Crystallography Open Database
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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 140
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4132315 | CIF | C27 H39 B Mo N6 O2 P | P -1 | 13.5487; 14.7499; 16.1417 109.37; 93.449; 98.756 | 2986.48 | Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198 |
| 4132316 | CIF | C79 H118 B4 Mo4 N24 O8 P2 Si2 | P 1 21/n 1 | 11.9565; 25.378; 16.08 90; 104.783; 90 | 4717.7 | Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198 |
| 4132317 | CIF | C26 H38 B Mo N6 O2 P | P -1 | 13.5471; 14.2491; 16.299 109.005; 95.885; 95.334 | 2932.26 | Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198 |
| 4132318 | CIF | C70 H128 B2 K2 Mo2 N12 O22 Si | P b c a | 18.5406; 24.8594; 19.5832 90; 90; 90 | 9026.1 | Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198 |
| 4132319 | CIF | C100 H160 B2 Mo2 N12 O4 Si10 | P -1 | 13.3366; 16.7705; 26.6283 103.244; 93.358; 93.082 | 5773.5 | Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198 |
| 4132320 | CIF | C12 H12 O | P 1 21 1 | 10.6225; 5.2027; 17.6456 90; 104.888; 90 | 942.46 | Iwasawa, Nobuharu; Watanabe, Shoya; Ario, Akane; Sogo, Hideyuki Re(I)-Catalyzed Hydropropargylation of Silyl Enol Ethers Utilizing Dynamic Interconversion of Vinylidene-Alkenylmetal Intermediates via 1,5-Hydride Transfer. Journal of the American Chemical Society, 2018, 140, 7769-7772 |
| 4132321 | CIF | C13 H14 O | R -3 :H | 23.4971; 23.4971; 10.1419 90; 90; 120 | 4849.3 | Iwasawa, Nobuharu; Watanabe, Shoya; Ario, Akane; Sogo, Hideyuki Re(I)-Catalyzed Hydropropargylation of Silyl Enol Ethers Utilizing Dynamic Interconversion of Vinylidene-Alkenylmetal Intermediates via 1,5-Hydride Transfer. Journal of the American Chemical Society, 2018, 140, 7769-7772 |
| 4132322 | CIF | C31 H48 O5 Si | P -1 | 8.5028; 12.2706; 15.7004 72.017; 79.272; 85.399 | 1530.38 | Iwasawa, Nobuharu; Watanabe, Shoya; Ario, Akane; Sogo, Hideyuki Re(I)-Catalyzed Hydropropargylation of Silyl Enol Ethers Utilizing Dynamic Interconversion of Vinylidene-Alkenylmetal Intermediates via 1,5-Hydride Transfer. Journal of the American Chemical Society, 2018, 140, 7769-7772 |
| 4132323 | CIF | C28 H48 O5 Si | P b c a | 14.502; 16.495; 24.257 90; 90; 90 | 5803 | Iwasawa, Nobuharu; Watanabe, Shoya; Ario, Akane; Sogo, Hideyuki Re(I)-Catalyzed Hydropropargylation of Silyl Enol Ethers Utilizing Dynamic Interconversion of Vinylidene-Alkenylmetal Intermediates via 1,5-Hydride Transfer. Journal of the American Chemical Society, 2018, 140, 7769-7772 |
| 4132324 | CIF | C23 H40 O3 Si | P 21 21 21 | 9.1557; 11.8598; 21.294 90; 90; 90 | 2312.2 | Iwasawa, Nobuharu; Watanabe, Shoya; Ario, Akane; Sogo, Hideyuki Re(I)-Catalyzed Hydropropargylation of Silyl Enol Ethers Utilizing Dynamic Interconversion of Vinylidene-Alkenylmetal Intermediates via 1,5-Hydride Transfer. Journal of the American Chemical Society, 2018, 140, 7769-7772 |
| 4132325 | CIF | C50 H52 Br2 N2 Ni | P 1 21/c 1 | 9.04574; 25.29692; 19.03833 90; 103.191; 90 | 4241.58 | Vaccarello, David N.; O'Connor, Kyle S; Iacono, Pasquale; Rose, Jeffrey M.; Cherian, Anna E.; Coates, Geoffrey W. Synthesis of Semicrystalline Polyolefin Materials: Precision Methyl Branching via Stereoretentive Chain Walking. Journal of the American Chemical Society, 2018, 140, 6208-6211 |
| 4132326 | CIF | C54 H45 F12 N9 P2 Ru | P -1 | 15.2905; 21.2936; 21.9394 73.6996; 77.0624; 79.2781 | 6623.9 | Keisar, Hodaya; de Ruiter, Graham; Velders, Aldrik H.; Milko, Petr; Gulino, Antonino; Evmenenko, Guennadi; Shimon, Linda J. W.; Diskin-Posner, Yael; Lahav, Michal; van der Boom, Milko E. Sorting of Molecular Building Blocks from Solution to Surface. Journal of the American Chemical Society, 2018, 140, 8162-8171 |
| 4132327 | CIF | C78 H72 F12 N9 Os P2 | P 1 21/c 1 | 14.9604; 23.8784; 24.1527 90; 104.537; 90 | 8351.9 | Keisar, Hodaya; de Ruiter, Graham; Velders, Aldrik H.; Milko, Petr; Gulino, Antonino; Evmenenko, Guennadi; Shimon, Linda J. W.; Diskin-Posner, Yael; Lahav, Michal; van der Boom, Milko E. Sorting of Molecular Building Blocks from Solution to Surface. Journal of the American Chemical Society, 2018, 140, 8162-8171 |
| 4132328 | CIF | C54 H45 F12 N9 Os P2 | P -1 | 15.2657; 21.4783; 21.9227 73.534; 76.39; 80.261 | 6659.1 | Keisar, Hodaya; de Ruiter, Graham; Velders, Aldrik H.; Milko, Petr; Gulino, Antonino; Evmenenko, Guennadi; Shimon, Linda J. W.; Diskin-Posner, Yael; Lahav, Michal; van der Boom, Milko E. Sorting of Molecular Building Blocks from Solution to Surface. Journal of the American Chemical Society, 2018, 140, 8162-8171 |
| 4132329 | CIF | C50 H34 N6 O Zn | P 1 | 10.718; 11.09; 11.966 109.125; 106.64; 108.575 | 1146.2 | Bhunia, Sarmistha; Rana, Atanu; Roy, Pronay; Martin, Daniel J.; Pegis, Michael L.; Roy, Bijan; Dey, Abhishek Rational Design of Mononuclear Iron Porphyrins for Facile and Selective 4e<sup>-</sup>/4H<sup>+</sup> O<sub>2</sub> Reduction: Activation of O-O Bond by 2nd Sphere Hydrogen Bonding. Journal of the American Chemical Society, 2018, 140, 9444-9457 |
| 4132330 | CIF | C108 H68 Fe2 N12 O6 | P 1 2/n 1 | 18.382; 11.34; 23.79 90; 111.405; 90 | 4617 | Bhunia, Sarmistha; Rana, Atanu; Roy, Pronay; Martin, Daniel J.; Pegis, Michael L.; Roy, Bijan; Dey, Abhishek Rational Design of Mononuclear Iron Porphyrins for Facile and Selective 4e<sup>-</sup>/4H<sup>+</sup> O<sub>2</sub> Reduction: Activation of O-O Bond by 2nd Sphere Hydrogen Bonding. Journal of the American Chemical Society, 2018, 140, 9444-9457 |
| 4132331 | CIF | C64 H53 N5 O2 Zn | C 1 c 1 | 17.481; 13.53; 21.851 90; 93.37; 90 | 5159 | Bhunia, Sarmistha; Rana, Atanu; Roy, Pronay; Martin, Daniel J.; Pegis, Michael L.; Roy, Bijan; Dey, Abhishek Rational Design of Mononuclear Iron Porphyrins for Facile and Selective 4e<sup>-</sup>/4H<sup>+</sup> O<sub>2</sub> Reduction: Activation of O-O Bond by 2nd Sphere Hydrogen Bonding. Journal of the American Chemical Society, 2018, 140, 9444-9457 |
| 4132333 | CIF | C10 H19 Br O2 | C 1 2 1 | 24.997; 5.1956; 18.1896 90; 104.221; 90 | 2290 | Goh, Shermin S.; Guduguntla, Sureshbabu; Kikuchi, Takashi; Lutz, Martin; Otten, Edwin; Fujita, Makoto; Feringa, Ben L. Desymmetrization of meso-Dibromocycloalkenes through Copper(I)-Catalyzed Asymmetric Allylic Substitution with Organolithium Reagents. Journal of the American Chemical Society, 2018, 140, 7052-7055 |
| 4132335 | CIF | C13 H17 Br O2 | C 1 2 1 | 13.6584; 5.684; 16.1484 90; 109.058; 90 | 1184.95 | Goh, Shermin S.; Guduguntla, Sureshbabu; Kikuchi, Takashi; Lutz, Martin; Otten, Edwin; Fujita, Makoto; Feringa, Ben L. Desymmetrization of meso-Dibromocycloalkenes through Copper(I)-Catalyzed Asymmetric Allylic Substitution with Organolithium Reagents. Journal of the American Chemical Society, 2018, 140, 7052-7055 |
| 4132338 | CIF | C53 H38 N2 O8 S2 Zn2 | C 1 2 1 | 19.9556; 22.8307; 21.9438 90; 91.054; 90 | 9995.9 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132340 | CIF | C63 H40 Br2 N4 O11 Zn2 | P m m m | 11.291; 15.799; 18.292 90; 90; 90 | 3263 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132342 | CIF | C29 H24 N4 O3 | P -1 | 8.9034; 10.004; 15.0137 92.406; 105.717; 113.904 | 1159.22 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132344 | CIF | C38 H32 Br2 N4 O6 | P 1 21/c 1 | 12.9265; 27.1065; 11.5966 90; 105.835; 90 | 3909.2 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132346 | CIF | C82 H56 Br2 N6 O14 Zn2 | P m m m | 11.149; 15.869; 22.608 90; 90; 90 | 3999.9 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132348 | CIF | C19 H16 Br2 N2 O3 | P 1 21/c 1 | 9.3937; 33.5488; 11.4358 90; 92.795; 90 | 3599.7 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132349 | CIF | C50 H44 N6 O7 | P 1 21/c 1 | 15.7656; 22.972; 23.9458 90; 94.083; 90 | 8650.4 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132350 | CIF | C48 H40 N6 O6 | P 1 21/c 1 | 17.2113; 9.6042; 25.5421 90; 109.466; 90 | 3980.8 | Williams, Derek E.; Martin, Corey R.; Dolgopolova, Ekaterina A.; Swifton, Anton; Godfrey, Danielle C.; Ejegbavwo, Otega A.; Pellechia, Perry J.; Smith, Mark D.; Shustova, Natalia B. Flipping the Switch: Fast Photoisomerization in a Confined Environment. Journal of the American Chemical Society, 2018, 140, 7611-7622 |
| 4132351 | CIF | C19 H20 O4 | P 1 21/n 1 | 9.4235; 20.518; 18.322 90; 99.732; 90 | 3491.6 | Xu, Lun; Wang, Chao; Gao, Ziwei; Zhao, Yu-Ming Total Synthesis of (±)-Cephanolides B and C via a Palladium-Catalyzed Cascade Cyclization and Late-Stage sp<sup>3</sup> C-H Bond Oxidation. Journal of the American Chemical Society, 2018, 140, 5653-5658 |
| 4132352 | CIF | C19 H22 O4 | P 1 21/c 1 | 9.4065; 14.5426; 11.1202 90; 91.584; 90 | 1520.6 | Xu, Lun; Wang, Chao; Gao, Ziwei; Zhao, Yu-Ming Total Synthesis of (±)-Cephanolides B and C via a Palladium-Catalyzed Cascade Cyclization and Late-Stage sp<sup>3</sup> C-H Bond Oxidation. Journal of the American Chemical Society, 2018, 140, 5653-5658 |
| 4132353 | CIF | C19 H25 I O3 | P 21 21 21 | 7.5257; 13.677; 17.867 90; 90; 90 | 1839 | Xu, Lun; Wang, Chao; Gao, Ziwei; Zhao, Yu-Ming Total Synthesis of (±)-Cephanolides B and C via a Palladium-Catalyzed Cascade Cyclization and Late-Stage sp<sup>3</sup> C-H Bond Oxidation. Journal of the American Chemical Society, 2018, 140, 5653-5658 |
| 4132354 | CIF | C18 H20 O3 | P 1 21/c 1 | 7.5021; 18.2651; 10.4008 90; 99.019; 90 | 1407.57 | Xu, Lun; Wang, Chao; Gao, Ziwei; Zhao, Yu-Ming Total Synthesis of (±)-Cephanolides B and C via a Palladium-Catalyzed Cascade Cyclization and Late-Stage sp<sup>3</sup> C-H Bond Oxidation. Journal of the American Chemical Society, 2018, 140, 5653-5658 |
| 4132355 | CIF | C19 H20 O4 | P 1 21/c 1 | 14.5021; 7.1154; 16.3667 90; 115.269; 90 | 1527.25 | Xu, Lun; Wang, Chao; Gao, Ziwei; Zhao, Yu-Ming Total Synthesis of (±)-Cephanolides B and C via a Palladium-Catalyzed Cascade Cyclization and Late-Stage sp<sup>3</sup> C-H Bond Oxidation. Journal of the American Chemical Society, 2018, 140, 5653-5658 |
| 4132356 | CIF | C72 H84 N5 O4 Rh | P -1 | 10.43; 11.159; 13.768 93.224; 99.919; 93.288 | 1572.3 | Zhang, Jiajing; Zhang, Wentao; Xu, Minghui; Zhang, Yang; Fu, Xuefeng; Fang, Huayi Production of Formamides from CO and Amines Induced by Porphyrin Rhodium(II) Metalloradical. Journal of the American Chemical Society, 2018, 140, 6656-6660 |
| 4132357 | CIF | C52 H44 N5 O2 Rh | P -1 | 9.813; 11.262; 11.59 62.96; 75.66; 68.08 | 1053.6 | Zhang, Jiajing; Zhang, Wentao; Xu, Minghui; Zhang, Yang; Fu, Xuefeng; Fang, Huayi Production of Formamides from CO and Amines Induced by Porphyrin Rhodium(II) Metalloradical. Journal of the American Chemical Society, 2018, 140, 6656-6660 |
| 4132358 | CIF | C62 H44 N4 | I 41/a :2 | 26.6512; 26.6512; 7.0521 90; 90; 90 | 5009 | di Gregorio, Maria Chiara; Ranjan, Priyadarshi; Houben, Lothar; Shimon, Linda J. W.; Rechav, Katya; Lahav, Michal; van der Boom, Milko E. Metal-Coordination-Induced Fusion Creates Hollow Crystalline Molecular Superstructures. Journal of the American Chemical Society, 2018, 140, 9132-9139 |
| 4132359 | CIF | C15 H15 Br O4 | P 1 21 1 | 8.7786; 8.2454; 10.7228 90; 110.205; 90 | 728.39 | Lee, Ansoo; Betori, Rick C.; Crane, Erika A.; Scheidt, Karl A. An Enantioselective Cross-Dehydrogenative Coupling Catalysis Approach to Substituted Tetrahydropyrans. Journal of the American Chemical Society, 2018, 140, 6212-6216 |
| 4132360 | CIF | C53 H45 F24 N8 P4 S2 | P 1 21 1 | 10.8385; 18.879; 13.905 90; 91.968; 90 | 2843.6 | Roy, Indranil; Bobbala, Sharan; Zhou, Jiawang; Nguyen, Minh T.; Nalluri, Siva Krishna Mohan; Wu, Yilei; Ferris, Daniel P.; Scott, Evan Alexander; Wasielewski, Michael R.; Stoddart, J. Fraser ExTzBox: A Glowing Cyclophane for Live-Cell Imaging. Journal of the American Chemical Society, 2018, 140, 7206-7212 |
| 4132361 | CIF | C16 H25 N5 O7 S | P 1 21 1 | 9.881; 9.166; 11.04 90; 110.96; 90 | 933.7 | Mailyan, Artur K.; Chen, Joanna L.; Li, Weiwei; Keller, Arturo A.; Sternisha, Shawn M.; Miller, Brian G.; Zakarian, Armen Short Total Synthesis of [<sup>15</sup>N<sub>5</sub>]-Cylindrospermopsins from <sup>15</sup>NH<sub>4</sub>Cl Enables Precise Quantification of Freshwater Cyanobacterial Contamination. Journal of the American Chemical Society, 2018, 140, 6027-6032 |
| 4132362 | CIF | C14 H16 F4 | P 1 21/c 1 | 12.9375; 9.6105; 10.1863 90; 97.313; 90 | 1256.22 | Liu, Zhonglin; Chen, He; Lv, Ying; Tan, Xinqiang; Shen, Haigen; Yu, Hai-Zhu; Li, Chaozhong Radical Carbofluorination of Unactivated Alkenes with Fluoride Ions. Journal of the American Chemical Society, 2018, 140, 6169-6175 |
| 4132363 | CIF | C16 H20 Cu F2 N2 O6 | P 1 21/n 1 | 8.509; 15.545; 13.953 90; 103.973; 90 | 1791 | Liu, Zhonglin; Chen, He; Lv, Ying; Tan, Xinqiang; Shen, Haigen; Yu, Hai-Zhu; Li, Chaozhong Radical Carbofluorination of Unactivated Alkenes with Fluoride Ions. Journal of the American Chemical Society, 2018, 140, 6169-6175 |
| 4132364 | CIF | C31 H31 Br O7 | P -1 | 10.3318; 10.4224; 13.6723 78.6657; 75.4327; 75.5399 | 1365.7 | Holmbo, Stephen D.; Pronin, Sergey V. A Concise Approach to Anthraquinone-Xanthone Heterodimers. Journal of the American Chemical Society, 2018, 140, 5065-5068 |
| 4132365 | CIF | C24 H23 F6 O2 | P 21 21 21 | 9.5667; 9.7395; 23.46 90; 90; 90 | 2185.9 | Basnet, Prakash; Dhungana, Roshan K.; Thapa, Surendra; Shrestha, Bijay; Kc, Shekhar; Sears, Jeremiah M.; Giri, Ramesh Ni-Catalyzed Regioselective β,δ-Diarylation of Unactivated Olefins in Ketimines via Ligand-Enabled Contraction of Transient Nickellacycles: Rapid Access to Remotely Diarylated Ketones. Journal of the American Chemical Society, 2018, 140, 7782-7786 |
| 4132366 | CIF | C24 H18 O3 S | P 21 21 21 | 10.0521; 12.6929; 15.0985 90; 90; 90 | 1926.42 | Jia, Shiqi; Chen, Zhili; Zhang, Nan; Tan, Yu; Liu, Yidong; Deng, Jun; Yan, Hailong Organocatalytic Enantioselective Construction of Axially Chiral Sulfone-Containing Styrenes. Journal of the American Chemical Society, 2018, 140, 7056-7060 |
| 4132367 | CIF | C16 H16 O2 | P b c a | 10.3789; 8.0553; 29.9399 90; 90; 90 | 2503.13 | James, Michael J.; Schwarz, Jonas Luca; Strieth-Kalthoff, Felix; Wibbeling, Birgit; Glorius, Frank Dearomative Cascade Photocatalysis: Divergent Synthesis through Catalyst Selective Energy Transfer. Journal of the American Chemical Society, 2018, 140, 8624-8628 |
| 4132368 | CIF | C16 H16 O2 | P b c a | 10.1733; 9.2676; 26.9341 90; 90; 90 | 2539.4 | James, Michael J.; Schwarz, Jonas Luca; Strieth-Kalthoff, Felix; Wibbeling, Birgit; Glorius, Frank Dearomative Cascade Photocatalysis: Divergent Synthesis through Catalyst Selective Energy Transfer. Journal of the American Chemical Society, 2018, 140, 8624-8628 |
| 4132369 | CIF | C10 H12 N4 O2 | P 1 21/c 1 | 9.8903; 4.6929; 11.8569 90; 96.707; 90 | 546.56 | Liu, Guofeng; Sheng, Jianhui; Wu, Hongwei; Yang, Chaolong; Yang, Guangbao; Li, Yongxin; Ganguly, Rakesh; Zhu, Liangliang; Zhao, Yanli Controlling Supramolecular Chirality of Two-Component Hydrogels by J- and H-Aggregation of Building Blocks. Journal of the American Chemical Society, 2018, 140, 6467-6473 |
| 4132370 | CIF | C10 H8 N2 S2 | C 2 2 21 | 6.51; 8.6267; 17.3423 90; 90; 90 | 973.94 | Liu, Guofeng; Sheng, Jianhui; Wu, Hongwei; Yang, Chaolong; Yang, Guangbao; Li, Yongxin; Ganguly, Rakesh; Zhu, Liangliang; Zhao, Yanli Controlling Supramolecular Chirality of Two-Component Hydrogels by J- and H-Aggregation of Building Blocks. Journal of the American Chemical Society, 2018, 140, 6467-6473 |
| 4132371 | CIF | C110 H162 Cl8 N2 O24 | P 1 21/n 1 | 18.85077; 15.97613; 38.4073 90; 95.6287; 90 | 11511.1 | Fielden, Stephen D. P.; Leigh, David A.; McTernan, Charlie T.; Pérez-Saavedra, Borja; Vitorica-Yrezabal, Iñigo J Spontaneous Assembly of Rotaxanes from a Primary Amine, Crown Ether and Electrophile. Journal of the American Chemical Society, 2018, 140, 6049-6052 |
| 4132372 | CIF | C46 H84 Cl N O10 | P 1 21/n 1 | 15.2276; 16.08441; 20.7588 90; 106.576; 90 | 4873.11 | Fielden, Stephen D. P.; Leigh, David A.; McTernan, Charlie T.; Pérez-Saavedra, Borja; Vitorica-Yrezabal, Iñigo J Spontaneous Assembly of Rotaxanes from a Primary Amine, Crown Ether and Electrophile. Journal of the American Chemical Society, 2018, 140, 6049-6052 |
| 4132373 | CIF | C24 H52 B Cl Li2 O2 Si4 | P 1 21/c 1 | 9.2197; 20.178; 18.246 90; 103.57; 90 | 3299.6 | Lee, Vladimir Ya; Sugasawa, Haruka; Gapurenko, Olga A.; Minyaev, Ruslan M.; Minkin, Vladimir I.; Gornitzka, Heinz; Sekiguchi, Akira From Borapyramidane to Borole Dianion. Journal of the American Chemical Society, 2018, 140, 6053-6056 |
| 4132374 | CIF | C16 H36 B Cl Si4 | P n m a | 11.9337; 17.0324; 11.6249 90; 90; 90 | 2362.9 | Lee, Vladimir Ya; Sugasawa, Haruka; Gapurenko, Olga A.; Minyaev, Ruslan M.; Minkin, Vladimir I.; Gornitzka, Heinz; Sekiguchi, Akira From Borapyramidane to Borole Dianion. Journal of the American Chemical Society, 2018, 140, 6053-6056 |
| 4132375 | CIF | C20 H19 N O4 | P 1 21 1 | 10.4618; 6.6429; 12.8407 90; 112.484; 90 | 824.55 | Shen, Peng-Xiang; Hu, Liang; Shao, Qian; Hong, Kai; Yu, Jin-Quan Pd(II)-Catalyzed Enantioselective C(sp<sup>3</sup>)-H Arylation of Free Carboxylic Acids. Journal of the American Chemical Society, 2018, 140, 6545-6549 |
| 4132376 | CIF | C22 H24 N4 O4 | P -1 | 8.7271; 13.977; 16.68 92.757; 98.833; 91.076 | 2007.4 | Wang, Chengpeng; Dong, Guangbin Direct β-Alkylation of Ketones and Aldehydes via Pd-Catalyzed Redox Cascade. Journal of the American Chemical Society, 2018, 140, 6057-6061 |
| 4132377 | CIF | C26 H30 Fe O2 | P -1 | 13.6378; 13.6481; 19.0182 93.601; 102.19; 111.741 | 3174.9 | Wang, Chengpeng; Dong, Guangbin Direct β-Alkylation of Ketones and Aldehydes via Pd-Catalyzed Redox Cascade. Journal of the American Chemical Society, 2018, 140, 6057-6061 |
| 4132378 | CIF | C164 H150.76 N10 O12 | P -1 | 16.4092; 16.4773; 28.5237 92.704; 92.421; 107.771 | 7323 | Schuster, Nathaniel J.; Hernández Sánchez, Raúl; Bukharina, Daria; Kotov, Nicholas A.; Berova, Nina; Ng, Fay; Steigerwald, Michael L.; Nuckolls, Colin A Helicene Nanoribbon with Greatly Amplified Chirality. Journal of the American Chemical Society, 2018, 140, 6235-6239 |
| 4132379 | CIF | C31 H31 Br N Ni O2 P | P 1 21 1 | 8.2162; 18.1432; 9.8241 90; 110.383; 90 | 1372.76 | Tenneti, Srinivasarao; Biswas, Souvagya; Cox, Glen Adam; Mans, Daniel J.; Lim, Hwan Jung; RajanBabu, T. V. Broadly Applicable Stereoselective Syntheses of Serrulatane, Amphilectane Diterpenes, and Their Diastereoisomeric Congeners Using Asymmetric Hydrovinylation for Absolute Stereochemical Control. Journal of the American Chemical Society, 2018, 140, 9868-9881 |
| 4132380 | CIF | C22 H33 N2 P | C 1 2/c 1 | 22.0032; 8.3103; 22.7142 90; 90.349; 90 | 4153.3 | Borah, Arun Jyoti; Shi, Zhuangzhi Rhodium-Catalyzed, Remote Terminal Hydroarylation of Activated Olefins through a Long-Range Deconjugative Isomerization. Journal of the American Chemical Society, 2018, 140, 6062-6066 |
| 4132381 | CIF | C31 H34 N2 O2 | C 1 2 1 | 33.63; 7.9364; 20.078 90; 115.091; 90 | 4853.2 | Wang, Chengdong; Xiao, Guanlin; Guo, Tao; Ding, Yalan; Wu, Xiaojin; Loh, Teck-Peng Palladium-Catalyzed Regiocontrollable Reductive Heck Reaction of Unactivated Aliphatic Alkenes. Journal of the American Chemical Society, 2018, 140, 9332-9336 |
| 4132382 | CIF | C20 H17 N3 O | C 1 2/c 1 | 23.384; 4.7955; 29.08 90; 94.542; 90 | 3250.7 | Wang, Chengdong; Xiao, Guanlin; Guo, Tao; Ding, Yalan; Wu, Xiaojin; Loh, Teck-Peng Palladium-Catalyzed Regiocontrollable Reductive Heck Reaction of Unactivated Aliphatic Alkenes. Journal of the American Chemical Society, 2018, 140, 9332-9336 |
| 4132383 | CIF | C21 H20 N2 O | P b c a | 13.6466; 9.3168; 27.5704 90; 90; 90 | 3505.37 | Wang, Chengdong; Xiao, Guanlin; Guo, Tao; Ding, Yalan; Wu, Xiaojin; Loh, Teck-Peng Palladium-Catalyzed Regiocontrollable Reductive Heck Reaction of Unactivated Aliphatic Alkenes. Journal of the American Chemical Society, 2018, 140, 9332-9336 |
| 4132384 | CIF | C21 H20 N2 O | I 41/a :2 | 19.5302; 19.5302; 18.7188 90; 90; 90 | 7139.9 | Wang, Chengdong; Xiao, Guanlin; Guo, Tao; Ding, Yalan; Wu, Xiaojin; Loh, Teck-Peng Palladium-Catalyzed Regiocontrollable Reductive Heck Reaction of Unactivated Aliphatic Alkenes. Journal of the American Chemical Society, 2018, 140, 9332-9336 |
| 4132385 | CIF | C19 H6 B F11 | P 1 21/n 1 | 10.34417; 16.5497; 21.0086 90; 105.661; 90 | 3463.01 | Hoshimoto, Yoichi; Kinoshita, Takuya; Hazra, Sunit; Ohashi, Masato; Ogoshi, Sensuke Main-Group-Catalyzed Reductive Alkylation of Multiply Substituted Amines with Aldehydes Using H<sub>2</sub>. Journal of the American Chemical Society, 2018, 140, 7292-7300 |
| 4132386 | CIF | C19 H17 N3 O3 | P -1 | 8.1093; 12.3368; 16.6982 86.58; 77.534; 86.696 | 1626.53 | Hoshimoto, Yoichi; Kinoshita, Takuya; Hazra, Sunit; Ohashi, Masato; Ogoshi, Sensuke Main-Group-Catalyzed Reductive Alkylation of Multiply Substituted Amines with Aldehydes Using H<sub>2</sub>. Journal of the American Chemical Society, 2018, 140, 7292-7300 |
| 4132387 | CIF | C15 H11 N O3 | P 1 21/c 1 | 22.6526; 7.9132; 6.8187 90; 93.51; 90 | 1219.99 | Hoshimoto, Yoichi; Kinoshita, Takuya; Hazra, Sunit; Ohashi, Masato; Ogoshi, Sensuke Main-Group-Catalyzed Reductive Alkylation of Multiply Substituted Amines with Aldehydes Using H<sub>2</sub>. Journal of the American Chemical Society, 2018, 140, 7292-7300 |
| 4132388 | CIF | C16 H11 N O5 | C 1 2/c 1 | 13.6723; 7.88868; 24.841 90; 90.7992; 90 | 2679 | Hoshimoto, Yoichi; Kinoshita, Takuya; Hazra, Sunit; Ohashi, Masato; Ogoshi, Sensuke Main-Group-Catalyzed Reductive Alkylation of Multiply Substituted Amines with Aldehydes Using H<sub>2</sub>. Journal of the American Chemical Society, 2018, 140, 7292-7300 |
| 4132389 | CIF | C15 H13 N O4 | P -1 | 7.711; 10.52; 10.5887 64.76; 79.688; 86.397 | 764.31 | Hoshimoto, Yoichi; Kinoshita, Takuya; Hazra, Sunit; Ohashi, Masato; Ogoshi, Sensuke Main-Group-Catalyzed Reductive Alkylation of Multiply Substituted Amines with Aldehydes Using H<sub>2</sub>. Journal of the American Chemical Society, 2018, 140, 7292-7300 |
| 4132390 | CIF | C19 H20 O6 | P 21 21 21 | 7.082; 10.1905; 22.8339 90; 90; 90 | 1647.9 | Chen, Gen-Qiang; Lin, Bi-Jin; Huang, Jia-Ming; Zhao, Ling-Yu; Chen, Qi-Shu; Jia, Shi-Peng; Yin, Qin; Zhang, Xumu Design and Synthesis of Chiral oxa-Spirocyclic Ligands for Ir-Catalyzed Direct Asymmetric Reduction of Bringmann's Lactones with Molecular H<sub>2</sub>. Journal of the American Chemical Society, 2018, 140, 8064-8068 |
| 4132391 | CIF | C44 H36 I4 N2 O2 Pb | P 1 21/c 1 | 26.2885; 8.8634; 8.7105 90; 94.287; 90 | 2023.92 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132392 | CIF | C56 H70 I8 N4 O6 Pb2 | P -1 | 12.4181; 12.5652; 23.8888 101.096; 104.074; 90.7065 | 3541.18 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132393 | CIF | C26 H32 I4 N2 O2 Pb | P 1 21/c 1 | 23.0465; 8.8619; 8.2792 90; 95.2834; 90 | 1683.72 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132394 | CIF | C38 H36 I4 N2 O2 Pb | C 1 c 1 | 49.3776; 8.489; 9.448 90; 94.9453; 90 | 3945.54 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132395 | CIF | C36 H32 I4 N2 O2 Pb | C 1 c 1 | 12.4275; 12.4001; 48.36 90; 95.8609; 90 | 7413.4 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132396 | CIF | C48 H56 I8 N4 O4 Pb2 | C 1 c 1 | 12.5228; 12.4668; 39.555 90; 97.668; 90 | 6120.1 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132397 | CIF | C40 H40 I4 N2 O2 Pb | C 1 2/c 1 | 53.3048; 6.1727; 12.5651 90; 90.318; 90 | 4134.3 | Passarelli, James V.; Fairfield, Daniel J.; Sather, Nicholas A.; Hendricks, Mark P.; Sai, Hiroaki; Stern, Charlotte L.; Stupp, Samuel I. Enhanced Out-of-Plane Conductivity and Photovoltaic Performance in n = 1 Layered Perovskites through Organic Cation Design. Journal of the American Chemical Society, 2018, 140, 7313-7323 |
| 4132398 | CIF | C48 H48 B4 F16 Fe12 N72 | F d -3 m :2 | 16.45; 16.45; 16.45 90; 90; 90 | 4451.41 | Park, Jesse G.; Aubrey, Michael L.; Oktawiec, Julia; Chakarawet, Khetpakorn; Darago, Lucy E.; Grandjean, Fernande; Long, Gary J.; Long, Jeffrey R. Charge Delocalization and Bulk Electronic Conductivity in the Mixed-Valence Metal-Organic Framework Fe(1,2,3-triazolate)<sub>2</sub>(BF<sub>4</sub>) <sub>x</sub>. Journal of the American Chemical Society, 2018, 140, 8526-8534 |
| 4132399 | CIF | C48 H48 Fe12 N72 | F d -3 m :2 | 16.65075; 16.65075; 16.65075 90; 90; 90 | 4616.38 | Park, Jesse G.; Aubrey, Michael L.; Oktawiec, Julia; Chakarawet, Khetpakorn; Darago, Lucy E.; Grandjean, Fernande; Long, Gary J.; Long, Jeffrey R. Charge Delocalization and Bulk Electronic Conductivity in the Mixed-Valence Metal-Organic Framework Fe(1,2,3-triazolate)<sub>2</sub>(BF<sub>4</sub>) <sub>x</sub>. Journal of the American Chemical Society, 2018, 140, 8526-8534 |
| 4132400 | CIF | C48 H48 B4 F16 Fe12 N72 | F d -3 m :2 | 16.4794; 16.4794; 16.4794 90; 90; 90 | 4475.32 | Park, Jesse G.; Aubrey, Michael L.; Oktawiec, Julia; Chakarawet, Khetpakorn; Darago, Lucy E.; Grandjean, Fernande; Long, Gary J.; Long, Jeffrey R. Charge Delocalization and Bulk Electronic Conductivity in the Mixed-Valence Metal-Organic Framework Fe(1,2,3-triazolate)<sub>2</sub>(BF<sub>4</sub>) <sub>x</sub>. Journal of the American Chemical Society, 2018, 140, 8526-8534 |
| 4132401 | CIF | C13 H10 N2 O2 | P -1 | 8.6821; 9.2577; 14.8443 71.884; 76.084; 79.136 | 1092.31 | Gao, De-Wei; Vinogradova, Ekaterina V.; Nimmagadda, Sri Krishna; Medina, Jose M.; Xiao, Yiyang; Suciu, Radu M.; Cravatt, Benjamin F.; Engle, Keary M. Direct Access to Versatile Electrophiles via Catalytic Oxidative Cyanation of Alkenes. Journal of the American Chemical Society, 2018, 140, 8069-8073 |
| 4132402 | CIF | C20 H19 N3 O4 | P -1 | 9.8385; 10.1022; 10.6601 65.532; 69.193; 82.563 | 901.27 | Gao, De-Wei; Vinogradova, Ekaterina V.; Nimmagadda, Sri Krishna; Medina, Jose M.; Xiao, Yiyang; Suciu, Radu M.; Cravatt, Benjamin F.; Engle, Keary M. Direct Access to Versatile Electrophiles via Catalytic Oxidative Cyanation of Alkenes. Journal of the American Chemical Society, 2018, 140, 8069-8073 |
| 4132403 | CIF | C84 H60 Cl4 N4 | P -1 | 9.2425; 12.1233; 14.1393 100.537; 95.652; 91.759 | 1548.09 | Ajayakumar, M. R.; Fu, Yubin; Ma, Ji; Hennersdorf, Felix; Komber, Hartmut; Weigand, Jan J.; Alfonsov, Alexey; Popov, Alexey A.; Berger, Reinhard; Liu, Junzhi; Müllen, Klaus; Feng, Xinliang Toward Full Zigzag-Edged Nanographenes: peri-Tetracene and Its Corresponding Circumanthracene. Journal of the American Chemical Society, 2018, 140, 6240-6244 |
| 4132404 | CIF | C55 H42 Cl2 I2 | P -1 | 11.7244; 12.9417; 14.3009 83.817; 87.738; 85.372 | 2149.23 | Ajayakumar, M. R.; Fu, Yubin; Ma, Ji; Hennersdorf, Felix; Komber, Hartmut; Weigand, Jan J.; Alfonsov, Alexey; Popov, Alexey A.; Berger, Reinhard; Liu, Junzhi; Müllen, Klaus; Feng, Xinliang Toward Full Zigzag-Edged Nanographenes: peri-Tetracene and Its Corresponding Circumanthracene. Journal of the American Chemical Society, 2018, 140, 6240-6244 |
| 4132405 | CIF | C77 H65 Cl6 | P -1 | 13.7112; 15.3522; 16.2553 108.701; 107.29; 101.419 | 2927.37 | Ajayakumar, M. R.; Fu, Yubin; Ma, Ji; Hennersdorf, Felix; Komber, Hartmut; Weigand, Jan J.; Alfonsov, Alexey; Popov, Alexey A.; Berger, Reinhard; Liu, Junzhi; Müllen, Klaus; Feng, Xinliang Toward Full Zigzag-Edged Nanographenes: peri-Tetracene and Its Corresponding Circumanthracene. Journal of the American Chemical Society, 2018, 140, 6240-6244 |
| 4132406 | CIF | C8 H6 Au N2 S8 | P 1 21/c 1 | 13.8261; 3.7274; 14.4026 90; 103.628; 90 | 721.35 | Le Gal, Yann; Roisnel, Thierry; Auban-Senzier, Pascale; Bellec, Nathalie; Íñiguez, Jorge; Canadell, Enric; Lorcy, Dominique Stable Metallic State of a Neutral-Radical Single-Component Conductor at Ambient Pressure. Journal of the American Chemical Society, 2018, 140, 6998-7004 |
| 4132407 | CIF | C16 H26 Au N3 S8 | C 1 c 1 | 22.294; 6.3477; 18.974 90; 111.118; 90 | 2504.8 | Le Gal, Yann; Roisnel, Thierry; Auban-Senzier, Pascale; Bellec, Nathalie; Íñiguez, Jorge; Canadell, Enric; Lorcy, Dominique Stable Metallic State of a Neutral-Radical Single-Component Conductor at Ambient Pressure. Journal of the American Chemical Society, 2018, 140, 6998-7004 |
| 4132408 | CIF | C92 H78 B8 F32 Fe4 N34 | C 1 2/c 1 | 17.479; 36.198; 18.614 90; 108.768; 90 | 11151 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132409 | CIF | C88 H84 B4 F16 N32 O8 Zn4 | P 4/n c c :2 | 21.6393; 21.6393; 21.1688 90; 90; 90 | 9912.5 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132410 | CIF | C104 H94 B6 F24 Fe4 N40 | P 1 21/c 1 | 26.4577; 17.6215; 27.3241 90; 116.132; 90 | 11437 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132411 | CIF | C112 H104 B4 F16 Fe4 N44 | P 1 21/c 1 | 17.5399; 25.9317; 28.7826 90; 116.955; 90 | 11669.2 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132412 | CIF | C94 H81 B8 F32 N35 Zn4 | P 1 21/c 1 | 19.5838; 35.646; 18.5501 90; 110.798; 90 | 12105.7 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132413 | CIF | C100 H90 B8 F32 Fe4 N38 | C 1 2/c 1 | 20.0311; 35.23; 18.0924 90; 111.188; 90 | 11904.6 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132414 | CIF | C104 H94 B6 F24 Fe4 N40 | P 1 21/c 1 | 26.948; 17.7359; 27.532 90; 115.376; 90 | 11889.2 | Dhers, Sébastien; Mondal, Abhishake; Aguilà, David; Ramírez, Juan; Vela, Sergi; Dechambenoit, Pierre; Rouzières, Mathieu; Nitschke, Jonathan R.; Clérac, Rodolphe; Lehn, Jean-Marie Spin State Chemistry: Modulation of Ligand p K<sub>a</sub> by Spin State Switching in a [2×2] Iron(II) Grid-Type Complex. Journal of the American Chemical Society, 2018, 140, 8218-8227 |
| 4132415 | CIF | C62.5 H138 Cl3.5 N5.5 P6 Re3 | P 1 21/c 1 | 12.4165; 33.602; 19.7243 90; 101.313; 90 | 8069.5 | Lindley, Brian M.; van Alten, Richt S.; Finger, Markus; Schendzielorz, Florian; Würtele, Christian; Miller, Alexander J. M.; Siewert, Inke; Schneider, Sven Mechanism of Chemical and Electrochemical N<sub>2</sub> Splitting by a Rhenium Pincer Complex. Journal of the American Chemical Society, 2018, 140, 7922-7935 |
| 4132416 | CIF | C28 H31 N O4 S | P 1 21 1 | 10.3008; 11.0103; 11.3288 90; 91.595; 90 | 1284.36 | Qi, Xiaoxu; Chen, Chaohuang; Hou, Chuanqi; Fu, Liang; Chen, Pinhong; Liu, Guosheng Enantioselective Pd(II)-Catalyzed Intramolecular Oxidative 6- endo Aminoacetoxylation of Unactivated Alkenes. Journal of the American Chemical Society, 2018, 140, 7415-7419 |
| 4132417 | CIF | C17 H23 N O5 S | P 21 21 21 | 5.6586; 12.5761; 25.22 90; 90; 90 | 1794.73 | Qi, Xiaoxu; Chen, Chaohuang; Hou, Chuanqi; Fu, Liang; Chen, Pinhong; Liu, Guosheng Enantioselective Pd(II)-Catalyzed Intramolecular Oxidative 6- endo Aminoacetoxylation of Unactivated Alkenes. Journal of the American Chemical Society, 2018, 140, 7415-7419 |
| 4132418 | CIF | C16 H21 N O4 S | P 21 21 21 | 8.385; 12.444; 16.636 90; 90; 90 | 1735.8 | Qi, Xiaoxu; Chen, Chaohuang; Hou, Chuanqi; Fu, Liang; Chen, Pinhong; Liu, Guosheng Enantioselective Pd(II)-Catalyzed Intramolecular Oxidative 6- endo Aminoacetoxylation of Unactivated Alkenes. Journal of the American Chemical Society, 2018, 140, 7415-7419 |
| 4132419 | CIF | C27 H22 Cl2 N2 O Pd | P 65 | 20.913; 20.913; 10.05 90; 90; 120 | 3806.5 | Qi, Xiaoxu; Chen, Chaohuang; Hou, Chuanqi; Fu, Liang; Chen, Pinhong; Liu, Guosheng Enantioselective Pd(II)-Catalyzed Intramolecular Oxidative 6- endo Aminoacetoxylation of Unactivated Alkenes. Journal of the American Chemical Society, 2018, 140, 7415-7419 |
| 4132420 | CIF | C64.77 H76.77 Cl2.31 Si4 | P -1 | 12.3113; 17.1071; 17.4051 95.068; 109.078; 109.676 | 3180 | Yamakado, Takuya; Otsubo, Kazuya; Osuka, Atsuhiro; Saito, Shohei Compression of a Flapping Mechanophore Accompanied by Thermal Void Collapse in a Crystalline Phase. Journal of the American Chemical Society, 2018, 140, 6245-6248 |
| 4132421 | CIF | C76 H100 Si4 | P -1 | 20.8371; 21.9323; 22.9286 88.53; 84.69; 89.064 | 10429.1 | Yamakado, Takuya; Otsubo, Kazuya; Osuka, Atsuhiro; Saito, Shohei Compression of a Flapping Mechanophore Accompanied by Thermal Void Collapse in a Crystalline Phase. Journal of the American Chemical Society, 2018, 140, 6245-6248 |
| 4132422 | CIF | C153.55 H203.1 Cl3.1 Si8 | P 1 21/c 1 | 14.0525; 33.864; 30.643 90; 90.53; 90 | 14582 | Yamakado, Takuya; Otsubo, Kazuya; Osuka, Atsuhiro; Saito, Shohei Compression of a Flapping Mechanophore Accompanied by Thermal Void Collapse in a Crystalline Phase. Journal of the American Chemical Society, 2018, 140, 6245-6248 |
| 4132423 | CIF | C64 H76 Si4 | P -1 | 17.765; 19.556; 34.096 91.567; 102.628; 94.744 | 11507 | Yamakado, Takuya; Otsubo, Kazuya; Osuka, Atsuhiro; Saito, Shohei Compression of a Flapping Mechanophore Accompanied by Thermal Void Collapse in a Crystalline Phase. Journal of the American Chemical Society, 2018, 140, 6245-6248 |
| 4132424 | CIF | C52.3 H52.6 Cl0.6 Si4 | P -1 | 9.7656; 16.3229; 16.4044 106.021; 92.4568; 96.7633 | 2488.1 | Yamakado, Takuya; Otsubo, Kazuya; Osuka, Atsuhiro; Saito, Shohei Compression of a Flapping Mechanophore Accompanied by Thermal Void Collapse in a Crystalline Phase. Journal of the American Chemical Society, 2018, 140, 6245-6248 |
| 4132425 | CIF | C76 H100 Si4 | P 1 21/c 1 | 28.0973; 34.31; 30.1231 90; 90.564; 90 | 29038 | Yamakado, Takuya; Otsubo, Kazuya; Osuka, Atsuhiro; Saito, Shohei Compression of a Flapping Mechanophore Accompanied by Thermal Void Collapse in a Crystalline Phase. Journal of the American Chemical Society, 2018, 140, 6245-6248 |
| 4132426 | CIF | C11 H16 N6 O6 | P -1 | 7.076; 9.231; 12.242 95.341; 105.299; 97.97 | 756.8 | Bian, Lifang; Shi, Huifang; Wang, Xuan; Ling, Kun; Ma, Huili; Li, Mengping; Cheng, Zhichao; Ma, Chaoqun; Cai, Suzhi; Wu, Qi; Gan, Nan; Xu, Xiangfei; An, Zhongfu; Huang, Wei Simultaneously Enhancing Efficiency and Lifetime of Ultralong Organic Phosphorescence Materials by Molecular Self-Assembly. Journal of the American Chemical Society, 2018, 140, 10734-10739 |
| 4132427 | CIF | C72 H72 Cr2 F12 Fe2 N28 O10 P2 | P -1 | 16.3144; 17.0403; 18.0957 105.937; 90.656; 111.646 | 4460.3 | Pichon, Céline; Suaud, Nicolas; Duhayon, Carine; Guihéry, Nathalie; Sutter, Jean-Pascal Cyano-Bridged Fe(II)-Cr(III) Single-Chain Magnet Based on Pentagonal Bipyramid Units: On the Added Value of Aligned Axial Anisotropy. Journal of the American Chemical Society, 2018, 140, 7698-7704 |
| 4132428 | CIF | C61 H53 Cr2 Fe N21 O6 | P 1 21/c 1 | 17.9823; 23.0229; 17.6605 90; 93.5112; 90 | 7297.8 | Pichon, Céline; Suaud, Nicolas; Duhayon, Carine; Guihéry, Nathalie; Sutter, Jean-Pascal Cyano-Bridged Fe(II)-Cr(III) Single-Chain Magnet Based on Pentagonal Bipyramid Units: On the Added Value of Aligned Axial Anisotropy. Journal of the American Chemical Society, 2018, 140, 7698-7704 |
| 4132429 | CIF | C51 H99 K N2 Np O6 Si6 | P -1 | 12.1932; 12.7204; 22.2152 100.886; 104.395; 95.5327 | 3240 | Su, Jing; Windorff, Cory J.; Batista, Enrique R.; Evans, William J.; Gaunt, Andrew J.; Janicke, Michael T.; Kozimor, Stosh A.; Scott, Brian L.; Woen, David H.; Yang, Ping Identification of the Formal +2 Oxidation State of Neptunium: Synthesis and Structural Characterization of {Np<sup>II</sup>[C<sub>5</sub>H<sub>3</sub>(SiMe<sub>3</sub>)<sub>2</sub>]<sub>3</sub>}<sup>1</sup>. Journal of the American Chemical Society, 2018, 140, 7425-7428 |
| 4132430 | CIF | C22 H37 Cl8 N O P2 Ru | P 1 21/c 1 | 12.03; 10.6729; 25.4912 90; 97.675; 90 | 3243.6 | Zeng, Rong; Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-David, Yehoshoa; Milstein, David CO Oxidation by N<sub>2</sub>O Homogeneously Catalyzed by Ruthenium Hydride Pincer Complexes Indicating a New Mechanism. Journal of the American Chemical Society, 2018, 140, 7061-7064 |
| 4132431 | CIF | C21 H27 N2 O2 P Ru | P 1 21/c 1 | 8.8526; 8.5443; 27.4092 90; 96.433; 90 | 2060.16 | Zeng, Rong; Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-David, Yehoshoa; Milstein, David CO Oxidation by N<sub>2</sub>O Homogeneously Catalyzed by Ruthenium Hydride Pincer Complexes Indicating a New Mechanism. Journal of the American Chemical Society, 2018, 140, 7061-7064 |
| 4132432 | CIF | C21 H27 N2 O2 P Ru | P b c a | 12.0886; 13.2869; 26.5089 90; 90; 90 | 4257.9 | Zeng, Rong; Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-David, Yehoshoa; Milstein, David CO Oxidation by N<sub>2</sub>O Homogeneously Catalyzed by Ruthenium Hydride Pincer Complexes Indicating a New Mechanism. Journal of the American Chemical Society, 2018, 140, 7061-7064 |
| 4132433 | CIF | C21 H28 Cl5 N2 O P Ru | P 1 21/c 1 | 13.1954; 15.1605; 14.1886 90; 108.745; 90 | 2687.9 | Zeng, Rong; Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-David, Yehoshoa; Milstein, David CO Oxidation by N<sub>2</sub>O Homogeneously Catalyzed by Ruthenium Hydride Pincer Complexes Indicating a New Mechanism. Journal of the American Chemical Society, 2018, 140, 7061-7064 |
| 4132434 | CIF | C20 H27 Cl2 N2 O P Ru | P 1 21/c 1 | 7.9533; 15.2254; 17.5833 90; 94.438; 90 | 2122.8 | Zeng, Rong; Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-David, Yehoshoa; Milstein, David CO Oxidation by N<sub>2</sub>O Homogeneously Catalyzed by Ruthenium Hydride Pincer Complexes Indicating a New Mechanism. Journal of the American Chemical Society, 2018, 140, 7061-7064 |
| 4132435 | CIF | C11 H13 Cl Fe N2 | P 21 21 21 | 8.943; 10.923; 11.682 90; 90; 90 | 1141.1 | Drolen, Claire; Conklin, Eric; Hetterich, Stephen J.; Krishnamurthy, Aditi; Andrade, Gabriel A.; Dimeglio, John L.; Martin, Maxwell I.; Tran, Linh K.; Yap, Glenn P. A.; Rosenthal, Joel; Young, Elizabeth R. pH-Driven Mechanistic Switching from Electron Transfer to Energy Transfer between [Ru(bpy)<sub>3</sub>]<sup>2+</sup> and Ferrocene Derivatives. Journal of the American Chemical Society, 2018, 140, 10169-10178 |
| 4132436 | CIF | C14 H20 F6 Fe N P | P b c m | 9.842; 13.966; 12.181 90; 90; 90 | 1674.3 | Drolen, Claire; Conklin, Eric; Hetterich, Stephen J.; Krishnamurthy, Aditi; Andrade, Gabriel A.; Dimeglio, John L.; Martin, Maxwell I.; Tran, Linh K.; Yap, Glenn P. A.; Rosenthal, Joel; Young, Elizabeth R. pH-Driven Mechanistic Switching from Electron Transfer to Energy Transfer between [Ru(bpy)<sub>3</sub>]<sup>2+</sup> and Ferrocene Derivatives. Journal of the American Chemical Society, 2018, 140, 10169-10178 |
| 4132437 | CIF | C14 H20 B2 F8 Fe N | P n a 21 | 18.8753; 10.9829; 8.5634 90; 90; 90 | 1775.24 | Drolen, Claire; Conklin, Eric; Hetterich, Stephen J.; Krishnamurthy, Aditi; Andrade, Gabriel A.; Dimeglio, John L.; Martin, Maxwell I.; Tran, Linh K.; Yap, Glenn P. A.; Rosenthal, Joel; Young, Elizabeth R. pH-Driven Mechanistic Switching from Electron Transfer to Energy Transfer between [Ru(bpy)<sub>3</sub>]<sup>2+</sup> and Ferrocene Derivatives. Journal of the American Chemical Society, 2018, 140, 10169-10178 |
| 4132438 | CIF | C198 H239 F24 N40 O3 P4 Pd8 S3 | P -1 | 30.43; 31.273; 32.258 117.87; 104.25; 104.17 | 23870 | Howlader, Prodip; Mondal, Bijnaneswar; Purba, Prioti Choudhury; Zangrando, Ennio; Mukherjee, Partha Sarathi Self-Assembled Pd(II) Barrels as Containers for Transient Merocyanine Form and Reverse Thermochromism of Spiropyran. Journal of the American Chemical Society, 2018, 140, 7952-7960 |
| 4132439 | CIF | C200 H250 F36 N42 O10 P6 Pd8 S4 | P -1 | 22.184; 23.316; 24.414 107.21; 103.15; 91.64 | 11684 | Howlader, Prodip; Mondal, Bijnaneswar; Purba, Prioti Choudhury; Zangrando, Ennio; Mukherjee, Partha Sarathi Self-Assembled Pd(II) Barrels as Containers for Transient Merocyanine Form and Reverse Thermochromism of Spiropyran. Journal of the American Chemical Society, 2018, 140, 7952-7960 |
| 4132440 | CIF | C14 H24 Cl4 Fe N2 O4 | C 1 2/c 1 | 16.183; 9.4935; 13.961 90; 104.871; 90 | 2073 | DeGayner, Jordan A.; Wang, Kunyu; Harris, T. David A Ferric Semiquinoid Single-Chain Magnet via Thermally-Switchable Metal-Ligand Electron Transfer. Journal of the American Chemical Society, 2018, 140, 6550-6553 |
| 4132441 | CIF | C14 H24 Cl4 Fe N2 O4 | C 1 2/c 1 | 16.1004; 9.3394; 13.8165 90; 104.971; 90 | 2007 | DeGayner, Jordan A.; Wang, Kunyu; Harris, T. David A Ferric Semiquinoid Single-Chain Magnet via Thermally-Switchable Metal-Ligand Electron Transfer. Journal of the American Chemical Society, 2018, 140, 6550-6553 |
| 4132442 | CIF | C45 H71 N4 O Y | P 1 21/n 1 | 12.9445; 20.055; 17.771 90; 107.513; 90 | 4399.5 | Kundu, Abhinanda; Inoue, Mariko; Nagae, Haruki; Tsurugi, Hayato; Mashima, Kazushi Direct ortho-C-H Aminoalkylation of 2-Substituted Pyridine Derivatives Catalyzed by Yttrium Complexes with N,N'-Diarylethylenediamido Ligands. Journal of the American Chemical Society, 2018, 140, 7332-7342 |
| 4132443 | CIF | C44 H61 Lu N2 O2 Si | P 21 21 21 | 14.6844; 16.2869; 17.6979 90; 90; 90 | 4232.7 | Kundu, Abhinanda; Inoue, Mariko; Nagae, Haruki; Tsurugi, Hayato; Mashima, Kazushi Direct ortho-C-H Aminoalkylation of 2-Substituted Pyridine Derivatives Catalyzed by Yttrium Complexes with N,N'-Diarylethylenediamido Ligands. Journal of the American Chemical Society, 2018, 140, 7332-7342 |
| 4132444 | CIF | C15 H19 F3 O10 | C 1 2 1 | 18.829; 5.8347; 18.4856 90; 98.902; 90 | 2006.39 | Zhou, Min; Ni, Chuanfa; Zeng, Yuwen; Hu, Jinbo Trifluoromethyl Benzoate: A Versatile Trifluoromethoxylation Reagent. Journal of the American Chemical Society, 2018, 140, 6801-6805 |
| 4132445 | CIF | C9 H29 Br7 N4 Pb2 | C m c 21 | 38.91; 8.4458; 8.342 90; 90; 90 | 2741.4 | Li, Lina; Shang, Xiaoying; Wang, Sasa; Dong, Ningning; Ji, Chengmin; Chen, Xueyuan; Zhao, Sangen; Wang, Jun; Sun, Zhihua; Hong, Maochun; Luo, Junhua Bilayered Hybrid Perovskite Ferroelectric with Giant Two-Photon Absorption. Journal of the American Chemical Society, 2018, 140, 6806-6809 |
| 4132446 | CIF | C9 H29 Br7 N4 Pb2 | C m c m | 39.303; 8.4726; 8.4483 90; 90; 90 | 2813.3 | Li, Lina; Shang, Xiaoying; Wang, Sasa; Dong, Ningning; Ji, Chengmin; Chen, Xueyuan; Zhao, Sangen; Wang, Jun; Sun, Zhihua; Hong, Maochun; Luo, Junhua Bilayered Hybrid Perovskite Ferroelectric with Giant Two-Photon Absorption. Journal of the American Chemical Society, 2018, 140, 6806-6809 |
| 4132447 | CIF | C21 H27 Cl I N O4 | P -1 | 6.9976; 11.0632; 15.736 87.487; 79.01; 73.201 | 1144.8 | Zou, Yike; Li, Xiangqin; Yang, Yun; Berritt, Simon; Melvin, Jason; Gonzales, Stephen; Spafford, Matthew; Smith, 3rd, Amos B Total Synthesis of (-)-Nodulisporic Acids D, C, and B: Evolution of a Unified Synthetic Strategy. Journal of the American Chemical Society, 2018, 140, 9502-9511 |
| 4132448 | CIF | C29 H56 O3 Si2 | P 1 21 1 | 7.0926; 10.7908; 20.6337 90; 96.016; 90 | 1570.5 | Zou, Yike; Li, Xiangqin; Yang, Yun; Berritt, Simon; Melvin, Jason; Gonzales, Stephen; Spafford, Matthew; Smith, 3rd, Amos B Total Synthesis of (-)-Nodulisporic Acids D, C, and B: Evolution of a Unified Synthetic Strategy. Journal of the American Chemical Society, 2018, 140, 9502-9511 |
| 4132449 | CIF | C19 H27 Br O3 | P -1 | 9.8887; 14.8615; 19.586 73.101; 80.806; 74.567 | 2644.2 | Zou, Yike; Li, Xiangqin; Yang, Yun; Berritt, Simon; Melvin, Jason; Gonzales, Stephen; Spafford, Matthew; Smith, 3rd, Amos B Total Synthesis of (-)-Nodulisporic Acids D, C, and B: Evolution of a Unified Synthetic Strategy. Journal of the American Chemical Society, 2018, 140, 9502-9511 |
| 4132450 | CIF | C16 H20 Cl N O | I 1 2 1 | 19.2746; 7.6362; 20.2859 90; 101.507; 90 | 2925.76 | Zou, Yike; Li, Xiangqin; Yang, Yun; Berritt, Simon; Melvin, Jason; Gonzales, Stephen; Spafford, Matthew; Smith, 3rd, Amos B Total Synthesis of (-)-Nodulisporic Acids D, C, and B: Evolution of a Unified Synthetic Strategy. Journal of the American Chemical Society, 2018, 140, 9502-9511 |
| 4132451 | CIF | C26 H36 Cl N O5 | P 21 21 21 | 9.3356; 10.3523; 27.244 90; 90; 90 | 2632.99 | Zou, Yike; Li, Xiangqin; Yang, Yun; Berritt, Simon; Melvin, Jason; Gonzales, Stephen; Spafford, Matthew; Smith, 3rd, Amos B Total Synthesis of (-)-Nodulisporic Acids D, C, and B: Evolution of a Unified Synthetic Strategy. Journal of the American Chemical Society, 2018, 140, 9502-9511 |
| 4132452 | CIF | C29 H37 Cl4 Co4 Mn N4 O19 | P -1 | 9.9954; 11.9031; 18.5973 78.224; 85.522; 77.125 | 2110.4 | Nguyen, Andy I.; Darago, Lucy E.; Balcells, David; Tilley, T. Don Influence of a "Dangling" Co(II) Ion Bound to a [MnCo<sub>3</sub>O<sub>4</sub>] Oxo Cubane. Journal of the American Chemical Society, 2018, 140, 9030-9033 |
| 4132453 | CIF | C29 H54 P2 Pd | P 1 21/n 1 | 9.5521; 9.1531; 16.1386 90; 91.007; 90 | 1410.8 | Wang, Justin Y.; Strom, Alexandra E.; Hartwig, John F. Mechanistic Studies of Palladium-Catalyzed Aminocarbonylation of Aryl Chlorides with Carbon Monoxide and Ammonia. Journal of the American Chemical Society, 2018, 140, 7979-7993 |
| 4132454 | CIF | C55 H101 B F4 O P4 Pd2 | P 1 21/n 1 | 10.7443; 21.9962; 25.3867 90; 95.498; 90 | 5972.1 | Wang, Justin Y.; Strom, Alexandra E.; Hartwig, John F. Mechanistic Studies of Palladium-Catalyzed Aminocarbonylation of Aryl Chlorides with Carbon Monoxide and Ammonia. Journal of the American Chemical Society, 2018, 140, 7979-7993 |
| 4132455 | CIF | C29 H50 O2 P2 Pd | P n m a | 14.5802; 23.5092; 8.5138 90; 90; 90 | 2918.3 | Wang, Justin Y.; Strom, Alexandra E.; Hartwig, John F. Mechanistic Studies of Palladium-Catalyzed Aminocarbonylation of Aryl Chlorides with Carbon Monoxide and Ammonia. Journal of the American Chemical Society, 2018, 140, 7979-7993 |
| 4132456 | CIF | C36 H49 Au Cl F6 N P Sb | P -1 | 9.8814; 11.6523; 16.7557 108.751; 103.739; 94.839 | 1747.31 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132457 | CIF | C18 H46 B10 N4 P2 | P 1 21/n 1 | 11.492; 19.277; 13.003 90; 99.819; 90 | 2838.4 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132458 | CIF | C64 H88 Au2 Cl6 F12 N2 P2 Sb2 | P c c n | 20.8838; 17.9885; 18.4736 90; 90; 90 | 6939.9 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132459 | CIF | C38 H47 Au Cl F6 N P Sb | P -1 | 10.0473; 11.3493; 17.4404 100.731; 103.7; 99.465 | 1852.5 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132460 | CIF | C70 H95 Au2 Cl6 F18 N2 O2 P2 Sb3 | P -1 | 10.3978; 10.8778; 17.7061 90.465; 90.583; 94.133 | 1997.26 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132461 | CIF | C35 H44 Au Cl0.86 F9 I0.14 N P Sb | P -1 | 10.2214; 11.5151; 16.2248 108.902; 99.944; 100.426 | 1721.07 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132462 | CIF | C34 H44 Au Br Cl0.77 F6 I0.23 N P Sb | P -1 | 10.182; 11.4038; 16.3043 109.033; 100.165; 100.426 | 1702.7 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132463 | CIF | C35 H44 Au Cl0.95 F9 I0.05 N O P Sb | P -1 | 10.0238; 11.7115; 16.7522 106.082; 106.45; 97.925 | 1761.66 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132464 | CIF | C45 H49 Au Cl0.85 F6 I0.15 N O P Sb | P -1 | 10.0424; 12.023; 19.663 101.463; 101.135; 100.103 | 2225.8 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132465 | CIF | C34 H47 Au Cl F6 N O2 P Sb | P -1 | 9.5384; 13.2116; 15.7777 112.015; 105.708; 91.052 | 1758.4 | Messina, Marco S.; Stauber, Julia M.; Waddington, Mary A.; Rheingold, Arnold L.; Maynard, Heather D.; Spokoyny, Alexander M. Organometallic Gold(III) Reagents for Cysteine Arylation. Journal of the American Chemical Society, 2018, 140, 7065-7069 |
| 4132466 | CIF | C28 H26 Fe O3 | P 1 21/c 1 | 10.8154; 18.7822; 11.4495 90; 109.742; 90 | 2189.11 | Dong, Zhe; Lu, Gang; Wang, Jianchun; Liu, Peng; Dong, Guangbin Modular ipso/ ortho Difunctionalization of Aryl Bromides via Palladium/Norbornene Cooperative Catalysis. Journal of the American Chemical Society, 2018, 140, 8551-8562 |
| 4132467 | CIF | C82 H138 Cl8 N6 O5 Pt | P -1 | 11.1681; 20.1957; 20.2872 100.49; 94.456; 97.41 | 4437.6 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132468 | CIF | C61 H68 Au Br4 Cl3 N4 O7 | P -1 | 9.9014; 11.376; 14.3487 95.5136; 106.474; 96.7739 | 1524.74 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132469 | CIF | C67 H99 Au Cl13 N5 O4 | P n a 21 | 21.626; 15.426; 22.964 90; 90; 90 | 7660.9 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132470 | CIF | C52.5 H73 Cl N4 O6 S2 | P c a 21 | 17.2894; 11.2213; 27.5815 90; 90; 90 | 5351.07 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132471 | CIF | C67 H99 Au Br4 Cl9 N5 O4 | P n a 21 | 21.768; 15.419; 23.157 90; 90; 90 | 7772.4 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132472 | CIF | C80 H132 Cl6 N6 O4 Pd2 | P -1 | 11.4123; 13.8383; 14.9653 102.685; 95.062; 112.999 | 2082.2 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132473 | CIF | C58 H59 Au Cl10 N4 O6 | P -1 | 9.4815; 11.0063; 14.569 83.563; 83.05; 80.654 | 1482.5 | Liu, Wenqi; Oliver, Allen G.; Smith, Bradley D. Macrocyclic Receptor for Precious Gold, Platinum, or Palladium Coordination Complexes. Journal of the American Chemical Society, 2018, 140, 6810-6813 |
| 4132474 | CIF | C63 H46 Cu F6 N9 P Zn | P 1 21/c 1 | 9.55; 31.109; 19.849 90; 90.768; 90 | 5896 | Sil, Debangsu; Martinez, Zachary; Ding, Shengda; Bhuvanesh, Nattamai; Darensbourg, Donald J.; Hall, Michael B.; Darensbourg, Marcetta Y. Cyanide Docking and Linkage Isomerism in Models for the Artificial [FeFe]-Hydrogenase Maturation Process. Journal of the American Chemical Society, 2018, 140, 9904-9911 |
| 4132475 | CIF | C64 H48 Cl2 Cu N9 Zn | P 1 21/n 1 | 14.1151; 18.5419; 19.9898 90; 90.583; 90 | 5231.5 | Sil, Debangsu; Martinez, Zachary; Ding, Shengda; Bhuvanesh, Nattamai; Darensbourg, Donald J.; Hall, Michael B.; Darensbourg, Marcetta Y. Cyanide Docking and Linkage Isomerism in Models for the Artificial [FeFe]-Hydrogenase Maturation Process. Journal of the American Chemical Society, 2018, 140, 9904-9911 |
| 4132476 | CIF | C58 H54 Cu2 F6 Fe4 N12 O10 P S4 | P 1 21/c 1 | 19.4349; 11.9765; 14.9472 90; 91.307; 90 | 3478.2 | Sil, Debangsu; Martinez, Zachary; Ding, Shengda; Bhuvanesh, Nattamai; Darensbourg, Donald J.; Hall, Michael B.; Darensbourg, Marcetta Y. Cyanide Docking and Linkage Isomerism in Models for the Artificial [FeFe]-Hydrogenase Maturation Process. Journal of the American Chemical Society, 2018, 140, 9904-9911 |
| 4132477 | CIF | C27 H24 Cu Fe2 N5 O5 S2 | P 21 21 21 | 8.954; 13.437; 24.882 90; 90; 90 | 2993.7 | Sil, Debangsu; Martinez, Zachary; Ding, Shengda; Bhuvanesh, Nattamai; Darensbourg, Donald J.; Hall, Michael B.; Darensbourg, Marcetta Y. Cyanide Docking and Linkage Isomerism in Models for the Artificial [FeFe]-Hydrogenase Maturation Process. Journal of the American Chemical Society, 2018, 140, 9904-9911 |
| 4132478 | CIF | C27 H43 Al Cl N3 P2 | P -1 | 11.416; 11.745; 12.139 76.321; 70.418; 83.516 | 1489 | Hara, Naofumi; Saito, Teruhiko; Semba, Kazuhiko; Kuriakose, Nishamol; Zheng, Hong; Sakaki, Shigeyoshi; Nakao, Yoshiaki Rhodium Complexes Bearing PAlP Pincer Ligands. Journal of the American Chemical Society, 2018, 140, 7070-7073 |
| 4132479 | CIF | C32 H47 Al N4 P2 Rh | P 1 21/c 1 | 16.1981; 11.3885; 18.3501 90; 106.008; 90 | 3253.82 | Hara, Naofumi; Saito, Teruhiko; Semba, Kazuhiko; Kuriakose, Nishamol; Zheng, Hong; Sakaki, Shigeyoshi; Nakao, Yoshiaki Rhodium Complexes Bearing PAlP Pincer Ligands. Journal of the American Chemical Society, 2018, 140, 7070-7073 |
| 4132480 | CIF | C58 H86 Al2 N6 O4 P4 Rh2 | P -1 | 9.0006; 15.272; 22.694 85.964; 84.286; 86.941 | 3092.9 | Hara, Naofumi; Saito, Teruhiko; Semba, Kazuhiko; Kuriakose, Nishamol; Zheng, Hong; Sakaki, Shigeyoshi; Nakao, Yoshiaki Rhodium Complexes Bearing PAlP Pincer Ligands. Journal of the American Chemical Society, 2018, 140, 7070-7073 |
| 4132481 | CIF | C28 H45 Al Cl4 N3 P2 Rh | P -1 | 11.1835; 12.0058; 13.1647 79.115; 76.906; 81.612 | 1680.8 | Hara, Naofumi; Saito, Teruhiko; Semba, Kazuhiko; Kuriakose, Nishamol; Zheng, Hong; Sakaki, Shigeyoshi; Nakao, Yoshiaki Rhodium Complexes Bearing PAlP Pincer Ligands. Journal of the American Chemical Society, 2018, 140, 7070-7073 |
| 4132482 | CIF | C48 H108 Au14 Cd S12 | C 1 2/c 1 | 22.96; 20.862; 19.584 90; 97.508; 90 | 9300 | Yang, Sha; Chen, Shuang; Xiong, Lin; Liu, Chong; Yu, Haizhu; Wang, Shuxin; Rosi, Nathaniel L.; Pei, Yong; Zhu, Manzhou Total Structure Determination of Au<sub>16</sub>(S-Adm)<sub>12</sub> and Cd<sub>1</sub>Au<sub>14</sub>(S tBu)<sub>12</sub> and Implications for the Structure of Au<sub>15</sub>(SR)<sub>13</sub>. Journal of the American Chemical Society, 2018, 140, 10988-10994 |
| 4132483 | CIF | C123 H185 Au14 Cd Cl6 S12 | P -1 | 16.476; 16.719; 30.157 80.994; 82.064; 62.481 | 7255.9 | Yang, Sha; Chen, Shuang; Xiong, Lin; Liu, Chong; Yu, Haizhu; Wang, Shuxin; Rosi, Nathaniel L.; Pei, Yong; Zhu, Manzhou Total Structure Determination of Au<sub>16</sub>(S-Adm)<sub>12</sub> and Cd<sub>1</sub>Au<sub>14</sub>(S tBu)<sub>12</sub> and Implications for the Structure of Au<sub>15</sub>(SR)<sub>13</sub>. Journal of the American Chemical Society, 2018, 140, 10988-10994 |
| 4132484 | CIF | C120 H180 Au16 S12 | P 1 21/c 1 | 29.202; 18.1799; 27.6543 90; 97.913; 90 | 14542 | Yang, Sha; Chen, Shuang; Xiong, Lin; Liu, Chong; Yu, Haizhu; Wang, Shuxin; Rosi, Nathaniel L.; Pei, Yong; Zhu, Manzhou Total Structure Determination of Au<sub>16</sub>(S-Adm)<sub>12</sub> and Cd<sub>1</sub>Au<sub>14</sub>(S tBu)<sub>12</sub> and Implications for the Structure of Au<sub>15</sub>(SR)<sub>13</sub>. Journal of the American Chemical Society, 2018, 140, 10988-10994 |
| 4132485 | CIF | C117 H62 O32 Zr6 | I m m m | 23.2664; 32.9221; 41.4807 90; 90; 90 | 31773.3 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132486 | CIF | C44 H22 O16 Zr3 | C m m m | 22.327; 33.727; 20.888 90; 90; 90 | 15729 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132487 | CIF | C53 H23 N O16 Zr3 | C m m m | 23.566; 33.312; 20.631 90; 90; 90 | 16196 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132488 | CIF | C58 H30 O16 Zr3 | C m m m | 23.159; 33.299; 20.824 90; 90; 90 | 16059 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132489 | CIF | C55 H28 O16 Zr3 | C m m m | 23.1484; 33.0429; 20.6518 90; 90; 90 | 15796.4 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132490 | CIF | C54 H26 O18 Zr3 | C m m m | 23.361; 33.409; 20.691 90; 90; 90 | 16149 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132491 | CIF | C125 H60 O32 Zr6 | I m m m | 23.1544; 33.1052; 40.833 90; 90; 90 | 31300 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132492 | CIF | C60 H30 O24 Zr3 | C m m m | 21.1374; 33.1766; 21.4671 90; 90; 90 | 15054.2 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132493 | CIF | C44 H22 O16 Zr3 | C m m m | 20.2175; 34.4927; 21.0753 90; 90; 90 | 14697 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132494 | CIF | C44 H22 Hf3 O16 | C m m m | 20.5524; 34.409; 21.016 90; 90; 90 | 14862.3 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132495 | CIF | C63 H34 O16 Zr3 | C m m m | 23.2646; 32.332; 21.5466 90; 90; 90 | 16207.2 | Zhang, Xin; Frey, Brandon L.; Chen, Yu-Sheng; Zhang, Jian Topology-Guided Stepwise Insertion of Three Secondary Linkers in Zirconium Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 7710-7715 |
| 4132496 | CIF | C174 H211 Br6 N33 O32 Zn3 | P 41 21 2 | 28.3931; 28.3931; 84.817 90; 90; 90 | 68377 | Yamagami, Motoya; Sawada, Tomohisa; Fujita, Makoto Synthetic β-Barrel by Metal-Induced Folding and Assembly. Journal of the American Chemical Society, 2018, 140, 8644-8647 |
| 4132497 | CIF | C174 H201.88 Cl6 N33 O30.5 Zn3 | P 41 21 2 | 28.3964; 28.3964; 84.3978 90; 90; 90 | 68054.6 | Yamagami, Motoya; Sawada, Tomohisa; Fujita, Makoto Synthetic β-Barrel by Metal-Induced Folding and Assembly. Journal of the American Chemical Society, 2018, 140, 8644-8647 |
| 4132498 | CIF | C174 H202 I6 N33 O31 Zn3 | P 41 21 2 | 28.4415; 28.4415; 85.872 90; 90; 90 | 69463.5 | Yamagami, Motoya; Sawada, Tomohisa; Fujita, Makoto Synthetic β-Barrel by Metal-Induced Folding and Assembly. Journal of the American Chemical Society, 2018, 140, 8644-8647 |
| 4132499 | CIF | C117.71 H134 N16 | P -1 | 10.2578; 13.5871; 18.479 90; 104.03; 90 | 2498.7 | Lou, Alexander J.-T.; Righetto, Stefania; Barger, Christopher; Zuccaccia, Cristiano; Cariati, Elena; Macchioni, Alceo; Marks, Tobin J. Unprecedented Large Hyperpolarizability of Twisted Chromophores in Polar Media. Journal of the American Chemical Society, 2018, 140, 8746-8755 |
| 4132500 | CIF | C27 H32 N4 | P 1 21/n 1 | 9.1171; 17.2703; 15.3013 90; 100.518; 90 | 2368.8 | Lou, Alexander J.-T.; Righetto, Stefania; Barger, Christopher; Zuccaccia, Cristiano; Cariati, Elena; Macchioni, Alceo; Marks, Tobin J. Unprecedented Large Hyperpolarizability of Twisted Chromophores in Polar Media. Journal of the American Chemical Society, 2018, 140, 8746-8755 |
| 4132501 | CIF | C112 H136 N16 | P -1 | 9.6621; 14.6897; 17.747 90; 104.666; 90 | 2436.8 | Lou, Alexander J.-T.; Righetto, Stefania; Barger, Christopher; Zuccaccia, Cristiano; Cariati, Elena; Macchioni, Alceo; Marks, Tobin J. Unprecedented Large Hyperpolarizability of Twisted Chromophores in Polar Media. Journal of the American Chemical Society, 2018, 140, 8746-8755 |
| 4132502 | CIF | C31 H37 Cl2 Cu N11 O4 | P -1 | 8.4233; 13.0818; 16.344 71.392; 89.569; 77.201 | 1660.5 | Ghattas, Wadih; Dubosclard, Virginie; Wick, Arne; Bendelac, Audrey; Guillot, Régis; Ricoux, Rémy; Mahy, Jean-Pierre Receptor-Based Artificial Metalloenzymes on Living Human Cells. Journal of the American Chemical Society, 2018, 140, 8756-8762 |
| 4132503 | CIF | C45 H26 F12 O2 | P -1 | 8.9854; 13.222; 16.513 68.563; 79.735; 87.455 | 1796.4 | Bedi, Anjan; Shimon, Linda J. W.; Gidron, Ori Helically Locked Tethered Twistacenes. Journal of the American Chemical Society, 2018, 140, 8086-8090 |
| 4132504 | CIF | C47 H30 F12 O2 | P -1 | 15.2965; 15.9067; 16.5026 73.197; 88.851; 78.149 | 3758.68 | Bedi, Anjan; Shimon, Linda J. W.; Gidron, Ori Helically Locked Tethered Twistacenes. Journal of the American Chemical Society, 2018, 140, 8086-8090 |
| 4132505 | CIF | C49 H35 F12 O2 | P 1 21/c 1 | 16.2853; 15.2445; 17.0808 90; 107.963; 90 | 4033.8 | Bedi, Anjan; Shimon, Linda J. W.; Gidron, Ori Helically Locked Tethered Twistacenes. Journal of the American Chemical Society, 2018, 140, 8086-8090 |
| 4132506 | CIF | C26 H19 N O | P c a 21 | 17.7003; 12.0897; 8.2601 90; 90; 90 | 1767.59 | Bowring, Miriam A.; Bradshaw, Liam R.; Parada, Giovanny A.; Pollock, Timothy P.; Fernández-Terán, Ricardo J; Kolmar, Scott S.; Mercado, Brandon Q.; Schlenker, Cody W.; Gamelin, Daniel R.; Mayer, James M. Activationless Multiple-Site Concerted Proton-Electron Tunneling. Journal of the American Chemical Society, 2018, 140, 7449-7452 |
| 4132507 | CIF | C50 H32 Cl F8 N4 O1.5 Ru | P 21 21 21 | 11.4235; 20.7153; 39.4855 90; 90; 90 | 9343.9 | Shing, Ka-Pan; Cao, Bei; Liu, Yungen; Lee, Hung Kay; Li, Ming-De; Phillips, David Lee; Chang, Xiao-Yong; Che, Chi-Ming Arylruthenium(III) Porphyrin-Catalyzed C-H Oxidation and Epoxidation at Room Temperature and [Ru<sup>V</sup>(Por)(O)(Ph)] Intermediate by Spectroscopic Analysis and Density Functional Theory Calculations. Journal of the American Chemical Society, 2018, 140, 7032-7042 |
| 4132508 | CIF | C50 H29 F8 N4 O2 Ru | C 1 2/c 1 | 20.0727; 12.7833; 20.2135 90; 109.087; 90 | 4901.6 | Shing, Ka-Pan; Cao, Bei; Liu, Yungen; Lee, Hung Kay; Li, Ming-De; Phillips, David Lee; Chang, Xiao-Yong; Che, Chi-Ming Arylruthenium(III) Porphyrin-Catalyzed C-H Oxidation and Epoxidation at Room Temperature and [Ru<sup>V</sup>(Por)(O)(Ph)] Intermediate by Spectroscopic Analysis and Density Functional Theory Calculations. Journal of the American Chemical Society, 2018, 140, 7032-7042 |
| 4132509 | CIF | C61 H52 Cl8 N4 O2 Ru | P 1 21/n 1 | 12.5729; 21.6205; 21.91 90; 95.011; 90 | 5933.1 | Shing, Ka-Pan; Cao, Bei; Liu, Yungen; Lee, Hung Kay; Li, Ming-De; Phillips, David Lee; Chang, Xiao-Yong; Che, Chi-Ming Arylruthenium(III) Porphyrin-Catalyzed C-H Oxidation and Epoxidation at Room Temperature and [Ru<sup>V</sup>(Por)(O)(Ph)] Intermediate by Spectroscopic Analysis and Density Functional Theory Calculations. Journal of the American Chemical Society, 2018, 140, 7032-7042 |
| 4132510 | CIF | C122 H134 F24 N4 O20 P4 | P 1 21/n 1 | 10.82435; 20.5867; 33.7361 90; 95.9552; 90 | 7477.1 | Wessels, Hanlie R.; Slebodnick, Carla; Gibson, Harry W. Viologen-Based Rotaxanes from Dibenzo-30-crown-10. Journal of the American Chemical Society, 2018, 140, 7358-7370 |
| 4132511 | CIF | C24 H35.5 Au O0.25 P | P 1 21/n 1 | 17.3939; 25.8131; 21.8115 90; 91.63; 90 | 9789.19 | Rocchigiani, Luca; Fernandez-Cestau, Julio; Chambrier, Isabelle; Hrobárik, Peter; Bochmann, Manfred Unlocking Structural Diversity in Gold(III) Hydrides: Unexpected Interplay of cis/ trans-Influence on Stability, Insertion Chemistry, and NMR Chemical Shifts. Journal of the American Chemical Society, 2018, 140, 8287-8302 |
| 4132512 | CIF | C29 H40 Au O4 P | P 21 21 21 | 10.3057; 14.2256; 19.7173 90; 90; 90 | 2890.65 | Rocchigiani, Luca; Fernandez-Cestau, Julio; Chambrier, Isabelle; Hrobárik, Peter; Bochmann, Manfred Unlocking Structural Diversity in Gold(III) Hydrides: Unexpected Interplay of cis/ trans-Influence on Stability, Insertion Chemistry, and NMR Chemical Shifts. Journal of the American Chemical Society, 2018, 140, 8287-8302 |
| 4132513 | CIF | C48 H67 Au F5 N O4 | P b c a | 20.9189; 17.0445; 26.4122 90; 90; 90 | 9417.33 | Rocchigiani, Luca; Fernandez-Cestau, Julio; Chambrier, Isabelle; Hrobárik, Peter; Bochmann, Manfred Unlocking Structural Diversity in Gold(III) Hydrides: Unexpected Interplay of cis/ trans-Influence on Stability, Insertion Chemistry, and NMR Chemical Shifts. Journal of the American Chemical Society, 2018, 140, 8287-8302 |
| 4132514 | CIF | C40 H50 Au2 O2 | P 1 21/c 1 | 14.6204; 5.968; 19.8075 90; 98.147; 90 | 1710.85 | Rocchigiani, Luca; Fernandez-Cestau, Julio; Chambrier, Isabelle; Hrobárik, Peter; Bochmann, Manfred Unlocking Structural Diversity in Gold(III) Hydrides: Unexpected Interplay of cis/ trans-Influence on Stability, Insertion Chemistry, and NMR Chemical Shifts. Journal of the American Chemical Society, 2018, 140, 8287-8302 |
| 4132515 | CIF | C26 H42 Au2 P2 | P 1 21/n 1 | 10.4674; 11.8922; 22.9414 90; 100.833; 90 | 2804.86 | Rocchigiani, Luca; Fernandez-Cestau, Julio; Chambrier, Isabelle; Hrobárik, Peter; Bochmann, Manfred Unlocking Structural Diversity in Gold(III) Hydrides: Unexpected Interplay of cis/ trans-Influence on Stability, Insertion Chemistry, and NMR Chemical Shifts. Journal of the American Chemical Society, 2018, 140, 8287-8302 |
| 4132516 | CIF | C41 H64 Ni O2 P2 | P 1 21/c 1 | 10.289; 37.957; 9.791 90; 99.355; 90 | 3772.9 | Somerville, Rosie J.; Hale, Lillian V. A.; Gómez-Bengoa, Enrique; Burés, Jordi; Martin, Ruben Intermediacy of Ni-Ni Species in sp<sup>2</sup> C-O Bond Cleavage of Aryl Esters: Relevance in Catalytic C-Si Bond Formation. Journal of the American Chemical Society, 2018, 140, 8771-8780 |
| 4132517 | CIF | C51 H82 Ni2 O2 P2 | P b c n | 32.625; 9.9735; 28.5895 90; 90; 90 | 9302.6 | Somerville, Rosie J.; Hale, Lillian V. A.; Gómez-Bengoa, Enrique; Burés, Jordi; Martin, Ruben Intermediacy of Ni-Ni Species in sp<sup>2</sup> C-O Bond Cleavage of Aryl Esters: Relevance in Catalytic C-Si Bond Formation. Journal of the American Chemical Society, 2018, 140, 8771-8780 |
| 4132518 | CIF | C56 H102 Ni2 O8 P2 | P -1 | 10.9948; 11.8656; 12.9686 67.3623; 76.229; 70.3121 | 1458.77 | Somerville, Rosie J.; Hale, Lillian V. A.; Gómez-Bengoa, Enrique; Burés, Jordi; Martin, Ruben Intermediacy of Ni-Ni Species in sp<sup>2</sup> C-O Bond Cleavage of Aryl Esters: Relevance in Catalytic C-Si Bond Formation. Journal of the American Chemical Society, 2018, 140, 8771-8780 |
| 4132519 | CIF | C70 H66 P4 Ru Si2 | P -1 | 10.1725; 11.8432; 13.0967 87.134; 83.968; 79.187 | 1540.5 | Tanaka, Yuya; Kato, Yuya; Tada, Tomofumi; Fujii, Shintaro; Kiguchi, Manabu; Akita, Munetaka "Doping" of Polyyne with an Organometallic Fragment Leads to Highly Conductive Metallapolyyne Molecular Wire. Journal of the American Chemical Society, 2018, 140, 10080-10084 |
| 4132520 | CIF | C74 H72 Au2 Cl8 N4 P4 Ru | C 1 2/c 1 | 28.328; 17.7028; 17.0686 90; 120.73; 90 | 7357.7 | Tanaka, Yuya; Kato, Yuya; Tada, Tomofumi; Fujii, Shintaro; Kiguchi, Manabu; Akita, Munetaka "Doping" of Polyyne with an Organometallic Fragment Leads to Highly Conductive Metallapolyyne Molecular Wire. Journal of the American Chemical Society, 2018, 140, 10080-10084 |
| 4132521 | CIF | C80 H72 P4 Ru Si2 | C 1 2/c 1 | 26.639; 10.0264; 25.445 90; 97.375; 90 | 6740 | Tanaka, Yuya; Kato, Yuya; Tada, Tomofumi; Fujii, Shintaro; Kiguchi, Manabu; Akita, Munetaka "Doping" of Polyyne with an Organometallic Fragment Leads to Highly Conductive Metallapolyyne Molecular Wire. Journal of the American Chemical Society, 2018, 140, 10080-10084 |
| 4132522 | CIF | C25 H33 N O4 S | P 1 21 1 | 9.8224; 6.6868; 17.4224 90; 91.738; 90 | 1143.78 | Grélaud, Simon; Cooper, Phillippa; Feron, Lyman J.; Bower, John F. Branch-Selective and Enantioselective Iridium-Catalyzed Alkene Hydroarylation via Anilide-Directed C-H Oxidative Addition. Journal of the American Chemical Society, 2018, 140, 9351-9356 |
| 4132523 | CIF | C16 H19 N O S | P 21 21 21 | 5.0523; 16.423; 17.2698 90; 90; 90 | 1432.94 | Grélaud, Simon; Cooper, Phillippa; Feron, Lyman J.; Bower, John F. Branch-Selective and Enantioselective Iridium-Catalyzed Alkene Hydroarylation via Anilide-Directed C-H Oxidative Addition. Journal of the American Chemical Society, 2018, 140, 9351-9356 |
| 4132524 | CIF | C16 H19 N O S | P 21 21 21 | 5.0568; 16.3847; 17.2832 90; 90; 90 | 1431.98 | Grélaud, Simon; Cooper, Phillippa; Feron, Lyman J.; Bower, John F. Branch-Selective and Enantioselective Iridium-Catalyzed Alkene Hydroarylation via Anilide-Directed C-H Oxidative Addition. Journal of the American Chemical Society, 2018, 140, 9351-9356 |
| 4132525 | CIF | C78 H222 Cu6 Fe2 N12 Ni4 O118 | P 4/m m m | 36.382; 36.382; 15.489 90; 90; 90 | 20502 | Tejeda-Serrano, María; Mon, Marta; Ross, Bethany; Gonell, Francisco; Ferrando-Soria, Jesús; Corma, Avelino; Leyva-Pérez, Antonio; Armentano, Donatella; Pardo, Emilio Isolated Fe(III)-O Sites Catalyze the Hydrogenation of Acetylene in Ethylene Flows under Front-End Industrial Conditions. Journal of the American Chemical Society, 2018, 140, 8827-8832 |
| 4132526 | CIF | C25 H25 Cl Cu N8 O4 | P 1 21/n 1 | 9.47238; 9.82216; 27.9989 90; 98.9437; 90 | 2573.32 | Bhadra, Mayukh; Lee, Jung Yoon C.; Cowley, Ryan E.; Kim, Sunghee; Siegler, Maxime A.; Solomon, Edward I.; Karlin, Kenneth D. Intramolecular Hydrogen Bonding Enhances Stability and Reactivity of Mononuclear Cupric Superoxide Complexes. Journal of the American Chemical Society, 2018, 140, 9042-9045 |
| 4132527 | CIF | C28 H26 Cl2 Cu F5 N5 O9 | P 1 21/c 1 | 20.0003; 10.59484; 15.22292 90; 99.1402; 90 | 3184.78 | Bhadra, Mayukh; Lee, Jung Yoon C.; Cowley, Ryan E.; Kim, Sunghee; Siegler, Maxime A.; Solomon, Edward I.; Karlin, Kenneth D. Intramolecular Hydrogen Bonding Enhances Stability and Reactivity of Mononuclear Cupric Superoxide Complexes. Journal of the American Chemical Society, 2018, 140, 9042-9045 |
| 4132528 | CIF | C52.33 H45.83 Cu2 F22 N10 O0.58 Sb2 | P -1 | 19.8184; 23.5255; 23.9366 112.269; 106.518; 102.112 | 9245.6 | Bhadra, Mayukh; Lee, Jung Yoon C.; Cowley, Ryan E.; Kim, Sunghee; Siegler, Maxime A.; Solomon, Edward I.; Karlin, Kenneth D. Intramolecular Hydrogen Bonding Enhances Stability and Reactivity of Mononuclear Cupric Superoxide Complexes. Journal of the American Chemical Society, 2018, 140, 9042-9045 |
| 4132529 | CIF | C26 H21 Cu F8 N8 O3.5 S | P -1 | 16.9714; 25.4865; 30.1352 113.519; 94.289; 95.9659 | 11790.2 | Bhadra, Mayukh; Lee, Jung Yoon C.; Cowley, Ryan E.; Kim, Sunghee; Siegler, Maxime A.; Solomon, Edward I.; Karlin, Kenneth D. Intramolecular Hydrogen Bonding Enhances Stability and Reactivity of Mononuclear Cupric Superoxide Complexes. Journal of the American Chemical Society, 2018, 140, 9042-9045 |
| 4132530 | CIF | C141 H157 Cl15 N10 O0 Zn2 | P -1 | 18.8651; 19.7892; 20.6097 69.546; 85.836; 67.732 | 6655.5 | Nagai, Tomohiro; Takiguchi, Asahi; Ueda, Masayuki; Oda, Kazuma; Hiroto, Satoru; Shinokubo, Hiroshi X-Shaped Cyclobutane-Linked Tetraporphyrins through a Thermal [2+2] Cycloaddition of Etheno-Fused Diporphyrins. Journal of the American Chemical Society, 2018, 140, 8392-8395 |
| 4132531 | CIF | C661.53 H697.2 Cl25.75 N36.45 Ni8 | C 1 2/c 1 | 25.7724; 36.8812; 30.7405 90; 96.752; 90 | 29016.7 | Nagai, Tomohiro; Takiguchi, Asahi; Ueda, Masayuki; Oda, Kazuma; Hiroto, Satoru; Shinokubo, Hiroshi X-Shaped Cyclobutane-Linked Tetraporphyrins through a Thermal [2+2] Cycloaddition of Etheno-Fused Diporphyrins. Journal of the American Chemical Society, 2018, 140, 8392-8395 |
| 4132532 | CIF | C293.49 H319.68 Cl5.64 N19.83 O4.62 Zn4 | P 1 21/c 1 | 17.92; 40.8305; 18.667 90; 105.355; 90 | 13170.8 | Nagai, Tomohiro; Takiguchi, Asahi; Ueda, Masayuki; Oda, Kazuma; Hiroto, Satoru; Shinokubo, Hiroshi X-Shaped Cyclobutane-Linked Tetraporphyrins through a Thermal [2+2] Cycloaddition of Etheno-Fused Diporphyrins. Journal of the American Chemical Society, 2018, 140, 8392-8395 |
| 4132533 | CIF | C24 H14 F6 N3 O4 Rh S | C 1 2/c 1 | 17.5481; 20.1172; 13.4385 90; 101.468; 90 | 4649.3 | Chan, Alan Kwun-Wa; Ng, Maggie; Low, Kam-Hung; Yam, Vivian Wing-Wah Versatile Control of Directed Supramolecular Assembly via Subtle Changes of the Rhodium(I) Pincer Building Blocks. Journal of the American Chemical Society, 2018, 140, 8321-8329 |
| 4132534 | CIF | C26 H29 N O4 S | P 21 21 21 | 8.3584; 14.816; 18.9753 90; 90; 90 | 2349.86 | Li, Ke; Li, Mao-Lin; Zhang, Qi; Zhu, Shou-Fei; Zhou, Qi-Lin Highly Enantioselective Nickel-Catalyzed Intramolecular Hydroalkenylation of N- and O-Tethered 1,6-Dienes To Form Six-Membered Heterocycles. Journal of the American Chemical Society, 2018, 140, 7458-7461 |
| 4132535 | CIF | C13 H14 O3 | P 1 21 1 | 5.88468; 24.088; 11.56387 90; 92.8518; 90 | 1637.15 | Li, Ke; Li, Mao-Lin; Zhang, Qi; Zhu, Shou-Fei; Zhou, Qi-Lin Highly Enantioselective Nickel-Catalyzed Intramolecular Hydroalkenylation of N- and O-Tethered 1,6-Dienes To Form Six-Membered Heterocycles. Journal of the American Chemical Society, 2018, 140, 7458-7461 |
| 4132536 | CIF | C19 H21 N O2 S | P 1 21 1 | 5.6458; 26.6994; 6.107 90; 115.687; 90 | 829.59 | Li, Ke; Li, Mao-Lin; Zhang, Qi; Zhu, Shou-Fei; Zhou, Qi-Lin Highly Enantioselective Nickel-Catalyzed Intramolecular Hydroalkenylation of N- and O-Tethered 1,6-Dienes To Form Six-Membered Heterocycles. Journal of the American Chemical Society, 2018, 140, 7458-7461 |
| 4132537 | CIF | C23 H24 Cl O4 P Pd | P -1 | 8.9395; 9.5963; 14.4751 104.785; 100.092; 106.757 | 1107.37 | Zhang, Wei; Waddell, Peter M.; Tiedemann, Margaret A.; Padilla, Christian E.; Mei, Jiajun; Chen, Liye; Carrow, Brad P. Electron-Rich Metal Cations Enable Synthesis of High Molecular Weight, Linear Functional Polyethylenes. Journal of the American Chemical Society, 2018, 140, 8841-8850 |
| 4132538 | CIF | C25 H31 Cl O5 P2 Pd | P 1 21/n 1 | 8.8242; 18.5471; 16.3705 90; 103.122; 90 | 2609.29 | Zhang, Wei; Waddell, Peter M.; Tiedemann, Margaret A.; Padilla, Christian E.; Mei, Jiajun; Chen, Liye; Carrow, Brad P. Electron-Rich Metal Cations Enable Synthesis of High Molecular Weight, Linear Functional Polyethylenes. Journal of the American Chemical Society, 2018, 140, 8841-8850 |
| 4132539 | CIF | C29 H39 Cl O3 P2 Pd | P 21 21 21 | 10.2642; 15.4645; 18.4446 90; 90; 90 | 2927.72 | Zhang, Wei; Waddell, Peter M.; Tiedemann, Margaret A.; Padilla, Christian E.; Mei, Jiajun; Chen, Liye; Carrow, Brad P. Electron-Rich Metal Cations Enable Synthesis of High Molecular Weight, Linear Functional Polyethylenes. Journal of the American Chemical Society, 2018, 140, 8841-8850 |
| 4132540 | CIF | C33 H49 Cl N2 O3 P2 Pd | P 1 21/n 1 | 9.6631; 21.6925; 17.1226 90; 105.858; 90 | 3452.6 | Zhang, Wei; Waddell, Peter M.; Tiedemann, Margaret A.; Padilla, Christian E.; Mei, Jiajun; Chen, Liye; Carrow, Brad P. Electron-Rich Metal Cations Enable Synthesis of High Molecular Weight, Linear Functional Polyethylenes. Journal of the American Chemical Society, 2018, 140, 8841-8850 |
| 4132541 | CIF | C28 H37 Cl N O4 P Pd | P 1 21/c 1 | 8.7229; 15.938; 20.9835 90; 98.316; 90 | 2886.6 | Zhang, Wei; Waddell, Peter M.; Tiedemann, Margaret A.; Padilla, Christian E.; Mei, Jiajun; Chen, Liye; Carrow, Brad P. Electron-Rich Metal Cations Enable Synthesis of High Molecular Weight, Linear Functional Polyethylenes. Journal of the American Chemical Society, 2018, 140, 8841-8850 |
| 4132542 | CIF | C80 H66 N12 O40 Tb6 | F d -3 m :2 | 38.985; 38.985; 38.985 90; 90; 90 | 59251 | Jiang, Hao; Jia, Jiangtao; Shkurenko, Aleksander; Chen, Zhijie; Adil, Karim; Belmabkhout, Youssef; Weselinski, Lukasz J.; Assen, Ayalew H.; Xue, Dong-Xu; O'Keeffe, Michael; Eddaoudi, Mohamed Enriching the Reticular Chemistry Repertoire: Merged Nets Approach for the Rational Design of Intricate Mixed-Linker Metal-Organic Framework Platforms. Journal of the American Chemical Society, 2018, 140, 8858-8867 |
| 4132543 | CIF | C178 H138 N8 O38 Tb6 | I 41 | 39.74; 39.74; 56.261 90; 90; 90 | 88851 | Jiang, Hao; Jia, Jiangtao; Shkurenko, Aleksander; Chen, Zhijie; Adil, Karim; Belmabkhout, Youssef; Weselinski, Lukasz J.; Assen, Ayalew H.; Xue, Dong-Xu; O'Keeffe, Michael; Eddaoudi, Mohamed Enriching the Reticular Chemistry Repertoire: Merged Nets Approach for the Rational Design of Intricate Mixed-Linker Metal-Organic Framework Platforms. Journal of the American Chemical Society, 2018, 140, 8858-8867 |
| 4132544 | CIF | C136 H120 N8 O38 S6 Tb6 | F d -3 m :2 | 46.0411; 46.0411; 46.0411 90; 90; 90 | 97597.1 | Jiang, Hao; Jia, Jiangtao; Shkurenko, Aleksander; Chen, Zhijie; Adil, Karim; Belmabkhout, Youssef; Weselinski, Lukasz J.; Assen, Ayalew H.; Xue, Dong-Xu; O'Keeffe, Michael; Eddaoudi, Mohamed Enriching the Reticular Chemistry Repertoire: Merged Nets Approach for the Rational Design of Intricate Mixed-Linker Metal-Organic Framework Platforms. Journal of the American Chemical Society, 2018, 140, 8858-8867 |
| 4132545 | CIF | C62 H54 F6 N6 O34 Tb6 | F d -3 m :2 | 38.309; 38.309; 38.309 90; 90; 90 | 56222 | Jiang, Hao; Jia, Jiangtao; Shkurenko, Aleksander; Chen, Zhijie; Adil, Karim; Belmabkhout, Youssef; Weselinski, Lukasz J.; Assen, Ayalew H.; Xue, Dong-Xu; O'Keeffe, Michael; Eddaoudi, Mohamed Enriching the Reticular Chemistry Repertoire: Merged Nets Approach for the Rational Design of Intricate Mixed-Linker Metal-Organic Framework Platforms. Journal of the American Chemical Society, 2018, 140, 8858-8867 |
| 4132546 | CIF | C134.73 H109.04 N5.58 O35.58 S6 Tb6 | F d -3 :2 | 45.6614; 45.6614; 45.6614 90; 90; 90 | 95202.4 | Jiang, Hao; Jia, Jiangtao; Shkurenko, Aleksander; Chen, Zhijie; Adil, Karim; Belmabkhout, Youssef; Weselinski, Lukasz J.; Assen, Ayalew H.; Xue, Dong-Xu; O'Keeffe, Michael; Eddaoudi, Mohamed Enriching the Reticular Chemistry Repertoire: Merged Nets Approach for the Rational Design of Intricate Mixed-Linker Metal-Organic Framework Platforms. Journal of the American Chemical Society, 2018, 140, 8858-8867 |
| 4132547 | CIF | C34 H30 Br N2 O P | P 21 21 21 | 14.4874; 19.8805; 20.6103 90; 90; 90 | 5936.11 | Shao, Xinxin; Li, Kangnan; Malcolmson, Steven J. Enantioselective Synthesis of anti-1,2-Diamines by Cu-Catalyzed Reductive Couplings of Azadienes with Aldimines and Ketimines. Journal of the American Chemical Society, 2018, 140, 7083-7087 |
| 4132548 | CIF | C39.75 H26 Cl2.5 N2 O4 | C 1 2/c 1 | 9.1525; 12.9741; 27.813 90; 95.477; 90 | 3287.6 | Wu, Kailong; Zhang, Tao; Wang, Zian; Wang, Lian; Zhan, Lisi; Gong, Shaolong; Zhong, Cheng; Lu, Zheng-Hong; Zhang, Song; Yang, Chuluo De Novo Design of Excited-State Intramolecular Proton Transfer Emitters via a Thermally Activated Delayed Fluorescence Channel. Journal of the American Chemical Society, 2018, 140, 8877-8886 |
| 4132549 | CIF | C41 H30 N2 O4 | C 1 2/c 1 | 12.253; 13.695; 18.695 90; 102.729; 90 | 3060 | Wu, Kailong; Zhang, Tao; Wang, Zian; Wang, Lian; Zhan, Lisi; Gong, Shaolong; Zhong, Cheng; Lu, Zheng-Hong; Zhang, Song; Yang, Chuluo De Novo Design of Excited-State Intramolecular Proton Transfer Emitters via a Thermally Activated Delayed Fluorescence Channel. Journal of the American Chemical Society, 2018, 140, 8877-8886 |
| 4132550 | CIF | C40 H78 Cl3 Dy O4 P2 | P 21 21 21 | 15.4; 15.3943; 19.6252 90; 90; 90 | 4652.6 | Wang, Yu-Xia; Ma, Yinina; Chai, Yisheng; Shi, Wei; Sun, Young; Cheng, Peng Observation of Magnetodielectric Effect in a Dysprosium-Based Single-Molecule Magnet. Journal of the American Chemical Society, 2018, 140, 7795-7798 |
| 4132551 | CIF | C98 H162 Fe2 K2 N6 O20 | C 1 2/m 1 | 20.2963; 17.9161; 15.4636 90; 108.659; 90 | 5327.5 | McWilliams, Sean F.; Bill, Eckhard; Lukat-Rodgers, Gudrun; Rodgers, Kenton R.; Mercado, Brandon Q.; Holland, Patrick L. Effects of N<sub>2</sub> Binding Mode on Iron-Based Functionalization of Dinitrogen to Form an Iron(III) Hydrazido Complex. Journal of the American Chemical Society, 2018, 140, 8586-8598 |
| 4132552 | CIF | C49 H85 Fe K N6 O8 | P 1 21/n 1 | 21.4377; 21.1501; 26.26 90; 111.839; 90 | 11052 | McWilliams, Sean F.; Bill, Eckhard; Lukat-Rodgers, Gudrun; Rodgers, Kenton R.; Mercado, Brandon Q.; Holland, Patrick L. Effects of N<sub>2</sub> Binding Mode on Iron-Based Functionalization of Dinitrogen to Form an Iron(III) Hydrazido Complex. Journal of the American Chemical Society, 2018, 140, 8586-8598 |
| 4132553 | CIF | C35 H59 Fe N4 Si2 | P 1 21/c 1 | 21.1375; 20.4561; 18.855 90; 113.643; 90 | 7468.4 | McWilliams, Sean F.; Bill, Eckhard; Lukat-Rodgers, Gudrun; Rodgers, Kenton R.; Mercado, Brandon Q.; Holland, Patrick L. Effects of N<sub>2</sub> Binding Mode on Iron-Based Functionalization of Dinitrogen to Form an Iron(III) Hydrazido Complex. Journal of the American Chemical Society, 2018, 140, 8586-8598 |
| 4132554 | CIF | C41 H65 Fe I2 K N2 O6 | C 1 2/c 1 | 22.9536; 12.6698; 33.869 90; 106.622; 90 | 9438.1 | McWilliams, Sean F.; Bill, Eckhard; Lukat-Rodgers, Gudrun; Rodgers, Kenton R.; Mercado, Brandon Q.; Holland, Patrick L. Effects of N<sub>2</sub> Binding Mode on Iron-Based Functionalization of Dinitrogen to Form an Iron(III) Hydrazido Complex. Journal of the American Chemical Society, 2018, 140, 8586-8598 |
| 4132555 | CIF | C55 H91 Fe K N2 O8 | P 1 21/n 1 | 17.543; 16.6901; 20.3235 90; 107.336; 90 | 5680.3 | McWilliams, Sean F.; Bill, Eckhard; Lukat-Rodgers, Gudrun; Rodgers, Kenton R.; Mercado, Brandon Q.; Holland, Patrick L. Effects of N<sub>2</sub> Binding Mode on Iron-Based Functionalization of Dinitrogen to Form an Iron(III) Hydrazido Complex. Journal of the American Chemical Society, 2018, 140, 8586-8598 |
| 4132556 | CIF | C41 H32 Ir N3 O | P -1 | 8.441; 11.844; 16.46 96.665; 100.755; 103.614 | 1549 | Lai, Po-Ni; Brysacz, Caroline H.; Alam, Md Kamrul; Ayoub, Nicholas A.; Gray, Thomas G.; Bao, Jiming; Teets, Thomas S. Highly Efficient Red-Emitting Bis-Cyclometalated Iridium Complexes. Journal of the American Chemical Society, 2018, 140, 10198-10207 |
| 4132557 | CIF | C39 H32 Cl4 Ir N3 O S2 | P 1 21/c 1 | 12.9276; 24.1615; 13.3586 90; 116.226; 90 | 3743 | Lai, Po-Ni; Brysacz, Caroline H.; Alam, Md Kamrul; Ayoub, Nicholas A.; Gray, Thomas G.; Bao, Jiming; Teets, Thomas S. Highly Efficient Red-Emitting Bis-Cyclometalated Iridium Complexes. Journal of the American Chemical Society, 2018, 140, 10198-10207 |
| 4132558 | CIF | C40 H37 Cl2 Ir N4 S2 | C 1 2/c 1 | 13.2791; 21.2737; 13.2932 90; 102.215; 90 | 3670.3 | Lai, Po-Ni; Brysacz, Caroline H.; Alam, Md Kamrul; Ayoub, Nicholas A.; Gray, Thomas G.; Bao, Jiming; Teets, Thomas S. Highly Efficient Red-Emitting Bis-Cyclometalated Iridium Complexes. Journal of the American Chemical Society, 2018, 140, 10198-10207 |
| 4132559 | CIF | C46 H59 Cr N2 P Si | P c a 21 | 17.0985; 13.5512; 21.4178 90; 90; 90 | 4962.6 | Wu, Pengcheng; Yap, Glenn P. A.; Theopold, Klaus H. Structure and Reactivity of Chromium(VI) Alkylidenes. Journal of the American Chemical Society, 2018, 140, 7088-7091 |
| 4132560 | CIF | C32 H56 Cr N2 Si2 | P 1 21/n 1 | 11.0281; 16.9697; 19.3066 90; 101.422; 90 | 3541.5 | Wu, Pengcheng; Yap, Glenn P. A.; Theopold, Klaus H. Structure and Reactivity of Chromium(VI) Alkylidenes. Journal of the American Chemical Society, 2018, 140, 7088-7091 |
| 4132561 | CIF | C38 H47 Cr N2 | P 21 21 21 | 9.8933; 17.768; 19.173 90; 90; 90 | 3370.3 | Wu, Pengcheng; Yap, Glenn P. A.; Theopold, Klaus H. Structure and Reactivity of Chromium(VI) Alkylidenes. Journal of the American Chemical Society, 2018, 140, 7088-7091 |
| 4132562 | CIF | C52 H71 Cr N2 P | P 21 21 21 | 12.4593; 12.8057; 30.868 90; 90; 90 | 4925 | Wu, Pengcheng; Yap, Glenn P. A.; Theopold, Klaus H. Structure and Reactivity of Chromium(VI) Alkylidenes. Journal of the American Chemical Society, 2018, 140, 7088-7091 |
| 4132563 | CIF | C34 H52 Cr N2 | P -1 | 9.9722; 11.1746; 17.0474 72.227; 74.053; 65.581 | 1622.84 | Wu, Pengcheng; Yap, Glenn P. A.; Theopold, Klaus H. Structure and Reactivity of Chromium(VI) Alkylidenes. Journal of the American Chemical Society, 2018, 140, 7088-7091 |
| 4132564 | CIF | C72 H48 N12 Ni3 O32 Zr6 | F m -3 m | 29.365; 29.365; 29.365 90; 90; 90 | 25321.5 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132565 | CIF | C72 H48 N12 O32 Pd3 Zr6 | F m -3 m | 29.482; 29.482; 29.482 90; 90; 90 | 25625.4 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132566 | CIF | C20 H34 Cl2 N2 Ni O8 S4 | P -1 | 7.1382; 10.4292; 10.7797 73.312; 82.332; 75.812 | 743.54 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132567 | CIF | C12 H16 N2 Ni O8 | P -1 | 6.2763; 6.8351; 9.243 96.319; 105.067; 113.408 | 341.04 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132568 | CIF | C16 H22 Cl2 N2 O6 Pd S2 | P -1 | 5.5954; 8.3386; 12.7456 99.2697; 101.056; 98.754 | 565.64 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132569 | CIF | C20 H34 Cl2 Cu N2 O8 S4 | P -1 | 7.0833; 10.3708; 10.9549 71.8866; 83.9415; 76.9365 | 744.53 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132570 | CIF | C12 H14 Cu N2 O8 | P -1 | 6.2994; 6.7911; 9.1637 98.9958; 105.053; 108.698 | 346.07 | Yuan, Shuai; Zhang, Peng; Zhang, Liangliang; Garcia-Esparza, Angel T; Sokaras, Dimosthenis; Qin, Jun-Sheng; Feng, Liang; Day, Gregory S.; Chen, Wenmiao; Drake, Hannah F.; Elumalai, Palani; Madrahimov, Sherzod T.; Sun, Daofeng; Zhou, Hong-Cai Exposed Equatorial Positions of Metal Centers via Sequential Ligand Elimination and Installation in MOFs. Journal of the American Chemical Society, 2018, 140, 10814-10819 |
| 4132571 | CIF | C16 H26 O2 | P 1 21/c 1 | 17.2768; 7.2505; 11.1446 90; 96.356; 90 | 1387.45 | Merchant, Rohan R.; Oberg, Kevin M.; Lin, Yutong; Novak, Alexander J. E.; Felding, Jakob; Baran, Phil S. Divergent Synthesis of Pyrone Diterpenes via Radical Cross Coupling. Journal of the American Chemical Society, 2018, 140, 7462-7465 |
| 4132572 | CIF | C33 H25 B F2 N4 | P 1 21/n 1 | 6.8589; 18.4294; 20.7665 90; 94.9492; 90 | 2615.2 | Zhou, Jiong; Zhang, Yuzhen; Yu, Guocan; Crawley, Matthew R.; Fulong, Cressa Ria P.; Friedman, Alan E.; Sengupta, Sanghamitra; Sun, Jifu; Li, Qing; Huang, Feihe; Cook, Timothy R. Highly Emissive Self-Assembled BODIPY-Platinum Supramolecular Triangles. Journal of the American Chemical Society, 2018, 140, 7730-7736 |
| 4132573 | CIF | C19 H17 B F2 I2 N2 | P 1 21/n 1 | 11.4365; 12.9084; 13.2216 90; 90.809; 90 | 1951.67 | Zhou, Jiong; Zhang, Yuzhen; Yu, Guocan; Crawley, Matthew R.; Fulong, Cressa Ria P.; Friedman, Alan E.; Sengupta, Sanghamitra; Sun, Jifu; Li, Qing; Huang, Feihe; Cook, Timothy R. Highly Emissive Self-Assembled BODIPY-Platinum Supramolecular Triangles. Journal of the American Chemical Society, 2018, 140, 7730-7736 |
| 4132574 | CIF | C29 H37 N2 O2 P | P 1 21/c 1 | 15.8551; 10.844; 15.1961 90; 100.17; 90 | 2571.7 | Liu, Liu Leo; Zhou, Jiliang; Andrews, Ryan; Stephan, Douglas W. A Room-Temperature-Stable Phosphanorcaradiene. Journal of the American Chemical Society, 2018, 140, 7466-7470 |
| 4132575 | CIF | C43 H45 N2 O4 P | P -1 | 9.8219; 13.2831; 14.8369 99.452; 103.114; 95.605 | 1841.2 | Liu, Liu Leo; Zhou, Jiliang; Andrews, Ryan; Stephan, Douglas W. A Room-Temperature-Stable Phosphanorcaradiene. Journal of the American Chemical Society, 2018, 140, 7466-7470 |
| 4132576 | CIF | C22 H39.5 Cl0.5 F3 N2 O3 S Si | P 1 21/c 1 | 9.2238; 17.261; 17.5861 90; 98.018; 90 | 2772.5 | Liu, Liu Leo; Zhou, Jiliang; Andrews, Ryan; Stephan, Douglas W. A Room-Temperature-Stable Phosphanorcaradiene. Journal of the American Chemical Society, 2018, 140, 7466-7470 |
| 4132577 | CIF | C15 H31 B N2 | F d d 2 | 19.068; 21.572; 8.1409 90; 90; 90 | 3348.6 | Liu, Liu Leo; Zhou, Jiliang; Andrews, Ryan; Stephan, Douglas W. A Room-Temperature-Stable Phosphanorcaradiene. Journal of the American Chemical Society, 2018, 140, 7466-7470 |
| 4132578 | CIF | C28 H36 Cl8 N4 Ru | P 1 21/c 1 | 15.255; 13.69; 16.939 90; 104.621; 90 | 3423 | Dutta, Indranil; Yadav, Sudhir; Sarbajna, Abir; De, Subhabrata; Hölscher, Markus; Leitner, Walter; Bera, Jitendra K. Double Dehydrogenation of Primary Amines to Nitriles by a Ruthenium Complex Featuring Pyrazole Functionality. Journal of the American Chemical Society, 2018, 140, 8662-8666 |
| 4132579 | CIF | C26 H32 Cl2 N4 Ru | P 1 21/c 1 | 10.3321; 15.1479; 17.801 90; 105.534; 90 | 2684.3 | Dutta, Indranil; Yadav, Sudhir; Sarbajna, Abir; De, Subhabrata; Hölscher, Markus; Leitner, Walter; Bera, Jitendra K. Double Dehydrogenation of Primary Amines to Nitriles by a Ruthenium Complex Featuring Pyrazole Functionality. Journal of the American Chemical Society, 2018, 140, 8662-8666 |
| 4132580 | CIF | C26 H31 Cl3 N4 Ru | P 1 21/n 1 | 15.5162; 11.1368; 17.7144 90; 114.52; 90 | 2785 | Dutta, Indranil; Yadav, Sudhir; Sarbajna, Abir; De, Subhabrata; Hölscher, Markus; Leitner, Walter; Bera, Jitendra K. Double Dehydrogenation of Primary Amines to Nitriles by a Ruthenium Complex Featuring Pyrazole Functionality. Journal of the American Chemical Society, 2018, 140, 8662-8666 |
| 4132581 | CIF | C22 H29 Cl2 N3 Ru | P n a 21 | 19.27; 9.9659; 11.8072 90; 90; 90 | 2267.5 | Dutta, Indranil; Yadav, Sudhir; Sarbajna, Abir; De, Subhabrata; Hölscher, Markus; Leitner, Walter; Bera, Jitendra K. Double Dehydrogenation of Primary Amines to Nitriles by a Ruthenium Complex Featuring Pyrazole Functionality. Journal of the American Chemical Society, 2018, 140, 8662-8666 |
| 4132582 | CIF | C55 H83 Co K2 N O2 | C 1 2/c 1 | 46.323; 12.1188; 24.6506 90; 121.309; 90 | 11823.2 | Mokhtarzadeh, Charles C.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. A Highly-Reduced Cobalt Terminal Carbyne: Divergent Metal- and α-Carbon-Centered Reactivity. Journal of the American Chemical Society, 2018, 140, 8100-8104 |
| 4132583 | CIF | C65 H85 Co K N O | P -1 | 11.4478; 12.1071; 21.3849 82.679; 86.994; 81.566 | 2906.3 | Mokhtarzadeh, Charles C.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. A Highly-Reduced Cobalt Terminal Carbyne: Divergent Metal- and α-Carbon-Centered Reactivity. Journal of the American Chemical Society, 2018, 140, 8100-8104 |
| 4132584 | CIF | C47 H64 Co I2 N | P c a 21 | 23.0483; 14.029; 27.3737 90; 90; 90 | 8851.1 | Mokhtarzadeh, Charles C.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. A Highly-Reduced Cobalt Terminal Carbyne: Divergent Metal- and α-Carbon-Centered Reactivity. Journal of the American Chemical Society, 2018, 140, 8100-8104 |
| 4132585 | CIF | C51 H75 Co K N O | P 1 21/c 1 | 11.1895; 42.067; 10.8206 90; 108.693; 90 | 4824.7 | Mokhtarzadeh, Charles C.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. A Highly-Reduced Cobalt Terminal Carbyne: Divergent Metal- and α-Carbon-Centered Reactivity. Journal of the American Chemical Society, 2018, 140, 8100-8104 |
| 4132586 | CIF | C59 H86 Co K N O Si | P -1 | 12.4898; 12.5227; 20.6102 93.054; 104.868; 110.926 | 2872.39 | Mokhtarzadeh, Charles C.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. A Highly-Reduced Cobalt Terminal Carbyne: Divergent Metal- and α-Carbon-Centered Reactivity. Journal of the American Chemical Society, 2018, 140, 8100-8104 |
| 4132587 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.8607; 14.8607; 6.7012 90; 90; 120 | 1281.63 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132588 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.9319; 14.9319; 6.7338 90; 90; 120 | 1300.23 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132589 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.7885; 14.7885; 6.6738 90; 90; 120 | 1264.01 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132590 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.6822; 14.6822; 6.6323 90; 90; 120 | 1238.16 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132591 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.8806; 14.8806; 6.7146 90; 90; 120 | 1287.63 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132592 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.747; 14.747; 6.6608 90; 90; 120 | 1254.48 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132593 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 15.0014; 15.0014; 6.7669 90; 90; 120 | 1318.82 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
| 4132594 | CIF | C27 H39 Br O6 Si | P -1 | 9.0108; 10.7633; 16.4963 75.572; 76.098; 66.854 | 1406.42 | Kou, Kevin G. M.; Pflueger, Jason J.; Kiho, Toshihiro; Morrill, Louis C.; Fisher, Ethan L.; Clagg, Kyle; Lebold, Terry P.; Kisunzu, Jessica K.; Sarpong, Richmond A Benzyne Insertion Approach to Hetisine-Type Diterpenoid Alkaloids: Synthesis of Cossonidine (Davisine). Journal of the American Chemical Society, 2018, 140, 8105-8109 |
| 4132595 | CIF | C20 H26 Cl3 N O2 | P 21 21 21 | 10.7865; 12.1566; 14.757 90; 90; 90 | 1935.04 | Kou, Kevin G. M.; Pflueger, Jason J.; Kiho, Toshihiro; Morrill, Louis C.; Fisher, Ethan L.; Clagg, Kyle; Lebold, Terry P.; Kisunzu, Jessica K.; Sarpong, Richmond A Benzyne Insertion Approach to Hetisine-Type Diterpenoid Alkaloids: Synthesis of Cossonidine (Davisine). Journal of the American Chemical Society, 2018, 140, 8105-8109 |
| 4132596 | CIF | C57 H48 Cl7 Cu Fe N2 O2 | P 21 21 21 | 15.6465; 16.924; 19.6011 90; 90; 90 | 5190.4 | Schwamb, C. Benjamin; Fitzpatrick, Keegan P.; Brueckner, Alexander C.; Richardson, H. Camille; Cheong, Paul H.-Y.; Scheidt, Karl A. Enantioselective Synthesis of α-Amidoboronates Catalyzed by Planar-Chiral NHC-Cu(I) Complexes. Journal of the American Chemical Society, 2018, 140, 10644-10648 |
| 4132597 | CIF | C34 H34 Cl Cu Fe N2 O | P 1 2 1 | 18.3929; 9.5949; 18.9878 90; 96.359; 90 | 3330.3 | Schwamb, C. Benjamin; Fitzpatrick, Keegan P.; Brueckner, Alexander C.; Richardson, H. Camille; Cheong, Paul H.-Y.; Scheidt, Karl A. Enantioselective Synthesis of α-Amidoboronates Catalyzed by Planar-Chiral NHC-Cu(I) Complexes. Journal of the American Chemical Society, 2018, 140, 10644-10648 |
| 4132598 | CIF | C29 H32 Cl Cu Fe N2 O2 | P 21 21 21 | 11.4799; 15.0428; 15.3127 90; 90; 90 | 2644.3 | Schwamb, C. Benjamin; Fitzpatrick, Keegan P.; Brueckner, Alexander C.; Richardson, H. Camille; Cheong, Paul H.-Y.; Scheidt, Karl A. Enantioselective Synthesis of α-Amidoboronates Catalyzed by Planar-Chiral NHC-Cu(I) Complexes. Journal of the American Chemical Society, 2018, 140, 10644-10648 |
| 4132599 | CIF | C35 H46 B N3 O5 | P 1 21 1 | 10.9592; 9.3307; 16.2386 90; 91.805; 90 | 1659.7 | Schwamb, C. Benjamin; Fitzpatrick, Keegan P.; Brueckner, Alexander C.; Richardson, H. Camille; Cheong, Paul H.-Y.; Scheidt, Karl A. Enantioselective Synthesis of α-Amidoboronates Catalyzed by Planar-Chiral NHC-Cu(I) Complexes. Journal of the American Chemical Society, 2018, 140, 10644-10648 |
| 4132600 | CIF | C70.77 H59.54 N2 O15 Yb2 | P -1 | 16.6368; 18.0871; 19.3244 84.612; 80.119; 64.846 | 5184 | Collet, Guillaume; Lathion, Timothée; Besnard, Céline; Piguet, Claude; Petoud, Stéphane On-Demand Degradation of Metal-Organic Framework Based on Photocleavable Dianthracene-Based Ligand. Journal of the American Chemical Society, 2018, 140, 10820-10828 |
| 4132601 | CIF | C34 H32 O6 S2 | P 1 21/n 1 | 10.4209; 7.9301; 18.7758 90; 104.06; 90 | 1505.13 | Collet, Guillaume; Lathion, Timothée; Besnard, Céline; Piguet, Claude; Petoud, Stéphane On-Demand Degradation of Metal-Organic Framework Based on Photocleavable Dianthracene-Based Ligand. Journal of the American Chemical Society, 2018, 140, 10820-10828 |
| 4132602 | CIF | C38 H38 N2 O6 | P -1 | 9.2901; 13.6758; 14.4243 66.913; 74.315; 74.609 | 1596.55 | Collet, Guillaume; Lathion, Timothée; Besnard, Céline; Piguet, Claude; Petoud, Stéphane On-Demand Degradation of Metal-Organic Framework Based on Photocleavable Dianthracene-Based Ligand. Journal of the American Chemical Society, 2018, 140, 10820-10828 |
| 4132603 | CIF | C38 H38 N2 O6 | P 1 21/c 1 | 10.6198; 12.0108; 12.5761 90; 96.716; 90 | 1593.1 | Collet, Guillaume; Lathion, Timothée; Besnard, Céline; Piguet, Claude; Petoud, Stéphane On-Demand Degradation of Metal-Organic Framework Based on Photocleavable Dianthracene-Based Ligand. Journal of the American Chemical Society, 2018, 140, 10820-10828 |
| 4132604 | CIF | C13 H17.5 N0.5 O2 | P 1 21 1 | 12.9712; 7.0406; 13.2586 90; 102.884; 90 | 1180.36 | Kapoor, Mohit; Liu, Daniel; Young, Michael C. Carbon Dioxide-Mediated C(sp<sup>3</sup>)-H Arylation of Amine Substrates. Journal of the American Chemical Society, 2018, 140, 6818-6822 |
| 4132605 | CIF | C450.5 H382.5 B16 F88 Fe8 N76 | P 1 21/c 1 | 43.0969; 37.9996; 36.5407 90; 110.741; 90 | 55963.2 | Roberts, Derrick A.; Pilgrim, Ben S.; Sirvinskaite, Giedre; Ronson, Tanya K.; Nitschke, Jonathan R. Covalent Post-assembly Modification Triggers Multiple Structural Transformations of a Tetrazine-Edged Fe<sub>4</sub>L<sub>6</sub> Tetrahedron. Journal of the American Chemical Society, 2018, 140, 9616-9623 |
| 4132606 | CIF | C640 H639 F138 Fe8 N86 P19 | C 1 2/c 1 | 49.486; 28.207; 48.662 90; 96.856; 90 | 67439 | Roberts, Derrick A.; Pilgrim, Ben S.; Sirvinskaite, Giedre; Ronson, Tanya K.; Nitschke, Jonathan R. Covalent Post-assembly Modification Triggers Multiple Structural Transformations of a Tetrazine-Edged Fe<sub>4</sub>L<sub>6</sub> Tetrahedron. Journal of the American Chemical Society, 2018, 140, 9616-9623 |
| 4132607 | CIF | C490 H507 F108 Fe8 N75 O24 P18 | C 1 2/c 1 | 36.2842; 36.3797; 49.0016 90; 95.956; 90 | 64333 | Roberts, Derrick A.; Pilgrim, Ben S.; Sirvinskaite, Giedre; Ronson, Tanya K.; Nitschke, Jonathan R. Covalent Post-assembly Modification Triggers Multiple Structural Transformations of a Tetrazine-Edged Fe<sub>4</sub>L<sub>6</sub> Tetrahedron. Journal of the American Chemical Society, 2018, 140, 9616-9623 |
| 4132608 | CIF | C18 H14 Fe O7 | P 21 21 21 | 6.9433; 11.2978; 22.534 90; 90; 90 | 1767.7 | Zhuo, Chun-Xiang; Fürstner, Alois Catalysis-Based Total Syntheses of Pateamine A and DMDA-Pat A. Journal of the American Chemical Society, 2018, 140, 10514-10523 |
| 4132609 | CIF | C20 H27 N O6 | P 1 21/c 1 | 9.816; 18.649; 11.003 90; 98.09; 90 | 1994.1 | Kerkovius, Jeff K.; Kerr, Michael A. Total Synthesis of Isodihydrokoumine, (19 Z)-Taberpsychine, and (4 R)-Isodihydroukoumine N<sub>4</sub>-Oxide. Journal of the American Chemical Society, 2018, 140, 8415-8419 |
| 4132610 | CIF | C72 H60 Ag2 N6 P4 | P -1 | 9.9399; 13.1293; 13.1412 114.292; 101.059; 90.719 | 1526.07 | Yang, Chen; Zhang, Chong; Zheng, Zhansheng; Jiang, Chao; Luo, Jun; Du, Yang; Hu, Bingcheng; Sun, Chengguo; Christe, Karl O. Synthesis and Characterization of cyclo-Pentazolate Salts of NH<sub>4</sub><sup>+</sup>, NH<sub>3</sub>OH<sup>+</sup>, N<sub>2</sub>H<sub>5</sub><sup>+</sup>, C(NH<sub>2</sub>)<sub>3</sub><sup>+</sup>, and N(CH<sub>3</sub>)<sub>4</sub><sup/>. Journal of the American Chemical Society, 2018, 140, 16488-16494 |
| 4132611 | CIF | C6 H6 Ag2 N4 | P 21 21 21 | 22.291; 5.553; 6.631 90; 90; 90 | 820.8 | Yang, Chen; Zhang, Chong; Zheng, Zhansheng; Jiang, Chao; Luo, Jun; Du, Yang; Hu, Bingcheng; Sun, Chengguo; Christe, Karl O. Synthesis and Characterization of cyclo-Pentazolate Salts of NH<sub>4</sub><sup>+</sup>, NH<sub>3</sub>OH<sup>+</sup>, N<sub>2</sub>H<sub>5</sub><sup>+</sup>, C(NH<sub>2</sub>)<sub>3</sub><sup>+</sup>, and N(CH<sub>3</sub>)<sub>4</sub><sup/>. Journal of the American Chemical Society, 2018, 140, 16488-16494 |
| 4132612 | CIF | C94 H53.6 O33.7 V1.1 Zr6 | P 6/m m m | 39.554; 39.554; 16.43 90; 90; 120 | 22261 | Otake, Ken-Ichi; Cui, Yuexing; Buru, Cassandra T.; Li, Zhanyong; Hupp, Joseph T.; Farha, Omar K. Single-Atom-Based Vanadium Oxide Catalysts Supported on Metal-Organic Frameworks: Selective Alcohol Oxidation and Structure-Activity Relationship. Journal of the American Chemical Society, 2018, 140, 8652-8656 |
| 4132613 | CIF | C18 H6 Hf6 O33.1 V1.5 | F d -3 m :2 | 34.9765; 34.9765; 34.9765 90; 90; 90 | 42789 | Otake, Ken-Ichi; Cui, Yuexing; Buru, Cassandra T.; Li, Zhanyong; Hupp, Joseph T.; Farha, Omar K. Single-Atom-Based Vanadium Oxide Catalysts Supported on Metal-Organic Frameworks: Selective Alcohol Oxidation and Structure-Activity Relationship. Journal of the American Chemical Society, 2018, 140, 8652-8656 |
| 4132614 | CIF | C18 H6 Hf6 O34.4 V1.44 | F d -3 m :2 | 34.893; 34.893; 34.893 90; 90; 90 | 42483 | Otake, Ken-Ichi; Cui, Yuexing; Buru, Cassandra T.; Li, Zhanyong; Hupp, Joseph T.; Farha, Omar K. Single-Atom-Based Vanadium Oxide Catalysts Supported on Metal-Organic Frameworks: Selective Alcohol Oxidation and Structure-Activity Relationship. Journal of the American Chemical Society, 2018, 140, 8652-8656 |
| 4132615 | CIF | C27 H23 Cl Co F12 N5 P2 | C 1 2/c 1 | 22.0129; 17.2789; 17.2384 90; 115.933; 90 | 5896.5 | Wang, Ping; Liang, Guangchao; Reddy, M. Ramana; Long, Melissa; Driskill, Kandria; Lyons, Christian; Donnadieu, Bruno; Bollinger, John C.; Webster, Charles Edwin; Zhao, Xuan Electronic and Steric Tuning of Catalytic H<sub>2</sub> Evolution by Cobalt Complexes with Pentadentate Polypyridyl-Amine Ligands. Journal of the American Chemical Society, 2018, 140, 9219-9229 |
| 4132616 | CIF | C54 H57 Co2 F30 N10 O6 P5 | P 1 21/c 1 | 14.6956; 17.882; 25.751 90; 100.363; 90 | 6656.6 | Wang, Ping; Liang, Guangchao; Reddy, M. Ramana; Long, Melissa; Driskill, Kandria; Lyons, Christian; Donnadieu, Bruno; Bollinger, John C.; Webster, Charles Edwin; Zhao, Xuan Electronic and Steric Tuning of Catalytic H<sub>2</sub> Evolution by Cobalt Complexes with Pentadentate Polypyridyl-Amine Ligands. Journal of the American Chemical Society, 2018, 140, 9219-9229 |
| 4132617 | CIF | C41 H32 Cl N5 O P2 Ru | P 1 21/c 1 | 11.6372; 44.6425; 20.0826 90; 96.7742; 90 | 10360.3 | Tanushi, Akira; Radosevich, Alexander T. Insertion of a Nontrigonal Phosphorus Ligand into a Transition Metal-Hydride: Direct Access to a Metallohydrophosphorane. Journal of the American Chemical Society, 2018, 140, 8114-8118 |
| 4132618 | CIF | C41 H33 Cl4 N5 P2 Ru | P 1 21/n 1 | 11.4147; 24.3387; 13.5456 90; 92.1539; 90 | 3760.57 | Tanushi, Akira; Radosevich, Alexander T. Insertion of a Nontrigonal Phosphorus Ligand into a Transition Metal-Hydride: Direct Access to a Metallohydrophosphorane. Journal of the American Chemical Society, 2018, 140, 8114-8118 |
| 4132619 | CIF | C22 H16 N5 P | C 1 2/c 1 | 23.2935; 10.5714; 15.8503 90; 116.124; 90 | 3504.3 | Tanushi, Akira; Radosevich, Alexander T. Insertion of a Nontrigonal Phosphorus Ligand into a Transition Metal-Hydride: Direct Access to a Metallohydrophosphorane. Journal of the American Chemical Society, 2018, 140, 8114-8118 |
| 4132620 | CIF | C33 H23 B F10 S | P 1 21/c 1 | 13.644; 10.2135; 21.876 90; 100.755; 90 | 2994.9 | Fan, Louie; Jupp, Andrew R.; Stephan, Douglas W. Remote Stereochemistry of a Frustrated Lewis Pair Provides Thermal and Photochemical Control of Reactivity. Journal of the American Chemical Society, 2018, 140, 8119-8123 |
| 4132621 | CIF | C19 H13 B F10 S | I 1 2/a 1 | 19.669; 10.679; 20.378 90; 117.285; 90 | 3804.1 | Fan, Louie; Jupp, Andrew R.; Stephan, Douglas W. Remote Stereochemistry of a Frustrated Lewis Pair Provides Thermal and Photochemical Control of Reactivity. Journal of the American Chemical Society, 2018, 140, 8119-8123 |
| 4132622 | CIF | C33 H23 B F10 S | C 1 2/c 1 | 18.681; 11.4846; 28.874 90; 108.779; 90 | 5865 | Fan, Louie; Jupp, Andrew R.; Stephan, Douglas W. Remote Stereochemistry of a Frustrated Lewis Pair Provides Thermal and Photochemical Control of Reactivity. Journal of the American Chemical Society, 2018, 140, 8119-8123 |
| 4132623 | CIF | C25 H17 B F10 S | P -1 | 7.6225; 12.48; 13.343 99.233; 102.536; 98.225 | 1202 | Fan, Louie; Jupp, Andrew R.; Stephan, Douglas W. Remote Stereochemistry of a Frustrated Lewis Pair Provides Thermal and Photochemical Control of Reactivity. Journal of the American Chemical Society, 2018, 140, 8119-8123 |
| 4132624 | CIF | C28 H20 B F10 N S | P 1 21/c 1 | 9.3368; 17.8578; 16.328 90; 101.12; 90 | 2671.3 | Fan, Louie; Jupp, Andrew R.; Stephan, Douglas W. Remote Stereochemistry of a Frustrated Lewis Pair Provides Thermal and Photochemical Control of Reactivity. Journal of the American Chemical Society, 2018, 140, 8119-8123 |
| 4132625 | CIF | C30 H22 B F10 N S | P 1 21/c 1 | 10.054; 12.313; 23.109 90; 97.593; 90 | 2835.7 | Fan, Louie; Jupp, Andrew R.; Stephan, Douglas W. Remote Stereochemistry of a Frustrated Lewis Pair Provides Thermal and Photochemical Control of Reactivity. Journal of the American Chemical Society, 2018, 140, 8119-8123 |
| 4132626 | CIF | C42 H52 Ag2 Cl6 N4 S2 | P 1 21/n 1 | 14.2598; 11.7679; 15.0014 90; 106.365; 90 | 2415.37 | Doud, Evan A.; Inkpen, Michael S.; Lovat, Giacomo; Montes, Enrique; Paley, Daniel W.; Steigerwald, Michael L.; Vázquez, Héctor; Venkataraman, Latha; Roy, Xavier In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions. Journal of the American Chemical Society, 2018, 140, 8944-8949 |
| 4132627 | CIF | C20.5 H25 Cl2 Cu N2 S | P 1 21/c 1 | 12.3475; 7.5762; 23.0412 90; 104.263; 90 | 2089 | Doud, Evan A.; Inkpen, Michael S.; Lovat, Giacomo; Montes, Enrique; Paley, Daniel W.; Steigerwald, Michael L.; Vázquez, Héctor; Venkataraman, Latha; Roy, Xavier In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions. Journal of the American Chemical Society, 2018, 140, 8944-8949 |
| 4132628 | CIF | C20 H24 Au Cl N2 S | P -1 | 8.5453; 10.0951; 12.3151 104.024; 106.985; 94.21 | 973.77 | Doud, Evan A.; Inkpen, Michael S.; Lovat, Giacomo; Montes, Enrique; Paley, Daniel W.; Steigerwald, Michael L.; Vázquez, Héctor; Venkataraman, Latha; Roy, Xavier In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions. Journal of the American Chemical Society, 2018, 140, 8944-8949 |
| 4132629 | CIF | C30 H50 Au Cl O2 P2 S2 | P 1 21/c 1 | 22.3899; 17.9598; 18.6379 90; 111.629; 90 | 6966.94 | Doud, Evan A.; Inkpen, Michael S.; Lovat, Giacomo; Montes, Enrique; Paley, Daniel W.; Steigerwald, Michael L.; Vázquez, Héctor; Venkataraman, Latha; Roy, Xavier In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions. Journal of the American Chemical Society, 2018, 140, 8944-8949 |
| 4132630 | CIF | C27 H30 Au Cl3 N2 S | C 1 2/c 1 | 32.2745; 7.7536; 23.0815 90; 109.981; 90 | 5428.3 | Doud, Evan A.; Inkpen, Michael S.; Lovat, Giacomo; Montes, Enrique; Paley, Daniel W.; Steigerwald, Michael L.; Vázquez, Héctor; Venkataraman, Latha; Roy, Xavier In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions. Journal of the American Chemical Society, 2018, 140, 8944-8949 |
| 4132631 | CIF | C14 H20 Au Cl N2 S | P -1 | 9.34; 9.4284; 9.9843 80.472; 72.891; 73.52 | 802.56 | Doud, Evan A.; Inkpen, Michael S.; Lovat, Giacomo; Montes, Enrique; Paley, Daniel W.; Steigerwald, Michael L.; Vázquez, Héctor; Venkataraman, Latha; Roy, Xavier In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions. Journal of the American Chemical Society, 2018, 140, 8944-8949 |
| 4132632 | CIF | C20 H36 N2 O2 | P 1 21 1 | 17.2695; 8.4949; 21.739 90; 108.14; 90 | 3030.7 | Poremba, Kelsey E.; Kadunce, Nathaniel T.; Suzuki, Naoyuki; Cherney, Alan H.; Reisman, Sarah E. Correction to "Nickel-Catalyzed Asymmetric Reductive Cross-Coupling To Access 1,1-Diarylalkanes". Journal of the American Chemical Society, 2018, 140, 7746 |
| 4132633 | CIF | C42.7 H25.4 O32.04 Zr6 | F m -3 m | 20.7123; 20.7123; 20.7123 90; 90; 90 | 8885.6 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132634 | CIF | C132 H64 O27 Zr6 | P m -3 n | 40.561; 40.561; 40.561 90; 90; 90 | 66731 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132635 | CIF | C64.5 H41 O28.5 Zr6 | F m -3 m | 26.8422; 26.8422; 26.8422 90; 90; 90 | 19339.9 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132636 | CIF | C42.7 H25.4 O32.04 Zr6 | F m -3 m | 20.7439; 20.7439; 20.7439 90; 90; 90 | 8926.3 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132637 | CIF | C132 H64 O27 Zr6 | P m -3 n | 41.367; 41.367; 41.367 90; 90; 90 | 70788 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132638 | CIF | C64.5 H41 O28.5 Zr6 | F m -3 m | 26.684; 26.684; 26.684 90; 90; 90 | 19000 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132639 | CIF | C42.7 H25.4 O32.04 Zr6 | F m -3 m | 20.7549; 20.7549; 20.7549 90; 90; 90 | 8940.5 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132640 | CIF | C84 H52 O32 Zr6 | F m -3 m | 26.8341; 26.8341; 26.8341 90; 90; 90 | 19322 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132641 | CIF | C144 H72 O38.4 Zr7.2 | P m -3 m | 38.764; 38.764; 38.764 90; 90; 90 | 58249 | Lee, Seungkyu; Bürgi, Hans-Beat; Alshmimri, Sultan A.; Yaghi, Omar M. Impact of Disordered Guest-Framework Interactions on the Crystallography of Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 8958-8964 |
| 4132642 | CIF | C13 H36 F3 O21 S V6 | P 1 21/c 1 | 10.1551; 15.5316; 20.0248 90; 90.702; 90 | 3158.2 | Petel, Brittney E.; Brennessel, William W.; Matson, Ellen M. Oxygen-Atom Vacancy Formation at Polyoxovanadate Clusters: Homogeneous Models for Reducible Metal Oxides. Journal of the American Chemical Society, 2018, 140, 8424-8428 |
| 4132643 | CIF | C264 H252 F12 N36 P2 | R -3 :H | 33.494; 33.494; 17.224 90; 90; 120 | 16734 | Liu, Zhichang; Frasconi, Marco; Liu, Wei-Guang; Zhang, Yu; Dyar, Scott M.; Shen, Dengke; Sarjeant, Amy A.; Goddard, 3rd, William A; Wasielewski, Michael R.; Stoddart, J. Fraser Mixed-Valence Superstructure Assembled from a Mixed-Valence Host-Guest Complex. Journal of the American Chemical Society, 2018, 140, 9387-9391 |
| 4132644 | CIF | C17 H20 O6 S | C 1 c 1 | 10.983; 16.5417; 9.7709 90; 102.979; 90 | 1729.8 | Huang, Hanchu; Sun, Bohan; Huang, Yingzi; Niu, Jia Radical Cascade-Triggered Controlled Ring-Opening Polymerization of Macrocyclic Monomers. Journal of the American Chemical Society, 2018, 140, 10402-10406 |
| 4132645 | CIF | C21 H37 N Si Ti | P n m a | 10.9353; 13.4608; 14.6526 90; 90; 90 | 2156.8 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132646 | CIF | C21 H37 N Si Zr | P 1 21/c 1 | 11.1297; 13.3297; 29.346 90; 90.0065; 90 | 4353.6 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132647 | CIF | C21 H37 Hf N Si | P 1 21/c 1 | 11.0664; 13.3567; 29.381 90; 90.0186; 90 | 4342.8 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132648 | CIF | C31 H55 N3 Si Ti | P 1 21/c 1 | 19.119; 10.0925; 17.663 90; 104.751; 90 | 3295.9 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132649 | CIF | C26 H46 Hf N2 Si | P 1 21/n 1 | 9.827; 16.38; 16.788 90; 93.032; 90 | 2698.5 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132650 | CIF | C31 H55 Hf N3 Si | P -1 | 10.0272; 11.4817; 14.1819 79.88; 77.87; 86.752 | 1571.13 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132651 | CIF | C39 H55 Hf N3 Si | P -1 | 13.7387; 14.6755; 18.1687 84.7857; 77.1608; 89.5164 | 3556.6 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132652 | CIF | C39 H55 N3 Si Zr | P -1 | 13.7071; 14.6675; 18.238 84.8197; 77.1803; 89.5273 | 3560.5 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132653 | CIF | C22 H42 N2 Si Ti | C 1 2/c 1 | 42.519; 9.1392; 31.749 90; 127.762; 90 | 9753.4 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132654 | CIF | C27 H51 N3 Si Ti | P 1 21/n 1 | 10.297; 15.025; 19.462 90; 101.74; 90 | 2948 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132655 | CIF | C31 H51 N3 Si Ti | P 1 21/n 1 | 16.28; 10.6344; 18.997 90; 108.879; 90 | 3112 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132656 | CIF | C27 H51 Hf N3 Si | P b c a | 16.882; 11.9432; 30.22 90; 90; 90 | 6093.1 | Chen, Jiawei; Yassin, Nadine; Gunasekara, Thilina; Norton, Jack R.; Rauch, Michael Insertion of Isonitriles into the M-C Bonds of Group 4 Dialkyl Complexes. Journal of the American Chemical Society, 2018, 140, 8980-8989 |
| 4132657 | CIF | C26 H28 Br Cl3 N4 O3 | P 1 | 8.9983; 9.3045; 9.3473 110.886; 93.34; 100.809 | 711.5 | Chen, Si-Kai; Ma, Wen-Qiang; Yan, Zhi-Bo; Zhang, Fu-Min; Wang, Shao-Hua; Tu, Yong-Qiang; Zhang, Xiao-Ming; Tian, Jin-Miao Organo-Cation Catalyzed Asymmetric Homo/Heterodialkylation of Bisoxindoles: Construction of Vicinal All-Carbon Quaternary Stereocenters and Total Synthesis of (-)-Chimonanthidine. Journal of the American Chemical Society, 2018, 140, 10099-10103 |
| 4132658 | CIF | C32 H36 N2 O10 | P 1 | 11.494; 11.7725; 12.7954 78.086; 76.309; 77.663 | 1621.03 | Chen, Si-Kai; Ma, Wen-Qiang; Yan, Zhi-Bo; Zhang, Fu-Min; Wang, Shao-Hua; Tu, Yong-Qiang; Zhang, Xiao-Ming; Tian, Jin-Miao Organo-Cation Catalyzed Asymmetric Homo/Heterodialkylation of Bisoxindoles: Construction of Vicinal All-Carbon Quaternary Stereocenters and Total Synthesis of (-)-Chimonanthidine. Journal of the American Chemical Society, 2018, 140, 10099-10103 |
| 4132659 | CIF | C29 H34 B Fe N3 O4 | P -1 | 10.258; 10.444; 13.218 84.484; 81.981; 81.287 | 1382 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132660 | CIF | C30 H34 B Cr N3 O5 | P 1 21/n 1 | 17.203; 10.435; 17.352 90; 110.324; 90 | 2921 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132661 | CIF | C63 H76 B Cu F3 Fe N5 O7 S | P n a 21 | 19.2348; 11.0028; 29.4015 90; 90; 90 | 6222.4 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132662 | CIF | C30 H34 B N3 O5 W | P 1 21/n 1 | 17.23; 10.613; 17.382 90; 110.349; 90 | 2980.1 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132663 | CIF | C29 H34 B N3 O4 Ru | P -1 | 10.426; 10.476; 13.17 82.804; 84.581; 81.381 | 1406.8 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132664 | CIF | C50 H68 B2 Br4 N6 | P b c a | 19.425; 21.843; 25.309 90; 90; 90 | 10739 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132665 | CIF | C56 H43 B2 F15 N3 O4 Ru | P -1 | 12.069; 15.099; 16.022 74.434; 73.19; 83.7 | 2691 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132666 | CIF | C24 H41 B Br2 N2 | C 1 c 1 | 17.02; 12.696; 11.809 90; 90.977; 90 | 2551.4 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132667 | CIF | C16.67 H22.67 B0.67 N2 | P b c n | 29.725; 8.1656; 18.9301 90; 90; 90 | 4594.8 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132668 | CIF | C24 H41 B N2 | P 1 21/c 1 | 8.5109; 17.7724; 14.743 90; 98.972; 90 | 2202.7 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132669 | CIF | C26 H49 B Cl2 N2 Si2 | P 1 21/n 1 | 9.4346; 24.9229; 14.8706 90; 99.894; 90 | 3444.6 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132670 | CIF | C26 H49 B Cl N2 Si2 | P -1 | 9.18; 9.199; 20.177 98.295; 92.95; 117.259 | 1485 | Pranckevicius, Conor; Jimenéz-Halla, J Oscar C; Kirsch, Marius; Krummenacher, Ivo; Braunschweig, Holger Complexation and Release of N-Heterocyclic Carbene-Aminoborylene Ligands from Group VI and VIII Metals. Journal of the American Chemical Society, 2018, 140, 10524-10529 |
| 4132671 | CIF | C20 H23 N | P -1 | 10.3571; 11.0882; 14.0186 92.908; 101.465; 90.026 | 1575.67 | Nguyen, Vu T.; Dang, Hang T.; Pham, Hoang H.; Nguyen, Viet D.; Flores-Hansen, Carsten; Arman, Hadi D.; Larionov, Oleg V. Highly Regio- and Stereoselective Catalytic Synthesis of Conjugated Dienes and Polyenes. Journal of the American Chemical Society, 2018, 140, 8434-8438 |
| 4132672 | CIF | C19 H21 N | P 1 21/c 1 | 12.9391; 8.796; 13.4951 90; 104.676; 90 | 1485.8 | Nguyen, Vu T.; Dang, Hang T.; Pham, Hoang H.; Nguyen, Viet D.; Flores-Hansen, Carsten; Arman, Hadi D.; Larionov, Oleg V. Highly Regio- and Stereoselective Catalytic Synthesis of Conjugated Dienes and Polyenes. Journal of the American Chemical Society, 2018, 140, 8434-8438 |
| 4132673 | CIF | C13 H10 Cl N | P 1 21/c 1 | 3.9327; 20.3504; 12.8881 90; 95.764; 90 | 1026.25 | Nguyen, Vu T.; Dang, Hang T.; Pham, Hoang H.; Nguyen, Viet D.; Flores-Hansen, Carsten; Arman, Hadi D.; Larionov, Oleg V. Highly Regio- and Stereoselective Catalytic Synthesis of Conjugated Dienes and Polyenes. Journal of the American Chemical Society, 2018, 140, 8434-8438 |
| 4132674 | CIF | C30 H20 | P 1 21/c 1 | 7.82299; 17.3405; 13.9697 90; 96.824; 90 | 1881.63 | Ravat, Prince; Šolomek, Tomáš; Häussinger, Daniel; Blacque, Olivier; Juríček, Michal Dimethylcethrene: A Chiroptical Diradicaloid Photoswitch. Journal of the American Chemical Society, 2018, 140, 10839-10847 |
| 4132675 | CIF | C30 H22 O2 | C 1 2/c 1 | 9.2601; 14.986; 14.9657 90; 107.491; 90 | 1980.8 | Ravat, Prince; Šolomek, Tomáš; Häussinger, Daniel; Blacque, Olivier; Juríček, Michal Dimethylcethrene: A Chiroptical Diradicaloid Photoswitch. Journal of the American Chemical Society, 2018, 140, 10839-10847 |
| 4132676 | CIF | C50 H62 N2 O10 | P n m a | 23.143; 15.393; 12.944 90; 90; 90 | 4611 | Brekalo, Ivana; Kane, Christopher M.; Ley, Amanda N.; Ramirez, Joseph R.; Friščić, Tomislav; Holman, K. Travis Use of a "Shoe-Last" Solid-State Template in the Mechanochemical Synthesis of High-Porosity RHO-Zinc Imidazolate. Journal of the American Chemical Society, 2018, 140, 10104-10108 |
| 4132677 | CIF | C46 H54 N2 O10 | P b c n | 15.482; 16.274; 15.976 90; 90; 90 | 4025.2 | Brekalo, Ivana; Kane, Christopher M.; Ley, Amanda N.; Ramirez, Joseph R.; Friščić, Tomislav; Holman, K. Travis Use of a "Shoe-Last" Solid-State Template in the Mechanochemical Synthesis of High-Porosity RHO-Zinc Imidazolate. Journal of the American Chemical Society, 2018, 140, 10104-10108 |
| 4132678 | CIF | C208 H304 N88 O32 Zn16 | P m -3 m | 28.6715; 28.6715; 28.6715 90; 90; 90 | 23570 | Brekalo, Ivana; Kane, Christopher M.; Ley, Amanda N.; Ramirez, Joseph R.; Friščić, Tomislav; Holman, K. Travis Use of a "Shoe-Last" Solid-State Template in the Mechanochemical Synthesis of High-Porosity RHO-Zinc Imidazolate. Journal of the American Chemical Society, 2018, 140, 10104-10108 |
| 4132679 | CIF | C28 H41 N | P 1 21/c 1 | 7.4475; 11.6494; 26.153 90; 90.314; 90 | 2269 | Weinstein, Cory M.; Junor, Glen P.; Tolentino, Daniel R.; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Highly Ambiphilic Room Temperature Stable Six-Membered Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 9255-9260 |
| 4132680 | CIF | C26 H42 Cl N Pd | P 1 21/c 1 | 9.0915; 19.517; 14.058 90; 103.301; 90 | 2427.5 | Weinstein, Cory M.; Junor, Glen P.; Tolentino, Daniel R.; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Highly Ambiphilic Room Temperature Stable Six-Membered Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 9255-9260 |
| 4132681 | CIF | C25 H40 Cl N Pd | P 1 21/n 1 | 11.9071; 13.5787; 15.2077 90; 90.716; 90 | 2458.6 | Weinstein, Cory M.; Junor, Glen P.; Tolentino, Daniel R.; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Highly Ambiphilic Room Temperature Stable Six-Membered Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 9255-9260 |
| 4132682 | CIF | C28 H41 Au Cl N | P 21 21 21 | 10.6312; 13.2056; 17.7225 90; 90; 90 | 2488.1 | Weinstein, Cory M.; Junor, Glen P.; Tolentino, Daniel R.; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Highly Ambiphilic Room Temperature Stable Six-Membered Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 9255-9260 |
| 4132683 | CIF | C30 H41 Cl N O2 Rh | P 1 21/n 1 | 9.9542; 15.6195; 17.9011 90; 103.015; 90 | 2711.76 | Weinstein, Cory M.; Junor, Glen P.; Tolentino, Daniel R.; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Highly Ambiphilic Room Temperature Stable Six-Membered Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 9255-9260 |
| 4132684 | CIF | C40 H30 Cl6 F3 N P2 Pt Sb | P 1 21/n 1 | 11.7666; 21.1781; 16.7826 90; 93.451; 90 | 4174.5 | You, Di; Yang, Haifeng; Sen, Srobona; Gabbaï, François P Modulating the σ-Accepting Properties of an Antimony Z-type Ligand via Anion Abstraction: Remote-Controlled Reactivity of the Coordinated Platinum Atom. Journal of the American Chemical Society, 2018, 140, 9644-9651 |
| 4132685 | CIF | C44 H41 Cl2 F3 N P2 Pt Sb | P -1 | 9.675; 13.608; 17.248 69.737; 77.03; 80.654 | 2067 | You, Di; Yang, Haifeng; Sen, Srobona; Gabbaï, François P Modulating the σ-Accepting Properties of an Antimony Z-type Ligand via Anion Abstraction: Remote-Controlled Reactivity of the Coordinated Platinum Atom. Journal of the American Chemical Society, 2018, 140, 9644-9651 |
| 4132686 | CIF | C79.01 H62 F9.03 N2 O11.03 P4 Pt2 S3.01 Sb2 | P -1 | 12.914; 13.432; 13.461 77.264; 67.504; 82.244 | 2100.9 | You, Di; Yang, Haifeng; Sen, Srobona; Gabbaï, François P Modulating the σ-Accepting Properties of an Antimony Z-type Ligand via Anion Abstraction: Remote-Controlled Reactivity of the Coordinated Platinum Atom. Journal of the American Chemical Society, 2018, 140, 9644-9651 |
| 4132687 | CIF | C60 H41 B F18 N O P2 Pt Sb | P -1 | 9.07; 18.827; 19.304 70.644; 78.561; 78.51 | 3016.4 | You, Di; Yang, Haifeng; Sen, Srobona; Gabbaï, François P Modulating the σ-Accepting Properties of an Antimony Z-type Ligand via Anion Abstraction: Remote-Controlled Reactivity of the Coordinated Platinum Atom. Journal of the American Chemical Society, 2018, 140, 9644-9651 |
| 4132688 | CIF | C125.14 H84.28 B2 Cl6.28 F36 N2 P4 Pt2 Sb2 | P -1 | 8.936; 19.412; 20.369 115.125; 102.188; 92.038 | 3095.5 | You, Di; Yang, Haifeng; Sen, Srobona; Gabbaï, François P Modulating the σ-Accepting Properties of an Antimony Z-type Ligand via Anion Abstraction: Remote-Controlled Reactivity of the Coordinated Platinum Atom. Journal of the American Chemical Society, 2018, 140, 9644-9651 |
| 4132689 | CIF | C20 H24 Cl N O3 | P 21 21 21 | 9.2522; 10.3247; 19.5321 90; 90; 90 | 1865.8 | Deng, Lin; Chen, Mengqing; Dong, Guangbin Concise Synthesis of (-)-Cycloclavine and (-)-5- epi-Cycloclavine via Asymmetric C-C Activation. Journal of the American Chemical Society, 2018, 140, 9652-9658 |
| 4132690 | CIF | C88 H56 Cl4 F12 N16 O13 Re4 S4 | C 1 2/c 1 | 29.948; 29.987; 29.283 90; 101.13; 90 | 25803 | Haviv, Eynat; Azaiza-Dabbah, Dima; Carmieli, Raanan; Avram, Liat; Martin, Jan M. L.; Neumann, Ronny A Thiourea Tether in the Second Coordination Sphere as a Binding Site for CO<sub>2</sub> and a Proton Donor Promotes the Electrochemical Reduction of CO<sub>2</sub> to CO Catalyzed by a Rhenium Bipyridine-Type Complex. Journal of the American Chemical Society, 2018, 140, 12451-12456 |
| 4132691 | CIF | C36 H42 O7 | P 21 21 21 | 12.941; 13.1806; 18.8817 90; 90; 90 | 3220.65 | Liu, Wei; Ali, Siraj Z.; Ammann, Stephen E.; White, M. Christina Asymmetric Allylic C-H Alkylation via Palladium(II)/ cis-ArSOX Catalysis. Journal of the American Chemical Society, 2018, 140, 10658-10662 |
| 4132692 | CIF | C26 H29 N O7 S | P 1 | 8.1073; 12.6392; 13.2065 74.9956; 81.3175; 71.4936 | 1236.03 | Liu, Wei; Ali, Siraj Z.; Ammann, Stephen E.; White, M. Christina Asymmetric Allylic C-H Alkylation via Palladium(II)/ cis-ArSOX Catalysis. Journal of the American Chemical Society, 2018, 140, 10658-10662 |
| 4132693 | CIF | C31 H32 Cl2 F3 N O9 Pd S | P 1 21 1 | 11.5175; 12.9029; 12.3215 90; 112.935; 90 | 1686.34 | Liu, Wei; Ali, Siraj Z.; Ammann, Stephen E.; White, M. Christina Asymmetric Allylic C-H Alkylation via Palladium(II)/ cis-ArSOX Catalysis. Journal of the American Chemical Society, 2018, 140, 10658-10662 |
| 4132694 | CIF | C20 H19 N O4 | P 21 21 21 | 7.2794; 7.976; 28.9295 90; 90; 90 | 1679.66 | Liu, Wei; Ali, Siraj Z.; Ammann, Stephen E.; White, M. Christina Asymmetric Allylic C-H Alkylation via Palladium(II)/ cis-ArSOX Catalysis. Journal of the American Chemical Society, 2018, 140, 10658-10662 |
| 4132695 | CIF | C29 H28 O | P 1 21/n 1 | 9.2426; 11.0042; 22.027 90; 90.723; 90 | 2240.1 | Gao, Pin; Chen, Liang-An; Brown, M. Kevin Nickel-Catalyzed Stereoselective Diarylation of Alkenylarenes. Journal of the American Chemical Society, 2018, 140, 10653-10657 |
| 4132696 | CIF | C29 H28 O | P 1 21/c 1 | 11.1132; 16.9436; 12.0212 90; 104.743; 90 | 2189.04 | Gao, Pin; Chen, Liang-An; Brown, M. Kevin Nickel-Catalyzed Stereoselective Diarylation of Alkenylarenes. Journal of the American Chemical Society, 2018, 140, 10653-10657 |
| 4132697 | CIF | C24 H23 F3 | C 1 2/c 1 | 18.8921; 14.4381; 14.529 90; 97.589; 90 | 3928.3 | Gao, Pin; Chen, Liang-An; Brown, M. Kevin Nickel-Catalyzed Stereoselective Diarylation of Alkenylarenes. Journal of the American Chemical Society, 2018, 140, 10653-10657 |
| 4132698 | CIF | C48 H66 Cl6 Co3 F18 N18 O6 | I 1 2/a 1 | 18.1594; 7.9412; 47.787 90; 90.245; 90 | 6891.2 | Yu, Meng; Bouley, Bailey S.; Xie, Da; Enriquez, José S; Que, Emily L. <sup>19</sup>F PARASHIFT Probes for Magnetic Resonance Detection of H<sub>2</sub>O<sub>2</sub> and Peroxidase Activity. Journal of the American Chemical Society, 2018, 140, 10546-10552 |
| 4132699 | CIF | C26 H38 Co F9 N8 O4 | P 1 21/c 1 | 16.7381; 13.3744; 14.2241 90; 94.3; 90 | 3175.3 | Yu, Meng; Bouley, Bailey S.; Xie, Da; Enriquez, José S; Que, Emily L. <sup>19</sup>F PARASHIFT Probes for Magnetic Resonance Detection of H<sub>2</sub>O<sub>2</sub> and Peroxidase Activity. Journal of the American Chemical Society, 2018, 140, 10546-10552 |
| 4132700 | CIF | C19 H20 I N O3 S | P 1 21 1 | 7.5582; 14.1096; 9.6456 90; 107.998; 90 | 978.3 | Li, Bin; Chao, Zengyin; Li, Chunyu; Gu, Zhenhua Cu-Catalyzed Enantioselective Ring Opening of Cyclic Diaryliodoniums toward the Synthesis of Chiral Diarylmethanes. Journal of the American Chemical Society, 2018, 140, 9400-9403 |
| 4132701 | CIF | C22 H24 F3 I O5 S | P 1 21/n 1 | 9.6006; 20.3822; 24.3422 90; 99.723; 90 | 4694.9 | Li, Bin; Chao, Zengyin; Li, Chunyu; Gu, Zhenhua Cu-Catalyzed Enantioselective Ring Opening of Cyclic Diaryliodoniums toward the Synthesis of Chiral Diarylmethanes. Journal of the American Chemical Society, 2018, 140, 9400-9403 |
| 4132702 | CIF | C40 H49 Na O8 Si2 | C 1 c 1 | 25.195; 9.488; 19.143 90; 123.74; 90 | 3805.4 | Xie, Weilong; Park, Sung-Woo; Jung, Hoimin; Kim, Dongwook; Baik, Mu-Hyun; Chang, Sukbok Conjugate Addition of Perfluoroarenes to α,β-Unsaturated Carbonyls Enabled by an Alkoxide-Hydrosilane System: Implication of a Radical Pathway. Journal of the American Chemical Society, 2018, 140, 9659-9668 |
| 4132703 | CIF | C15 H9 Cl F2 O | P 1 21/c 1 | 10.7627; 12.6174; 9.1065 90; 101.936; 90 | 1209.9 | Xie, Weilong; Park, Sung-Woo; Jung, Hoimin; Kim, Dongwook; Baik, Mu-Hyun; Chang, Sukbok Conjugate Addition of Perfluoroarenes to α,β-Unsaturated Carbonyls Enabled by an Alkoxide-Hydrosilane System: Implication of a Radical Pathway. Journal of the American Chemical Society, 2018, 140, 9659-9668 |
| 4132704 | CIF | C53 H64 O12 S2 | P n a 21 | 37.029; 11.0822; 12.0393 90; 90; 90 | 4940.48 | Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Jung, Jong Hwa; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi; Lee, Shim Sung pseudo[1]Catenane-Type Pillar[5]thiacrown Whose Planar Chiral Inversion is Triggered by Metal Cation and Controlled by Anion. Journal of the American Chemical Society, 2018, 140, 9669-9677 |
| 4132705 | CIF | C53 H64 O12 S2 | P 21 21 21 | 12.5757; 18.6738; 41.8847 90; 90; 90 | 9836 | Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Jung, Jong Hwa; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi; Lee, Shim Sung pseudo[1]Catenane-Type Pillar[5]thiacrown Whose Planar Chiral Inversion is Triggered by Metal Cation and Controlled by Anion. Journal of the American Chemical Society, 2018, 140, 9669-9677 |
| 4132706 | CIF | C53 H64 O12 S2 | P 21 21 21 | 12.5633; 18.6928; 41.9876 90; 90; 90 | 9860.5 | Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Jung, Jong Hwa; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi; Lee, Shim Sung pseudo[1]Catenane-Type Pillar[5]thiacrown Whose Planar Chiral Inversion is Triggered by Metal Cation and Controlled by Anion. Journal of the American Chemical Society, 2018, 140, 9669-9677 |
| 4132707 | CIF | C53 H64 Cl2 Hg O20 S2 | P 1 21 1 | 15.9151; 9.0545; 22.8476 90; 91.173; 90 | 3291.7 | Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Jung, Jong Hwa; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi; Lee, Shim Sung pseudo[1]Catenane-Type Pillar[5]thiacrown Whose Planar Chiral Inversion is Triggered by Metal Cation and Controlled by Anion. Journal of the American Chemical Society, 2018, 140, 9669-9677 |
| 4132708 | CIF | C159 H190 Hg4 I8 O36 S6 | C 1 2 1 | 47.5683; 14.9566; 12.0028 90; 94.586; 90 | 8512.2 | Lee, Eunji; Ju, Huiyeong; Park, In-Hyeok; Jung, Jong Hwa; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi; Lee, Shim Sung pseudo[1]Catenane-Type Pillar[5]thiacrown Whose Planar Chiral Inversion is Triggered by Metal Cation and Controlled by Anion. Journal of the American Chemical Society, 2018, 140, 9669-9677 |
| 4132709 | CIF | C35 H44 O4 | P 21 21 21 | 6.3698; 13.228; 34.571 90; 90; 90 | 2912.9 | Wang, Yaxin; Hu, Xiafei; Morales-Rivera, Cristian A; Li, Guo-Xing; Huang, Xin; He, Gang; Liu, Peng; Chen, Gong Epimerization of Tertiary Carbon Centers via Reversible Radical Cleavage of Unactivated C(sp<sup>3</sup>)-H Bonds. Journal of the American Chemical Society, 2018, 140, 9678-9684 |
| 4132710 | CIF | C35 H44 O4 | P 21 21 21 | 11.1414; 12.4672; 21.0621 90; 90; 90 | 2925.57 | Wang, Yaxin; Hu, Xiafei; Morales-Rivera, Cristian A; Li, Guo-Xing; Huang, Xin; He, Gang; Liu, Peng; Chen, Gong Epimerization of Tertiary Carbon Centers via Reversible Radical Cleavage of Unactivated C(sp<sup>3</sup>)-H Bonds. Journal of the American Chemical Society, 2018, 140, 9678-9684 |
| 4132711 | CIF | C28 H38 O4 | P 21 21 21 | 7.7029; 14.6019; 21.1006 90; 90; 90 | 2373.33 | Wang, Yaxin; Hu, Xiafei; Morales-Rivera, Cristian A; Li, Guo-Xing; Huang, Xin; He, Gang; Liu, Peng; Chen, Gong Epimerization of Tertiary Carbon Centers via Reversible Radical Cleavage of Unactivated C(sp<sup>3</sup>)-H Bonds. Journal of the American Chemical Society, 2018, 140, 9678-9684 |
| 4132712 | CIF | C26 H35 N O3 | P 1 21 1 | 6.1268; 13.2115; 14.7663 90; 101.86; 90 | 1169.73 | Wang, Yaxin; Hu, Xiafei; Morales-Rivera, Cristian A; Li, Guo-Xing; Huang, Xin; He, Gang; Liu, Peng; Chen, Gong Epimerization of Tertiary Carbon Centers via Reversible Radical Cleavage of Unactivated C(sp<sup>3</sup>)-H Bonds. Journal of the American Chemical Society, 2018, 140, 9678-9684 |
| 4132713 | CIF | C16 H6 F8 O4 | P b c a | 7.9565; 15.697; 24.285 90; 90; 90 | 3033 | Ji, Pengfei; Drake, Tasha; Murakami, Akiko; Oliveres, Pau; Skone, Jonathan H.; Lin, Wenbin Tuning Lewis Acidity of Metal-Organic Frameworks via Perfluorination of Bridging Ligands: Spectroscopic, Theoretical, and Catalytic Studies. Journal of the American Chemical Society, 2018, 140, 10553-10561 |
| 4132714 | CIF | C210 H178 Cr12 N26 O68 | P -1 | 21.4077; 21.9786; 22.0259 115.221; 116.928; 90.438 | 8096.3 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132715 | CIF | C17 H8 Cu N O4 | P a -3 | 40.52; 40.52; 40.52 90; 90; 90 | 66529 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132716 | CIF | C20.25 H8 Cu D13 N O4 | P a -3 | 40.53; 40.53; 40.53 90; 90; 90 | 66578 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132717 | CIF | C204 H176 Cu12 N24 O66 | P 1 21/n 1 | 23.345; 27.435; 23.959 90; 99; 90 | 15156 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132718 | CIF | C168 H84 Mo12 N12 O68 | P 1 21/n 1 | 24.1875; 28.6009; 24.5462 90; 97.121; 90 | 16849.7 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132719 | CIF | C18.89 H8 Cu D7.56 N O4 | P a -3 | 40.519; 40.519; 40.519 90; 90; 90 | 66524 | Rowland, Casey A.; Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; Yap, Glenn P. A.; Brown, Craig M.; Bloch, Eric D. Methane Storage in Paddlewheel-Based Porous Coordination Cages. Journal of the American Chemical Society, 2018, 140, 11153-11157 |
| 4132720 | CIF | C18 H21 F O2 | P 21 21 21 | 7.6488; 14.2419; 28.2187 90; 90; 90 | 3073.96 | Blümel, Marcus; Nagasawa, Shota; Blackford, Katherine; Hare, Stephanie R.; Tantillo, Dean J.; Sarpong, Richmond Rearrangement of Hydroxylated Pinene Derivatives to Fenchone-Type Frameworks: Computational Evidence for Dynamically-Controlled Selectivity. Journal of the American Chemical Society, 2018, 140, 9291-9298 |
| 4132721 | CIF | C23 H24 O2 | P 1 21 1 | 8.3269; 7.6893; 13.8728 90; 100.63; 90 | 873.005 | Blümel, Marcus; Nagasawa, Shota; Blackford, Katherine; Hare, Stephanie R.; Tantillo, Dean J.; Sarpong, Richmond Rearrangement of Hydroxylated Pinene Derivatives to Fenchone-Type Frameworks: Computational Evidence for Dynamically-Controlled Selectivity. Journal of the American Chemical Society, 2018, 140, 9291-9298 |
| 4132722 | CIF | C17 H22 F N O5 | P 21 21 21 | 8.10217; 12.10152; 17.38923 90; 90; 90 | 1704.99 | Testa, Andrea; Lucas, Xavier; Castro, Guilherme V.; Chan, Kwok-Ho; Wright, Jane E.; Runcie, Andrew C.; Gadd, Morgan S.; Harrison, William T. A.; Ko, Eun-Jung; Fletcher, Daniel; Ciulli, Alessio 3-Fluoro-4-hydroxyprolines: Synthesis, Conformational Analysis, and Stereoselective Recognition by the VHL E3 Ubiquitin Ligase for Targeted Protein Degradation. Journal of the American Chemical Society, 2018, 140, 9299-9313 |
| 4132723 | CIF | C25 H22 F N O3 | P 1 21 1 | 9.9574; 8.8817; 10.7882 90; 90.883; 90 | 953.98 | Testa, Andrea; Lucas, Xavier; Castro, Guilherme V.; Chan, Kwok-Ho; Wright, Jane E.; Runcie, Andrew C.; Gadd, Morgan S.; Harrison, William T. A.; Ko, Eun-Jung; Fletcher, Daniel; Ciulli, Alessio 3-Fluoro-4-hydroxyprolines: Synthesis, Conformational Analysis, and Stereoselective Recognition by the VHL E3 Ubiquitin Ligase for Targeted Protein Degradation. Journal of the American Chemical Society, 2018, 140, 9299-9313 |
| 4132724 | CIF | C17 H24 F N O6 | P 21 21 21 | 6.05736; 8.48378; 34.6061 90; 90; 90 | 1778.38 | Testa, Andrea; Lucas, Xavier; Castro, Guilherme V.; Chan, Kwok-Ho; Wright, Jane E.; Runcie, Andrew C.; Gadd, Morgan S.; Harrison, William T. A.; Ko, Eun-Jung; Fletcher, Daniel; Ciulli, Alessio 3-Fluoro-4-hydroxyprolines: Synthesis, Conformational Analysis, and Stereoselective Recognition by the VHL E3 Ubiquitin Ligase for Targeted Protein Degradation. Journal of the American Chemical Society, 2018, 140, 9299-9313 |
| 4132725 | CIF | C17 H22 F N O5 | P 21 21 21 | 8.61245; 10.21862; 18.99958 90; 90; 90 | 1672.1 | Testa, Andrea; Lucas, Xavier; Castro, Guilherme V.; Chan, Kwok-Ho; Wright, Jane E.; Runcie, Andrew C.; Gadd, Morgan S.; Harrison, William T. A.; Ko, Eun-Jung; Fletcher, Daniel; Ciulli, Alessio 3-Fluoro-4-hydroxyprolines: Synthesis, Conformational Analysis, and Stereoselective Recognition by the VHL E3 Ubiquitin Ligase for Targeted Protein Degradation. Journal of the American Chemical Society, 2018, 140, 9299-9313 |
| 4132726 | CIF | C23 H17 N O | P 21 21 21 | 8.2353; 13.2333; 15.1468 90; 90; 90 | 1650.7 | Carmona, José A; Hornillos, Valentín; Ramírez-López, Pedro; Ros, Abel; Iglesias-Sigüenza, Javier; Gómez-Bengoa, Enrique; Fernández, Rosario; Lassaletta, José M Dynamic Kinetic Asymmetric Heck Reaction for the Simultaneous Generation of Central and Axial Chirality. Journal of the American Chemical Society, 2018, 140, 11067-11075 |
| 4132727 | CIF | C112 H104 N8 O8 | P 21 21 21 | 9.3299; 11.8388; 20.3171 90; 90; 90 | 2244.12 | Carmona, José A; Hornillos, Valentín; Ramírez-López, Pedro; Ros, Abel; Iglesias-Sigüenza, Javier; Gómez-Bengoa, Enrique; Fernández, Rosario; Lassaletta, José M Dynamic Kinetic Asymmetric Heck Reaction for the Simultaneous Generation of Central and Axial Chirality. Journal of the American Chemical Society, 2018, 140, 11067-11075 |
| 4132728 | CIF | C26 H23 Cl N O0.5 | P 21 21 21 | 11.48; 12.905; 28.8426 90; 90; 90 | 4273 | Carmona, José A; Hornillos, Valentín; Ramírez-López, Pedro; Ros, Abel; Iglesias-Sigüenza, Javier; Gómez-Bengoa, Enrique; Fernández, Rosario; Lassaletta, José M Dynamic Kinetic Asymmetric Heck Reaction for the Simultaneous Generation of Central and Axial Chirality. Journal of the American Chemical Society, 2018, 140, 11067-11075 |
| 4132729 | CIF | C65 H49 F0 N O0.5 P2 Pd S0 | P 1 | 12.7654; 15.5021; 15.5871 69.715; 81.105; 80.949 | 2840.5 | Carmona, José A; Hornillos, Valentín; Ramírez-López, Pedro; Ros, Abel; Iglesias-Sigüenza, Javier; Gómez-Bengoa, Enrique; Fernández, Rosario; Lassaletta, José M Dynamic Kinetic Asymmetric Heck Reaction for the Simultaneous Generation of Central and Axial Chirality. Journal of the American Chemical Society, 2018, 140, 11067-11075 |
| 4132730 | CIF | C37 H46 Mo O2 P2 | P -1 | 8.773; 11.504; 16.681 93.575; 98.963; 103.528 | 1608.2 | Buss, Joshua A.; VanderVelde, David G.; Agapie, Theodor Lewis Acid Enhancement of Proton Induced CO<sub>2</sub> Cleavage: Bond Weakening and Ligand Residence Time Effects. Journal of the American Chemical Society, 2018, 140, 10121-10125 |
| 4132731 | CIF | C48 H40 B F15 Mo N2 P2 | P c a 21 | 23.5019; 9.3504; 20.5286 90; 90; 90 | 4511.2 | Buss, Joshua A.; VanderVelde, David G.; Agapie, Theodor Lewis Acid Enhancement of Proton Induced CO<sub>2</sub> Cleavage: Bond Weakening and Ligand Residence Time Effects. Journal of the American Chemical Society, 2018, 140, 10121-10125 |
| 4132732 | CIF | C49 H40 B F15 Mo O2 P2 | P -1 | 9.4051; 11.3058; 22.0674 103.065; 94.669; 96.976 | 2254.39 | Buss, Joshua A.; VanderVelde, David G.; Agapie, Theodor Lewis Acid Enhancement of Proton Induced CO<sub>2</sub> Cleavage: Bond Weakening and Ligand Residence Time Effects. Journal of the American Chemical Society, 2018, 140, 10121-10125 |
| 4132733 | CIF | C75 H64 B F24 Mo O P2 | P -1 | 13.0216; 16.2787; 18.3832 111.964; 100.228; 92.383 | 3531.5 | Buss, Joshua A.; VanderVelde, David G.; Agapie, Theodor Lewis Acid Enhancement of Proton Induced CO<sub>2</sub> Cleavage: Bond Weakening and Ligand Residence Time Effects. Journal of the American Chemical Society, 2018, 140, 10121-10125 |
| 4132734 | CIF | C130 H109 B2 Cl F48 Mo2 N2 P4 | P -1 | 13.0558; 16.4548; 16.505 65.959; 81.517; 78.563 | 3165.1 | Buss, Joshua A.; VanderVelde, David G.; Agapie, Theodor Lewis Acid Enhancement of Proton Induced CO<sub>2</sub> Cleavage: Bond Weakening and Ligand Residence Time Effects. Journal of the American Chemical Society, 2018, 140, 10121-10125 |
| 4132735 | CIF | C17 H18 O3 | P 1 21/c 1 | 9.9036; 9.5634; 15.2192 90; 93.961; 90 | 1438 | Lee, Hanbin; Mane, Manoj V.; Ryu, Ho; Sahu, Debashis; Baik, Mu-Hyun; Yi, Chae S. Experimental and Computational Study of the ( Z)-Selective Formation of Trisubstituted Olefins and Benzo-Fused Oxacycles from the Ruthenium-Catalyzed Dehydrative C-H Coupling of Phenols with Ketones. Journal of the American Chemical Society, 2018, 140, 10289-10296 |
| 4132736 | CIF | C14 H18 O4 | P 1 21 1 | 5.53828; 24.4737; 8.98955 90; 91.211; 90 | 1218.19 | Lee, Hanbin; Mane, Manoj V.; Ryu, Ho; Sahu, Debashis; Baik, Mu-Hyun; Yi, Chae S. Experimental and Computational Study of the ( Z)-Selective Formation of Trisubstituted Olefins and Benzo-Fused Oxacycles from the Ruthenium-Catalyzed Dehydrative C-H Coupling of Phenols with Ketones. Journal of the American Chemical Society, 2018, 140, 10289-10296 |
| 4132737 | CIF | C17 H36 Cl9 N Si3 | P -4 3 n | 18.5044; 18.5044; 18.5044 90; 90; 90 | 6336.1 | Georg, Isabelle; Teichmann, Julian; Bursch, Markus; Tillmann, Jan; Endeward, Burkhard; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias Exhaustively Trichlorosilylated C<sub>1</sub> and C<sub>2</sub> Building Blocks: Beyond the Müller-Rochow Direct Process. Journal of the American Chemical Society, 2018, 140, 9696-9708 |
| 4132738 | CIF | C34 H72 Cl12 N2 Si4 | P -1 | 11.4327; 11.8063; 19.5139 85.921; 85.777; 88.686 | 2619.7 | Georg, Isabelle; Teichmann, Julian; Bursch, Markus; Tillmann, Jan; Endeward, Burkhard; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias Exhaustively Trichlorosilylated C<sub>1</sub> and C<sub>2</sub> Building Blocks: Beyond the Müller-Rochow Direct Process. Journal of the American Chemical Society, 2018, 140, 9696-9708 |
| 4132739 | CIF | C2 Cl12 Si4 | P b c a | 16.5007; 12.171; 18.2951 90; 90; 90 | 3674.2 | Georg, Isabelle; Teichmann, Julian; Bursch, Markus; Tillmann, Jan; Endeward, Burkhard; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias Exhaustively Trichlorosilylated C<sub>1</sub> and C<sub>2</sub> Building Blocks: Beyond the Müller-Rochow Direct Process. Journal of the American Chemical Society, 2018, 140, 9696-9708 |
| 4132740 | CIF | C8 H8 Cl6 Si2 | P -1 | 9.1268; 9.5234; 10.1718 77.516; 87.755; 62.147 | 761.25 | Georg, Isabelle; Teichmann, Julian; Bursch, Markus; Tillmann, Jan; Endeward, Burkhard; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias Exhaustively Trichlorosilylated C<sub>1</sub> and C<sub>2</sub> Building Blocks: Beyond the Müller-Rochow Direct Process. Journal of the American Chemical Society, 2018, 140, 9696-9708 |
| 4132741 | CIF | C30 H20 Cl6 Si2 | P -1 | 11.5499; 12.4908; 12.5898 65.826; 79.473; 65.638 | 1509.27 | Georg, Isabelle; Teichmann, Julian; Bursch, Markus; Tillmann, Jan; Endeward, Burkhard; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias Exhaustively Trichlorosilylated C<sub>1</sub> and C<sub>2</sub> Building Blocks: Beyond the Müller-Rochow Direct Process. Journal of the American Chemical Society, 2018, 140, 9696-9708 |
| 4132742 | CIF | C43 H45 F12 N4 O6 P3 Ru S | P 1 21/n 1 | 12.871; 27.8262; 13.7151 90; 108.04; 90 | 4670.6 | Kosgei, Gilbert K.; Breen, Douglas J.; Lamb, Robert W.; Livshits, Maksim Y.; Crandall, Laura A.; Ziegler, Christopher J.; Webster, Charles Edwin; Rack, Jeffrey J. Controlling Photoisomerization Reactivity Through Single Functional Group Substitutions in Ruthenium Phosphine Sulfoxide Complexes. Journal of the American Chemical Society, 2018, 140, 9819-9822 |
| 4132743 | CIF | C62 H68 I O5 P | P 43 21 2 | 26.5441; 26.5441; 22.7499 90; 90; 90 | 16029.3 | Ye, Baihua; Zhao, Jie; Zhao, Ke; McKenna, Jeffrey M.; Toste, F. Dean Chiral Diaryliodonium Phosphate Enables Light Driven Diastereoselective α-C(sp<sup>3</sup>)-H Acetalization. Journal of the American Chemical Society, 2018, 140, 8350-8356 |
| 4132744 | CIF | C16 H13 Fe2 N O6 S2 | P -1 | 7.63; 11.4442; 12.1777 66.08; 82.174; 78.089 | 949.5 | Ahmed, Md Estak; Dey, Subal; Darensbourg, Marcetta Y.; Dey, Abhishek Oxygen-Tolerant H<sub>2</sub> Production by [FeFe]-H<sub>2</sub>ase Active Site Mimics Aided by Second Sphere Proton Shuttle. Journal of the American Chemical Society, 2018, 140, 12457-12468 |
| 4132745 | CIF | C18 H15 Fe2 N O8 S2 | P 1 21/c 1 | 12.0292; 11.9367; 16.3521 90; 111.147; 90 | 2189.9 | Ahmed, Md Estak; Dey, Subal; Darensbourg, Marcetta Y.; Dey, Abhishek Oxygen-Tolerant H<sub>2</sub> Production by [FeFe]-H<sub>2</sub>ase Active Site Mimics Aided by Second Sphere Proton Shuttle. Journal of the American Chemical Society, 2018, 140, 12457-12468 |
| 4132746 | CIF | C15 H11 Fe2 N O6 S2 | P -1 | 7.5764; 10.35; 12.755 93.763; 104.601; 107.684 | 911.1 | Ahmed, Md Estak; Dey, Subal; Darensbourg, Marcetta Y.; Dey, Abhishek Oxygen-Tolerant H<sub>2</sub> Production by [FeFe]-H<sub>2</sub>ase Active Site Mimics Aided by Second Sphere Proton Shuttle. Journal of the American Chemical Society, 2018, 140, 12457-12468 |
| 4132747 | CIF | C108 H52 F24 O32 Zr6 | P 6/m m m | 39.341; 39.341; 16.4692 90; 90; 120 | 22075 | Liu, Jian; Ye, Jingyun; Li, Zhanyong; Otake, Ken-Ichi; Liao, Yijun; Peters, Aaron W.; Noh, Hyunho; Truhlar, Donald G.; Gagliardi, Laura; Cramer, Christopher J.; Farha, Omar K.; Hupp, Joseph T. Beyond the Active Site: Tuning the Activity and Selectivity of a Metal-Organic Framework-Supported Ni Catalyst for Ethylene Dimerization. Journal of the American Chemical Society, 2018, 140, 11174-11178 |
| 4132748 | CIF | C25 H30 I N O3 | P 1 21 1 | 8.8222; 22.4497; 12.2995 90; 90.664; 90 | 2435.82 | Li, Shou-Lei; Yang, Chen; Wu, Quan; Zheng, Han-Liang; Li, Xin; Cheng, Jin-Pei Atroposelective Catalytic Asymmetric Allylic Alkylation Reaction for Axially Chiral Anilides with Achiral Morita-Baylis-Hillman Carbonates. Journal of the American Chemical Society, 2018, 140, 12836-12843 |
| 4132749 | CIF | C26 H32 Br N3 O3 | P 1 21 1 | 9.2512; 9.908; 13.364 90; 93.83; 90 | 1222.2 | Li, Shou-Lei; Yang, Chen; Wu, Quan; Zheng, Han-Liang; Li, Xin; Cheng, Jin-Pei Atroposelective Catalytic Asymmetric Allylic Alkylation Reaction for Axially Chiral Anilides with Achiral Morita-Baylis-Hillman Carbonates. Journal of the American Chemical Society, 2018, 140, 12836-12843 |
| 4132750 | CIF | C30 H48 F12 Fe N10 P2 | P -1 | 9.0037; 10.6349; 20.9238 87.427; 80.838; 83.926 | 1966.1 | Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Hauser, Andreas; Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Real, José Antonio; Pillet, Sébastien; Bendeif, El-Eulmi; Besnard, Céline Very Long-Lived Photogenerated High-Spin Phase of a Multistable Spin-Crossover Molecular Material. Journal of the American Chemical Society, 2018, 140, 12870-12876 |
| 4132751 | CIF | C30 H48 F12 Fe N10 P2 | P -1 | 9.1236; 10.3986; 21.917 82.664; 79.143; 81.735 | 2010 | Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Hauser, Andreas; Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Real, José Antonio; Pillet, Sébastien; Bendeif, El-Eulmi; Besnard, Céline Very Long-Lived Photogenerated High-Spin Phase of a Multistable Spin-Crossover Molecular Material. Journal of the American Chemical Society, 2018, 140, 12870-12876 |
| 4132752 | CIF | C30 H48 F12 Fe N10 P2 | P -1 | 9.2022; 10.1887; 21.8917 91.39; 101.321; 98.577 | 1987.1 | Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Hauser, Andreas; Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Real, José Antonio; Pillet, Sébastien; Bendeif, El-Eulmi; Besnard, Céline Very Long-Lived Photogenerated High-Spin Phase of a Multistable Spin-Crossover Molecular Material. Journal of the American Chemical Society, 2018, 140, 12870-12876 |
| 4132753 | CIF | C30 H48 F12 Fe N10 P2 | P -1 | 9.2011; 10.1991; 21.9496 91.624; 101.414; 98.816 | 1991.6 | Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Hauser, Andreas; Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Real, José Antonio; Pillet, Sébastien; Bendeif, El-Eulmi; Besnard, Céline Very Long-Lived Photogenerated High-Spin Phase of a Multistable Spin-Crossover Molecular Material. Journal of the American Chemical Society, 2018, 140, 12870-12876 |
| 4132754 | CIF | C30 H48 F12 Fe N10 P2 | P -1 | 9.2642; 10.2705; 22.0624 91.906; 101.684; 98.679 | 2027.74 | Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Hauser, Andreas; Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Real, José Antonio; Pillet, Sébastien; Bendeif, El-Eulmi; Besnard, Céline Very Long-Lived Photogenerated High-Spin Phase of a Multistable Spin-Crossover Molecular Material. Journal of the American Chemical Society, 2018, 140, 12870-12876 |
| 4132755 | CIF | C30 H48 F12 Fe N10 P2 | P -1 | 9.2763; 10.2063; 22.0345 91.425; 101.334; 98.996 | 2017 | Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Hauser, Andreas; Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Real, José Antonio; Pillet, Sébastien; Bendeif, El-Eulmi; Besnard, Céline Very Long-Lived Photogenerated High-Spin Phase of a Multistable Spin-Crossover Molecular Material. Journal of the American Chemical Society, 2018, 140, 12870-12876 |
| 4132756 | CIF | C12.74 H8 Co N4 O1.48 | C 1 2/c 1 | 24.6998; 8.2115; 7.0889 90; 90.237; 90 | 1437.8 | Taylor, Mercedes K.; Runčevski, Tomče; Oktawiec, Julia; Bachman, Jonathan E.; Siegelman, Rebecca L.; Jiang, Henry; Mason, Jarad A.; Tarver, Jacob D.; Long, Jeffrey R. Near-Perfect CO<sub>2</sub>/CH<sub>4</sub> Selectivity Achieved through Reversible Guest Templating in the Flexible Metal-Organic Framework Co(bdp). Journal of the American Chemical Society, 2018, 140, 10324-10331 |
| 4132757 | CIF | C74 H96 N8 | P 1 21/n 1 | 21.3574; 13.0173; 23.82 90; 93.95; 90 | 6606.6 | Oki, Kosuke; Takase, Masayoshi; Mori, Shigeki; Shiotari, Akitoshi; Sugimoto, Yoshiaki; Ohara, Keishi; Okujima, Tetsuo; Uno, Hidemitsu Synthesis, Structures, and Properties of Core-Expanded Azacoronene Analogue: A Twisted π-System with Two N-Doped Heptagons. Journal of the American Chemical Society, 2018, 140, 10430-10434 |
| 4132758 | CIF | C74 H80 N8 | P -1 | 15.6996; 18.0988; 22.34 94.624; 93.167; 97.221 | 6263.2 | Oki, Kosuke; Takase, Masayoshi; Mori, Shigeki; Shiotari, Akitoshi; Sugimoto, Yoshiaki; Ohara, Keishi; Okujima, Tetsuo; Uno, Hidemitsu Synthesis, Structures, and Properties of Core-Expanded Azacoronene Analogue: A Twisted π-System with Two N-Doped Heptagons. Journal of the American Chemical Society, 2018, 140, 10430-10434 |
| 4132759 | CIF | C78 H88.34 F12 N8 O2.17 P2 | P 1 c 1 | 18.9374; 19.0517; 20.3855 90; 106.369; 90 | 7056.8 | Oki, Kosuke; Takase, Masayoshi; Mori, Shigeki; Shiotari, Akitoshi; Sugimoto, Yoshiaki; Ohara, Keishi; Okujima, Tetsuo; Uno, Hidemitsu Synthesis, Structures, and Properties of Core-Expanded Azacoronene Analogue: A Twisted π-System with Two N-Doped Heptagons. Journal of the American Chemical Society, 2018, 140, 10430-10434 |
| 4132760 | CIF | C44 H62 I N2 P2 U | P 21 21 2 | 12.4461; 15.3301; 11.6893 90; 90; 90 | 2230.32 | Mullane, Kimberly C.; Ryu, Ho; Cheisson, Thibault; Grant, Lauren N.; Park, Ji Young; Manor, Brian C.; Carroll, Patrick J.; Baik, Mu-Hyun; Mindiola, Daniel J.; Schelter, Eric J. C-H Bond Addition across a Transient Uranium-Nitrido Moiety and Formation of a Parent Uranium Imido Complex. Journal of the American Chemical Society, 2018, 140, 11335-11340 |
| 4132761 | CIF | C44 H62 Cl2 N2 P2 U | C 1 2/c 1 | 24.5125; 13.2349; 14.3958 90; 115.555; 90 | 4213.4 | Mullane, Kimberly C.; Ryu, Ho; Cheisson, Thibault; Grant, Lauren N.; Park, Ji Young; Manor, Brian C.; Carroll, Patrick J.; Baik, Mu-Hyun; Mindiola, Daniel J.; Schelter, Eric J. C-H Bond Addition across a Transient Uranium-Nitrido Moiety and Formation of a Parent Uranium Imido Complex. Journal of the American Chemical Society, 2018, 140, 11335-11340 |
| 4132762 | CIF | C44 H62 N8 P2 U | P -1 | 10.9802; 11.5895; 21.4568 87.954; 87.283; 65.953 | 2490.31 | Mullane, Kimberly C.; Ryu, Ho; Cheisson, Thibault; Grant, Lauren N.; Park, Ji Young; Manor, Brian C.; Carroll, Patrick J.; Baik, Mu-Hyun; Mindiola, Daniel J.; Schelter, Eric J. C-H Bond Addition across a Transient Uranium-Nitrido Moiety and Formation of a Parent Uranium Imido Complex. Journal of the American Chemical Society, 2018, 140, 11335-11340 |
| 4132763 | CIF | C59 H93 K N3 O3 P2 U | P -1 | 12.7487; 13.6035; 17.6124 102.07; 91.734; 98.501 | 2948.2 | Mullane, Kimberly C.; Ryu, Ho; Cheisson, Thibault; Grant, Lauren N.; Park, Ji Young; Manor, Brian C.; Carroll, Patrick J.; Baik, Mu-Hyun; Mindiola, Daniel J.; Schelter, Eric J. C-H Bond Addition across a Transient Uranium-Nitrido Moiety and Formation of a Parent Uranium Imido Complex. Journal of the American Chemical Society, 2018, 140, 11335-11340 |
| 4132764 | CIF | C25 H47 B3 F2 K N3 O6 | P -1 | 9.4486; 14.759; 22.6127 88.9; 89.95; 86.561 | 3147.12 | Geri, Jacob B.; Wade Wolfe, Michael M.; Szymczak, Nathaniel K. The Difluoromethyl Group as a Masked Nucleophile: A Lewis Acid/Base Approach. Journal of the American Chemical Society, 2018, 140, 9404-9408 |
| 4132765 | CIF | C17 H35 F6 Fe N8 O7 S2 | P 1 21/n 1 | 11.6737; 8.25353; 30.0031 90; 93.5614; 90 | 2885.19 | Speelman, Amy L.; White, Corey J.; Zhang, Bo; Alp, E. Ercan; Zhao, Jiyong; Hu, Michael; Krebs, Carsten; Penner-Hahn, James; Lehnert, Nicolai Non-heme High-Spin {FeNO}<sup>6-8</sup> Complexes: One Ligand Platform Can Do It All. Journal of the American Chemical Society, 2018, 140, 11341-11359 |
| 4132766 | CIF | C17 H15 Co F3 N3 O3 S | P -1 | 9.1975; 10.2549; 10.7336 86.647; 87.81; 65.188 | 917.26 | McLoughlin, Elizabeth A.; Waldie, Kate M.; Ramakrishnan, Srinivasan; Waymouth, Robert M. Protonation of a Cobalt Phenylazopyridine Complex at the Ligand Yields a Proton, Hydride, and Hydrogen Atom Transfer Reagent. Journal of the American Chemical Society, 2018, 140, 13233-13241 |
| 4132767 | CIF | C62.5 H44 Cl5.5 D1.5 N7 O7 | P 1 21/n 1 | 18.4626; 19.0335; 19.1173 90; 100.614; 90 | 6603 | Zhiquan, Lei; Xie, Han; Border, Sarah E.; Gallucci, Judith; Pavlović, Radoslav Z; Badjić, Jovica D A Stimuli-Responsive Molecular Capsule with Switchable Dynamics, Chirality, and Encapsulation Characteristics. Journal of the American Chemical Society, 2018, 140, 11091-11100 |
| 4132768 | CIF | C20 H20 Br2 O3 | P c a 21 | 17.222; 9.8655; 20.9582 90; 90; 90 | 3560.9 | Schmid, Matthias; Grossmann, Adriana S.; Wurst, Klaus; Magauer, Thomas Total Synthesis of Salimabromide: A Tetracyclic Polyketide from a Marine Myxobacterium. Journal of the American Chemical Society, 2018, 140, 8444-8447 |
| 4132769 | CIF | C20 H24 O | P 1 21/c 1 | 9.9024; 17.7073; 8.9301 90; 100.908; 90 | 1537.56 | Schmid, Matthias; Grossmann, Adriana S.; Wurst, Klaus; Magauer, Thomas Total Synthesis of Salimabromide: A Tetracyclic Polyketide from a Marine Myxobacterium. Journal of the American Chemical Society, 2018, 140, 8444-8447 |
| 4132770 | CIF | C20 H22 O3 | P 1 c 1 | 27.498; 7.6508; 15.583 90; 90.715; 90 | 3278.1 | Schmid, Matthias; Grossmann, Adriana S.; Wurst, Klaus; Magauer, Thomas Total Synthesis of Salimabromide: A Tetracyclic Polyketide from a Marine Myxobacterium. Journal of the American Chemical Society, 2018, 140, 8444-8447 |
| 4132771 | CIF | C20 H22 O3 | P -1 | 10.2423; 11.5267; 14.1776 88.506; 80.899; 76.244 | 1605.2 | Schmid, Matthias; Grossmann, Adriana S.; Wurst, Klaus; Magauer, Thomas Total Synthesis of Salimabromide: A Tetracyclic Polyketide from a Marine Myxobacterium. Journal of the American Chemical Society, 2018, 140, 8444-8447 |
| 4132772 | CIF | C47 H70 Cl2 N2 P2 Si | P -1 | 10.7291; 10.9423; 21.1536 90.135; 104.209; 93.207 | 2403.4 | Kundu, Subrata; Sinhababu, Soumen; Siddiqui, Mujahuddin M.; Luebben, Anna V.; Dittrich, Birger; Yang, Tao; Frenking, Gernot; Roesky, Herbert W. Comparison of Two Phosphinidenes Binding to Silicon(IV)dichloride as well as to Silylene. Journal of the American Chemical Society, 2018, 140, 9409-9412 |
| 4132773 | CIF | C126 H200 N6 P4 Si2 | P -1 | 13.3897; 16.8613; 28.705 97.348; 101.539; 105.097 | 6018.5 | Kundu, Subrata; Sinhababu, Soumen; Siddiqui, Mujahuddin M.; Luebben, Anna V.; Dittrich, Birger; Yang, Tao; Frenking, Gernot; Roesky, Herbert W. Comparison of Two Phosphinidenes Binding to Silicon(IV)dichloride as well as to Silylene. Journal of the American Chemical Society, 2018, 140, 9409-9412 |
| 4132774 | CIF | C32 H34 Mo2 N6 O10 | P 1 2/c 1 | 16.3099; 15.3787; 14.4277 90; 93.304; 90 | 3612.81 | Claire, F. James; Tenney, Stephanie M.; Li, Minyuan M.; Siegler, Maxime A.; Wagner, Justine S.; Hall, Anthony Shoji; Kempa, Thomas J. Hierarchically Ordered Two-Dimensional Coordination Polymers Assembled from Redox-Active Dimolybdenum Clusters. Journal of the American Chemical Society, 2018, 140, 10673-10676 |
| 4132775 | CIF | C68 H77 Mo4 N13 O21 | P 1 21/c 1 | 16.38752; 15.60553; 14.32079 90; 91.8; 90 | 3660.53 | Claire, F. James; Tenney, Stephanie M.; Li, Minyuan M.; Siegler, Maxime A.; Wagner, Justine S.; Hall, Anthony Shoji; Kempa, Thomas J. Hierarchically Ordered Two-Dimensional Coordination Polymers Assembled from Redox-Active Dimolybdenum Clusters. Journal of the American Chemical Society, 2018, 140, 10673-10676 |
| 4132776 | CIF | C18 H25 N3 Pd | P 1 21/n 1 | 8.1652; 19.9237; 11.5584 90; 108.914; 90 | 1778.81 | Rudenko, Andrey E.; Clayman, Naomi E.; Walker, Katherine L.; Maclaren, Jana K.; Zimmerman, Paul M.; Waymouth, Robert M. Ligand-Induced Reductive Elimination of Ethane from Azopyridine Palladium Dimethyl Complexes. Journal of the American Chemical Society, 2018, 140, 11408-11415 |
| 4132777 | CIF | C21 H24 N4 Pd | P 1 21/n 1 | 9.9146; 18.0926; 10.9702 90; 105.158; 90 | 1899.4 | Rudenko, Andrey E.; Clayman, Naomi E.; Walker, Katherine L.; Maclaren, Jana K.; Zimmerman, Paul M.; Waymouth, Robert M. Ligand-Induced Reductive Elimination of Ethane from Azopyridine Palladium Dimethyl Complexes. Journal of the American Chemical Society, 2018, 140, 11408-11415 |
| 4132778 | CIF | C14 H17 N3 Pd | P 1 21/c 1 | 10.2729; 17.4768; 7.5492 90; 102.902; 90 | 1321.15 | Rudenko, Andrey E.; Clayman, Naomi E.; Walker, Katherine L.; Maclaren, Jana K.; Zimmerman, Paul M.; Waymouth, Robert M. Ligand-Induced Reductive Elimination of Ethane from Azopyridine Palladium Dimethyl Complexes. Journal of the American Chemical Society, 2018, 140, 11408-11415 |
| 4132779 | CIF | C15 H16 F3 N3 Pd | P -1 | 8.1493; 10.1574; 10.6196 113.946; 91.188; 96.721 | 795.61 | Rudenko, Andrey E.; Clayman, Naomi E.; Walker, Katherine L.; Maclaren, Jana K.; Zimmerman, Paul M.; Waymouth, Robert M. Ligand-Induced Reductive Elimination of Ethane from Azopyridine Palladium Dimethyl Complexes. Journal of the American Chemical Society, 2018, 140, 11408-11415 |
| 4132780 | CIF | C77 H62 F3 Fe3 Mn N12 O8 S | P 1 21 1 | 12.2741; 19.4126; 15.5112 90; 108.397; 90 | 3507 | Reed, Christopher J.; Agapie, Theodor Thermodynamics of Proton and Electron Transfer in Tetranuclear Clusters with Mn-OH<sub>2</sub>/OH Motifs Relevant to H<sub>2</sub>O Activation by the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 10900-10908 |
| 4132781 | CIF | C105.06 H80.97 B Cl0.46 F3 Fe3 Mn N12 O10.47 S | P -1 | 14.2908; 15.9691; 24.3709 71.236; 75.366; 70.262 | 4891.6 | Reed, Christopher J.; Agapie, Theodor Thermodynamics of Proton and Electron Transfer in Tetranuclear Clusters with Mn-OH<sub>2</sub>/OH Motifs Relevant to H<sub>2</sub>O Activation by the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 10900-10908 |
| 4132782 | CIF | C76 H53.5 F9 Fe3 Mn N13.38 O14.12 S3 | C 1 2/c 1 | 44.125; 14.3106; 24.8034 90; 90.402; 90 | 15661.9 | Reed, Christopher J.; Agapie, Theodor Thermodynamics of Proton and Electron Transfer in Tetranuclear Clusters with Mn-OH<sub>2</sub>/OH Motifs Relevant to H<sub>2</sub>O Activation by the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 10900-10908 |
| 4132783 | CIF | C72 H62 F6 Fe3 Mn N12 O13 S2 | P 1 21/c 1 | 12.2685; 29.896; 19.6152 90; 92.393; 90 | 7188.2 | Reed, Christopher J.; Agapie, Theodor Thermodynamics of Proton and Electron Transfer in Tetranuclear Clusters with Mn-OH<sub>2</sub>/OH Motifs Relevant to H<sub>2</sub>O Activation by the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 10900-10908 |
| 4132784 | CIF | C67 H49 F3 Fe3 Mn N12 O8 S | C 1 2/c 1 | 14.7283; 19.3808; 45.518 90; 92.474; 90 | 12980.8 | Reed, Christopher J.; Agapie, Theodor Thermodynamics of Proton and Electron Transfer in Tetranuclear Clusters with Mn-OH<sub>2</sub>/OH Motifs Relevant to H<sub>2</sub>O Activation by the Oxygen Evolving Complex in Photosystem II. Journal of the American Chemical Society, 2018, 140, 10900-10908 |
| 4132785 | CIF | C20 H15 Br O3 | P 1 21 1 | 8.048; 5.946; 34.639 90; 95.953; 90 | 1648.7 | Cao, Yi-Ming; Lentz, Dieter; Christmann, Mathias Synthesis of Enantioenriched Bromohydrins via Divergent Reactions of Racemic Intermediates from Anchimeric Oxygen Borrowing. Journal of the American Chemical Society, 2018, 140, 10677-10681 |
| 4132786 | CIF | C23 H30 O4 | P 21 21 21 | 6.7003; 14.5512; 20.4826 90; 90; 90 | 1997 | Wang, Yu; Ju, Wei; Tian, Hailong; Tian, Weisheng; Gui, Jinghan Scalable Synthesis of Cyclocitrinol. Journal of the American Chemical Society, 2018, 140, 9413-9416 |
| 4132787 | CIF | C52 H83 Co F3 N6 O9 S | C 1 c 1 | 26.483; 21.984; 20.235 90; 106.187; 90 | 11314 | Shevick, Sophia L.; Obradors, Carla; Shenvi, Ryan A. Mechanistic Interrogation of Co/Ni-Dual Catalyzed Hydroarylation. Journal of the American Chemical Society, 2018, 140, 12056-12068 |
| 4132788 | CIF | C54 H22 Br2 N4 O8 | P -1 | 15.4448; 19.9037; 26.3807 86.411; 82.181; 79.782 | 7900.7 | Ball, Melissa L.; Zhang, Boyuan; Xu, Qizhi; Paley, Daniel W.; Ritter, Virginia Cary; Ng, Fay; Steigerwald, Michael L.; Nuckolls, Colin Influence of Molecular Conformation on Electron Transport in Giant, Conjugated Macrocycles. Journal of the American Chemical Society, 2018, 140, 10135-10139 |
| 4132789 | CIF | C21 H22 F12 N2 O3 W | P 1 21/n 1 | 9.16344; 15.7018; 17.4999 90; 95.5026; 90 | 2506.33 | Chan, Ka Wing; Lam, Erwin; D'Anna, Vincenza; Allouche, Florian; Michel, Carine; Safonova, Olga V.; Sautet, Philippe; Copéret, Christophe C-H Activation and Proton Transfer Initiate Alkene Metathesis Activity of the Tungsten(IV)-Oxo Complex. Journal of the American Chemical Society, 2018, 140, 11395-11401 |
| 4132790 | CIF | C23 H21 F12 N3 O3 W | P 1 21/c 1 | 14.6224; 15.5338; 24.4917 90; 92.123; 90 | 5559.26 | Chan, Ka Wing; Lam, Erwin; D'Anna, Vincenza; Allouche, Florian; Michel, Carine; Safonova, Olga V.; Sautet, Philippe; Copéret, Christophe C-H Activation and Proton Transfer Initiate Alkene Metathesis Activity of the Tungsten(IV)-Oxo Complex. Journal of the American Chemical Society, 2018, 140, 11395-11401 |
| 4132791 | CIF | C29 H59 Cl2 N O9 Si2 W | P 1 21 1 | 9.45008; 14.9417; 14.5852 90; 99.0652; 90 | 2033.71 | Chan, Ka Wing; Lam, Erwin; D'Anna, Vincenza; Allouche, Florian; Michel, Carine; Safonova, Olga V.; Sautet, Philippe; Copéret, Christophe C-H Activation and Proton Transfer Initiate Alkene Metathesis Activity of the Tungsten(IV)-Oxo Complex. Journal of the American Chemical Society, 2018, 140, 11395-11401 |
| 4132792 | CIF | C39 H69 N3 O9 Si2 W | P c c n | 19.9297; 28.037; 16.571 90; 90; 90 | 9259.4 | Chan, Ka Wing; Lam, Erwin; D'Anna, Vincenza; Allouche, Florian; Michel, Carine; Safonova, Olga V.; Sautet, Philippe; Copéret, Christophe C-H Activation and Proton Transfer Initiate Alkene Metathesis Activity of the Tungsten(IV)-Oxo Complex. Journal of the American Chemical Society, 2018, 140, 11395-11401 |
| 4132793 | CIF | C20 H20 F12 N2 O3 W | P 1 21/n 1 | 9.9222; 15.4195; 15.579 90; 93.791; 90 | 2378.3 | Chan, Ka Wing; Lam, Erwin; D'Anna, Vincenza; Allouche, Florian; Michel, Carine; Safonova, Olga V.; Sautet, Philippe; Copéret, Christophe C-H Activation and Proton Transfer Initiate Alkene Metathesis Activity of the Tungsten(IV)-Oxo Complex. Journal of the American Chemical Society, 2018, 140, 11395-11401 |
| 4132794 | CIF | C23 H15 F18 N3 O3 W | P -1 | 9.8228; 9.9086; 14.9056 89.146; 75.888; 78.116 | 1375.87 | Chan, Ka Wing; Lam, Erwin; D'Anna, Vincenza; Allouche, Florian; Michel, Carine; Safonova, Olga V.; Sautet, Philippe; Copéret, Christophe C-H Activation and Proton Transfer Initiate Alkene Metathesis Activity of the Tungsten(IV)-Oxo Complex. Journal of the American Chemical Society, 2018, 140, 11395-11401 |
| 4132795 | CIF | C24 H29 N O2 | C 1 2 1 | 18.6672; 6.4223; 16.6077 90; 90.374; 90 | 1990.99 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132796 | CIF | C25 H32 B N O2 | P 21 21 21 | 9.2547; 14.4223; 16.4644 90; 90; 90 | 2197.57 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132797 | CIF | C19 H21 N O2 | R -3 :H | 32.768; 32.768; 7.461 90; 90; 120 | 6938 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132798 | CIF | C19 H21 N O | P b c a | 6.69; 14.091; 31.349 90; 90; 90 | 2955.2 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132799 | CIF | C22 H23 N O | P 1 21/c 1 | 7.9251; 28.218; 7.5682 90; 95.489; 90 | 1684.72 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132800 | CIF | C28 H38 B N O2 | P b c a | 18.2222; 17.2648; 16.207 90; 90; 90 | 5098.8 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132801 | CIF | C22 H24 N2 | C 1 2/c 1 | 15.0877; 11.8705; 19.9549 90; 99.75; 90 | 3522.3 | Panda, Santanu; Ready, Joseph M. Tandem Allylation/1,2-Boronate Rearrangement for the Asymmetric Synthesis of Indolines with Adjacent Quaternary Stereocenters. Journal of the American Chemical Society, 2018, 140, 13242-13252 |
| 4132802 | CIF | C27 H17 Br O2 | P 1 21 1 | 10.66779; 13.865; 13.5618 90; 94.8127; 90 | 1998.84 | Wen, Wei; Chen, Lei; Luo, Ming-Jing; Zhang, Yan; Chen, Ying-Chun; Ouyang, Qin; Guo, Qi-Xiang Chiral Aldehyde Catalysis for the Catalytic Asymmetric Activation of Glycine Esters. Journal of the American Chemical Society, 2018, 140, 9774-9780 |
| 4132803 | CIF | C24 H32 N2 O3 | P 1 21 1 | 9.609; 8.9512; 12.4737 90; 101.073; 90 | 1052.92 | Shang, Ming; Chan, Jessica Z.; Cao, Min; Chang, Yejin; Wang, Qifan; Cook, Brennan; Torker, Sebastian; Wasa, Masayuki C-H Functionalization of Amines via Alkene-Derived Nucleophiles through Cooperative Action of Chiral and Achiral Lewis Acid Catalysts: Applications in Enantioselective Synthesis. Journal of the American Chemical Society, 2018, 140, 10593-10601 |
| 4132804 | CIF | C25 H36 N2 O4 | P 21 21 21 | 7.8167; 15.1723; 20.1325 90; 90; 90 | 2387.66 | Shang, Ming; Chan, Jessica Z.; Cao, Min; Chang, Yejin; Wang, Qifan; Cook, Brennan; Torker, Sebastian; Wasa, Masayuki C-H Functionalization of Amines via Alkene-Derived Nucleophiles through Cooperative Action of Chiral and Achiral Lewis Acid Catalysts: Applications in Enantioselective Synthesis. Journal of the American Chemical Society, 2018, 140, 10593-10601 |
| 4132805 | CIF | C12.5 H10.5 N5.5 O5.5 Zn | I -4 m 2 | 15.6389; 15.6389; 13.9429 90; 90; 90 | 3410.09 | Xu, Li-Li; Zhang, Hai-Feng; Li, Mian; Ng, Seik Weng; Feng, Jiang-He; Mao, Jiang-Gao; Li, Dan Chiroptical Activity from an Achiral Biological Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 11569-11572 |
| 4132806 | CIF | C11 H9 N6 O5.5 Zn | P c c n | 15.0337; 15.0402; 25.0437 90; 90; 90 | 5662.63 | Xu, Li-Li; Zhang, Hai-Feng; Li, Mian; Ng, Seik Weng; Feng, Jiang-He; Mao, Jiang-Gao; Li, Dan Chiroptical Activity from an Achiral Biological Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 11569-11572 |
| 4132807 | CIF | C12.5 H10.5 N5.5 O5.5 Zn | I -4 m 2 | 15.6362; 15.6362; 13.9515 90; 90; 90 | 3411.01 | Xu, Li-Li; Zhang, Hai-Feng; Li, Mian; Ng, Seik Weng; Feng, Jiang-He; Mao, Jiang-Gao; Li, Dan Chiroptical Activity from an Achiral Biological Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 11569-11572 |
| 4132808 | CIF | C58 H32 N6 O9 V Zn2 | P 4 | 16.644; 16.644; 13.854 90; 90; 90 | 3837.9 | Yamabayashi, Tsutomu; Atzori, Matteo; Tesi, Lorenzo; Cosquer, Goulven; Santanni, Fabio; Boulon, Marie-Emmanuelle; Morra, Elena; Benci, Stefano; Torre, Renato; Chiesa, Mario; Sorace, Lorenzo; Sessoli, Roberta; Yamashita, Masahiro Scaling Up Electronic Spin Qubits into a Three-Dimensional Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 12090-12101 |
| 4132809 | CIF | C44 H28 N4 O Ti | I 4 | 13.3796; 13.3796; 9.7766 90; 90; 90 | 1750.15 | Yamabayashi, Tsutomu; Atzori, Matteo; Tesi, Lorenzo; Cosquer, Goulven; Santanni, Fabio; Boulon, Marie-Emmanuelle; Morra, Elena; Benci, Stefano; Torre, Renato; Chiesa, Mario; Sorace, Lorenzo; Sessoli, Roberta; Yamashita, Masahiro Scaling Up Electronic Spin Qubits into a Three-Dimensional Metal-Organic Framework. Journal of the American Chemical Society, 2018, 140, 12090-12101 |
| 4132810 | CIF | C23 H30 N4 O | P 1 21/c 1 | 12.8801; 14.6375; 11.2233 90; 93.525; 90 | 2111.95 | Siu, Juno C.; Sauer, Gregory S.; Saha, Ambarneil; Macey, Reed L.; Fu, Niankai; Chauviré, Timothée; Lancaster, Kyle M.; Lin, Song Electrochemical Azidooxygenation of Alkenes Mediated by a TEMPO-N<sub>3</sub> Charge-Transfer Complex. Journal of the American Chemical Society, 2018, 140, 12511-12520 |
| 4132811 | CIF | C44 H96 Cl4 O164 Zr36 | F m m 2 | 34.835; 43.607; 15.766 90; 90; 90 | 23949 | Choi, Jong In; Chun, Hyungphil; Lah, Myoung Soo Zirconium-Formate Macrocycles and Supercage: Molecular Packing versus MOF-like Network for Water Vapor Sorption. Journal of the American Chemical Society, 2018, 140, 10915-10920 |
| 4132812 | CIF | C48 H96 Cl3 K3 O168 Zr36 | I -4 3 m | 37.539; 37.539; 37.539 90; 90; 90 | 52899 | Choi, Jong In; Chun, Hyungphil; Lah, Myoung Soo Zirconium-Formate Macrocycles and Supercage: Molecular Packing versus MOF-like Network for Water Vapor Sorption. Journal of the American Chemical Society, 2018, 140, 10915-10920 |
| 4132813 | CIF | C47 H29 B F17 P | P -1 | 12.5727; 13.0829; 13.4393 94.145; 96.365; 107.952 | 2076.7 | Mandal, Dipendu; Gupta, Richa; Young, Rowan D. Selective Monodefluorination and Wittig Functionalization of gem-Difluoromethyl Groups to Generate Monofluoroalkenes. Journal of the American Chemical Society, 2018, 140, 10682-10686 |
| 4132814 | CIF | C34 H40 Cl6 Mn2 N2 O12 | P -3 1 m | 14.0315; 14.0315; 10.2484 90; 90; 120 | 1747.4 | Liu, Lujia; Li, Liang; DeGayner, Jordan A.; Winegar, Peter H.; Fang, Yu; Harris, T. David Harnessing Structural Dynamics in a 2D Manganese-Benzoquinoid Framework To Dramatically Accelerate Metal Transport in Diffusion-Limited Metal Exchange Reactions. Journal of the American Chemical Society, 2018, 140, 11444-11453 |
| 4132815 | CIF | C36 H42 Cl6 Co3 N6 O18 | P -3 1 m | 13.657; 13.657; 9.7446 90; 90; 120 | 1574 | Liu, Lujia; Li, Liang; DeGayner, Jordan A.; Winegar, Peter H.; Fang, Yu; Harris, T. David Harnessing Structural Dynamics in a 2D Manganese-Benzoquinoid Framework To Dramatically Accelerate Metal Transport in Diffusion-Limited Metal Exchange Reactions. Journal of the American Chemical Society, 2018, 140, 11444-11453 |
| 4132816 | CIF | C36 H42 Cl6 N6 O18 Zn3 | P -3 1 m | 13.729; 13.729; 9.58 90; 90; 120 | 1563.8 | Liu, Lujia; Li, Liang; DeGayner, Jordan A.; Winegar, Peter H.; Fang, Yu; Harris, T. David Harnessing Structural Dynamics in a 2D Manganese-Benzoquinoid Framework To Dramatically Accelerate Metal Transport in Diffusion-Limited Metal Exchange Reactions. Journal of the American Chemical Society, 2018, 140, 11444-11453 |
| 4132817 | CIF | C34 H40 Cl6 Co2 N2 O12 | P -3 1 m | 13.7048; 13.7048; 10.1772 90; 90; 120 | 1655.4 | Liu, Lujia; Li, Liang; DeGayner, Jordan A.; Winegar, Peter H.; Fang, Yu; Harris, T. David Harnessing Structural Dynamics in a 2D Manganese-Benzoquinoid Framework To Dramatically Accelerate Metal Transport in Diffusion-Limited Metal Exchange Reactions. Journal of the American Chemical Society, 2018, 140, 11444-11453 |
| 4132818 | CIF | C150 H134 Au10 Cl2 O P8 Pd | P 1 21/c 1 | 22.04; 18.983; 34.465 90; 97.799; 90 | 14286 | Takano, Shinjiro; Hirai, Haru; Muramatsu, Satoru; Tsukuda, Tatsuya Hydride-Mediated Controlled Growth of a Bimetallic (Pd@Au<sub>8</sub>)<sup>2+</sup> Superatom to a Hydride-Doped (HPd@Au<sub>10</sub>)<sup>3+</sup> Superatom. Journal of the American Chemical Society, 2018, 140, 12314-12317 |
| 4132819 | CIF | C12.76 H5 O16 Zr3 | I m m a | 25.297; 28.549; 13.719 90; 90; 90 | 9908 | Zhang, Yuanyuan; Zhang, Xuan; Lyu, Jiafei; Otake, Ken-Ichi; Wang, Xingjie; Redfern, Louis R.; Malliakas, Christos D.; Li, Zhanyong; Islamoglu, Timur; Wang, Bo; Farha, Omar K. A Flexible Metal-Organic Framework with 4-Connected Zr<sub>6</sub> Nodes. Journal of the American Chemical Society, 2018, 140, 11179-11183 |
| 4132820 | CIF | C13 H6 O16 Zr3 | I m m a | 25.238; 26.867; 16.779 90; 90; 90 | 11377 | Zhang, Yuanyuan; Zhang, Xuan; Lyu, Jiafei; Otake, Ken-Ichi; Wang, Xingjie; Redfern, Louis R.; Malliakas, Christos D.; Li, Zhanyong; Islamoglu, Timur; Wang, Bo; Farha, Omar K. A Flexible Metal-Organic Framework with 4-Connected Zr<sub>6</sub> Nodes. Journal of the American Chemical Society, 2018, 140, 11179-11183 |
| 4132821 | CIF | C13 H5 O16 Zr3 | I m m a | 25.325; 28.408; 14.2372 90; 90; 90 | 10242.7 | Zhang, Yuanyuan; Zhang, Xuan; Lyu, Jiafei; Otake, Ken-Ichi; Wang, Xingjie; Redfern, Louis R.; Malliakas, Christos D.; Li, Zhanyong; Islamoglu, Timur; Wang, Bo; Farha, Omar K. A Flexible Metal-Organic Framework with 4-Connected Zr<sub>6</sub> Nodes. Journal of the American Chemical Society, 2018, 140, 11179-11183 |
| 4132822 | CIF | C11.87 H5 O16 Zr3 | I m m a | 25.1372; 28.199; 15.8108 90; 90; 90 | 11207.4 | Zhang, Yuanyuan; Zhang, Xuan; Lyu, Jiafei; Otake, Ken-Ichi; Wang, Xingjie; Redfern, Louis R.; Malliakas, Christos D.; Li, Zhanyong; Islamoglu, Timur; Wang, Bo; Farha, Omar K. A Flexible Metal-Organic Framework with 4-Connected Zr<sub>6</sub> Nodes. Journal of the American Chemical Society, 2018, 140, 11179-11183 |
| 4132823 | CIF | C13 H3 O16 Zr4.8 | I m m a | 25.1305; 26.1041; 18.9051 90; 90; 90 | 12401.9 | Zhang, Yuanyuan; Zhang, Xuan; Lyu, Jiafei; Otake, Ken-Ichi; Wang, Xingjie; Redfern, Louis R.; Malliakas, Christos D.; Li, Zhanyong; Islamoglu, Timur; Wang, Bo; Farha, Omar K. A Flexible Metal-Organic Framework with 4-Connected Zr<sub>6</sub> Nodes. Journal of the American Chemical Society, 2018, 140, 11179-11183 |
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