2177; 90 | 3311.67 | Sahu, Sumit; Gabbaï, François P Photoreductive Elimination of Chlorine from Antimony in an [SbPd]<sup>VII</sup> Complex. Journal of the American Chemical Society, 2017, 139, 5035-5038 |
| 4131253 | CIF | C36 H28 Cl5 P2 Pd Sb | P 21 21 21 | 13.1833; 14.0387; 18.8114 90; 90; 90 | 3481.5 | Sahu, Sumit; Gabbaï, François P Photoreductive Elimination of Chlorine from Antimony in an [SbPd]<sup>VII</sup> Complex. Journal of the American Chemical Society, 2017, 139, 5035-5038 |
| 4131254 | CIF | C55.32 H68 B F15 Fe N2 P4 | P -1 | 12.6573; 13.9154; 16.418 89.5764; 84.6591; 83.2243 | 2859.04 | Geri, Jacob B.; Shanahan, James P.; Szymczak, Nathaniel K. Testing the Push-Pull Hypothesis: Lewis Acid Augmented N<sub>2</sub> Activation at Iron. Journal of the American Chemical Society, 2017, 139, 5952-5956 |
| 4131255 | CIF | C76 H66 B2 F40 Fe N2 P4 | P n a 21 | 24.2958; 12.25554; 27.26129 90; 90; 90 | 8117.27 | Geri, Jacob B.; Shanahan, James P.; Szymczak, Nathaniel K. Testing the Push-Pull Hypothesis: Lewis Acid Augmented N<sub>2</sub> Activation at Iron. Journal of the American Chemical Society, 2017, 139, 5952-5956 |
| 4131256 | CIF | C65.43 H86.4 B1.6 F19.6 Fe1.6 N6.4 P3.2 | P 1 21/c 1 | 26.3521; 22.42897; 35.7607 90; 90.7535; 90 | 21134.6 | Geri, Jacob B.; Shanahan, James P.; Szymczak, Nathaniel K. Testing the Push-Pull Hypothesis: Lewis Acid Augmented N<sub>2</sub> Activation at Iron. Journal of the American Chemical Society, 2017, 139, 5952-5956 |
| 4131257 | CIF | C108.9 H90 Cu6 F3.3 O2.71 P6.1 S0.9 | P -1 | 15.0213; 25.1312; 28.3846 114.492; 98.338; 92.257 | 9588.9 | Liu, Shuo; Eberhart, Michael S.; Norton, Jack R.; Yin, Xiaodong; Neary, Michelle C.; Paley, Daniel W. Cationic Copper Hydride Clusters Arising from Oxidation of (Ph<sub>3</sub>P)<sub>6</sub>Cu<sub>6</sub>H<sub>6</sub>. Journal of the American Chemical Society, 2017, 139, 7685-7688 |
| 4131258 | CIF | C166 H143 B Cu7 F20 O4 P7 | P 1 21/c 1 | 18.193; 16.401; 46.871 90; 92.094; 90 | 13976 | Liu, Shuo; Eberhart, Michael S.; Norton, Jack R.; Yin, Xiaodong; Neary, Michelle C.; Paley, Daniel W. Cationic Copper Hydride Clusters Arising from Oxidation of (Ph<sub>3</sub>P)<sub>6</sub>Cu<sub>6</sub>H<sub>6</sub>. Journal of the American Chemical Society, 2017, 139, 7685-7688 |
| 4131259 | CIF | C76 H108 Sn2 | P 1 21/c 1 | 14.1168; 15.7553; 17.7494 90; 108.704; 90 | 3739.2 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131260 | CIF | C76 H108 Sn2 | C 1 2/c 1 | 42.812; 12.9077; 27.383 90; 104.88; 90 | 14625 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131261 | CIF | C67 H86 Sn2 | P 1 21/c 1 | 24.2225; 11.8023; 23.2736 90; 117.075; 90 | 5924.3 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131262 | CIF | C84 H112 Sn2 | P -1 | 10.9056; 13.3212; 13.5201 109.129; 100.475; 92.3398 | 1814.1 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131263 | CIF | C105 H148 Sn2 | C 1 2/c 1 | 24.8482; 13.0549; 30.6387 90; 111.726; 90 | 9232.9 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131264 | CIF | C86 H116 Sn2 | P -1 | 12.2343; 12.3376; 13.1415 92.9593; 92.3314; 108.371 | 1876.6 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131265 | CIF | C92 H127.77 O0.23 Sn2 | P -1 | 11.9437; 16.5134; 20.8121 84.9379; 88.9163; 88.8673 | 4087.4 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131266 | CIF | C80 H104 Sn2 | P -1 | 13.467; 13.5435; 20.6086 100.981; 107.806; 96.11 | 3458.3 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131267 | CIF | C69 H88 Sn2 | P 1 21/c 1 | 16.9165; 14.5926; 24.5953 90; 95.711; 90 | 6041.4 | Wang, Shuai; McCrea-Hendrick, Madison L; Weinstein, Cory M.; Caputo, Christine A.; Hoppe, Elke; Fettinger, James C.; Olmstead, Marilyn M.; Power, Philip P. Dynamic Behavior and Isomerization Equilibria of Distannenes Synthesized by Tin Hydride/Olefin Insertions: Characterization of the Elusive Monohydrido Bridged Isomer. Journal of the American Chemical Society, 2017, 139, 6586-6595 |
| 4131268 | CIF | C89 H134 N19 O16.5 S2 | P -1 | 14.6287; 18.6066; 20.5602 82.347; 87.749; 88.425 | 5540.8 | He, Qing; Kelliher, Michael; Bähring, Steffen; Lynch, Vincent M.; Sessler, Jonathan L. A Bis-calix[4]pyrrole Enzyme Mimic That Constrains Two Oxoanions in Close Proximity. Journal of the American Chemical Society, 2017, 139, 7140-7143 |
| 4131269 | CIF | C114 H155 N19 O15 P2 | P 1 21/c 1 | 22.803; 25.336; 20.96 90; 95.773; 90 | 12048 | He, Qing; Kelliher, Michael; Bähring, Steffen; Lynch, Vincent M.; Sessler, Jonathan L. A Bis-calix[4]pyrrole Enzyme Mimic That Constrains Two Oxoanions in Close Proximity. Journal of the American Chemical Society, 2017, 139, 7140-7143 |
| 4131270 | CIF | C98 H134 N18 O28 P4 | P 1 21/n 1 | 15.0606; 18.5209; 20.3176 90; 96.226; 90 | 5633.9 | He, Qing; Kelliher, Michael; Bähring, Steffen; Lynch, Vincent M.; Sessler, Jonathan L. A Bis-calix[4]pyrrole Enzyme Mimic That Constrains Two Oxoanions in Close Proximity. Journal of the American Chemical Society, 2017, 139, 7140-7143 |
| 4131271 | CIF | C40 H0 Cl0.12 N6 O2 | C 1 2/c 1 | 38.954; 6.9664; 24.402 90; 97.187; 90 | 6569.9 | He, Qing; Kelliher, Michael; Bähring, Steffen; Lynch, Vincent M.; Sessler, Jonathan L. A Bis-calix[4]pyrrole Enzyme Mimic That Constrains Two Oxoanions in Close Proximity. Journal of the American Chemical Society, 2017, 139, 7140-7143 |
| 4131272 | CIF | C86.12 H104.18 N20.06 O4.49 | P 1 21/c 1 | 10.2141; 13.2874; 29.0597 90; 92.361; 90 | 3940.6 | He, Qing; Kelliher, Michael; Bähring, Steffen; Lynch, Vincent M.; Sessler, Jonathan L. A Bis-calix[4]pyrrole Enzyme Mimic That Constrains Two Oxoanions in Close Proximity. Journal of the American Chemical Society, 2017, 139, 7140-7143 |
| 4131273 | CIF | C43 H37 Al2 Cl6 N3 O P2 | P 1 21/c 1 | 15.9914; 17.7499; 16.3249 90; 111.526; 90 | 4310.6 | Takaya, Jun; Iwasawa, Nobuharu Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>. Journal of the American Chemical Society, 2017, 139, 6074-6077 |
| 4131274 | CIF | C45 H41 Cl6 Ga2 N3 O1.5 P2 | P 1 a 1 | 16.2505; 18.0456; 16.419 90; 106.315; 90 | 4621 | Takaya, Jun; Iwasawa, Nobuharu Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>. Journal of the American Chemical Society, 2017, 139, 6074-6077 |
| 4131275 | CIF | C43 H37 Cl6 In2 N3 O P2 | P -1 | 10.6347; 15.1587; 16.3064 116.078; 107.927; 91.446 | 2206.5 | Takaya, Jun; Iwasawa, Nobuharu Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>. Journal of the American Chemical Society, 2017, 139, 6074-6077 |
| 4131276 | CIF | C39 H29 Al Cl3 N3 P2 Pd | P 1 2/c 1 | 23.6164; 22.668; 36.3526 90; 104.873; 90 | 18808.9 | Takaya, Jun; Iwasawa, Nobuharu Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>. Journal of the American Chemical Society, 2017, 139, 6074-6077 |
| 4131277 | CIF | C42 H36 Cl3 Ga N4 O P2 Pd | P 1 21/a 1 | 15.6604; 15.4147; 17.6596 90; 100.425; 90 | 4192.7 | Takaya, Jun; Iwasawa, Nobuharu Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>. Journal of the American Chemical Society, 2017, 139, 6074-6077 |
| 4131278 | CIF | C45 H47 Cl3 In N3 O3 P2 Pd S3 | P 1 21/a 1 | 15.37; 18.6633; 17.1449 90; 105.464; 90 | 4740.05 | Takaya, Jun; Iwasawa, Nobuharu Synthesis, Structure, and Catalysis of Palladium Complexes Bearing a Group 13 Metalloligand: Remarkable Effect of an Aluminum-Metalloligand in Hydrosilylation of CO<sub>2</sub>. Journal of the American Chemical Society, 2017, 139, 6074-6077 |
| 4131279 | CIF | C114 H96 F72 N12 O0 P12 | P -1 | 8.2927; 20.973; 22.4 68.639; 81.11; 85.463 | 3583.6 | Das, Gobinda; Skorjanc, Tina; Sharma, Sudhir Kumar; Gándara, Felipe; Lusi, Matteo; Shankar Rao, D. S.; Vimala, Sridurai; Krishna Prasad, Subbarao; Raya, Jesus; Han, Dong Suk; Jagannathan, Ramesh; Olsen, John-Carl; Trabolsi, Ali Viologen-Based Conjugated Covalent Organic Networks via Zincke Reaction. Journal of the American Chemical Society, 2017, 139, 9558-9565 |
| 4131280 | CIF | C112 H202 Al2 Co2 Li2 N8 O12 P6 | P 1 n 1 | 12.3678; 13.938; 36.575 90; 93.498; 90 | 6293.1 | Vollmer, Matthew V.; Xie, Jing; Lu, Connie C. Stable Dihydrogen Complexes of Cobalt(-I) Suggest an Inverse trans-Influence of Lewis Acidic Group 13 Metalloligands. Journal of the American Chemical Society, 2017, 139, 6570-6573 |
| 4131281 | CIF | C110 H180 Co2 Ga2 Li2 N8 O8 P6 | P -1 | 15.7589; 16.9042; 21.5439 83.33; 85.737; 87.113 | 5679.5 | Vollmer, Matthew V.; Xie, Jing; Lu, Connie C. Stable Dihydrogen Complexes of Cobalt(-I) Suggest an Inverse trans-Influence of Lewis Acidic Group 13 Metalloligands. Journal of the American Chemical Society, 2017, 139, 6570-6573 |
| 4131282 | CIF | C58 H94.9 Co In Li N4 O4 P3 | P -1 | 11.409; 12.13; 23.099 98.56; 90.383; 103.728 | 3067.8 | Vollmer, Matthew V.; Xie, Jing; Lu, Connie C. Stable Dihydrogen Complexes of Cobalt(-I) Suggest an Inverse trans-Influence of Lewis Acidic Group 13 Metalloligands. Journal of the American Chemical Society, 2017, 139, 6570-6573 |
| 4131283 | CIF | C95.25 H104.25 B0 Cl8.75 N8 Ni2 O4 Zn | I 1 2/a 1 | 35.3839; 11.1376; 51.7427 90; 95.806; 90 | 20286.8 | Doistau, Benjamin; Benda, Lorien; Cantin, Jean-Louis; Chamoreau, Lise-Marie; Ruiz, Eliseo; Marvaud, Valérie; Hasenknopf, Bernold; Vives, Guillaume Six States Switching of Redox-Active Molecular Tweezers by Three Orthogonal Stimuli. Journal of the American Chemical Society, 2017, 139, 9213-9220 |
| 4131284 | CIF | C54 H56 Br Cl2 N5 Ni O2 | P c a 21 | 41.7129; 7.0905; 17.3156 90; 90; 90 | 5121.35 | Doistau, Benjamin; Benda, Lorien; Cantin, Jean-Louis; Chamoreau, Lise-Marie; Ruiz, Eliseo; Marvaud, Valérie; Hasenknopf, Bernold; Vives, Guillaume Six States Switching of Redox-Active Molecular Tweezers by Three Orthogonal Stimuli. Journal of the American Chemical Society, 2017, 139, 9213-9220 |
| 4131285 | CIF | C34 H30 O | C 1 2/c 1 | 24.623; 15.4246; 15.0059 90; 119.147; 90 | 4977.6 | de Orbe, M. Elena; Amenós, Laura; Kirillova, Mariia S.; Wang, Yahui; López-Carrillo, Verónica; Maseras, Feliu; Echavarren, Antonio M. Cyclobutene vs 1,3-Diene Formation in the Gold-Catalyzed Reaction of Alkynes with Alkenes: The Complete Mechanistic Picture. Journal of the American Chemical Society, 2017, 139, 10302-10311 |
| 4131286 | CIF | C23 H19 N O2 | P 1 21 1 | 7.424; 32.859; 7.7501 90; 103.934; 90 | 1835 | de Orbe, M. Elena; Amenós, Laura; Kirillova, Mariia S.; Wang, Yahui; López-Carrillo, Verónica; Maseras, Feliu; Echavarren, Antonio M. Cyclobutene vs 1,3-Diene Formation in the Gold-Catalyzed Reaction of Alkynes with Alkenes: The Complete Mechanistic Picture. Journal of the American Chemical Society, 2017, 139, 10302-10311 |
| 4131287 | CIF | C33 H28 O | P 1 21/c 1 | 22.2327; 5.5071; 38.99 90; 91.34; 90 | 4772.5 | de Orbe, M. Elena; Amenós, Laura; Kirillova, Mariia S.; Wang, Yahui; López-Carrillo, Verónica; Maseras, Feliu; Echavarren, Antonio M. Cyclobutene vs 1,3-Diene Formation in the Gold-Catalyzed Reaction of Alkynes with Alkenes: The Complete Mechanistic Picture. Journal of the American Chemical Society, 2017, 139, 10302-10311 |
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