Crystallography Open Database
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COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
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4134472 | CIF | F H8 N2 O3 P | P n a 21 | 7.9296; 11.3383; 6.0243 90; 90; 90 | 541.63 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134473 | CIF | F H8 N2 O3 P | P n a 21 | 7.9292; 11.3401; 6.0235 90; 90; 90 | 541.62 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134474 | CIF | F H8 N2 O3 P | P 1 21/n 1 | 6.0598; 7.8788; 11.2274 90; 92.234; 90 | 535.63 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134475 | CIF | F H8 N2 O3 P | P 1 21/n 1 | 6.0581; 7.8735; 11.2215 90; 92.254; 90 | 534.83 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134476 | CIF | F H8 N2 O3 P | P 1 21/n 1 | 6.0577; 7.8714; 11.2223 90; 92.255; 90 | 534.69 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134477 | CIF | F H6.45 K0.39 N1.61 O3 P | P n a 21 | 7.9345; 11.0298; 5.9653 90; 90; 90 | 522.06 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134478 | CIF | F0.8 H6.4 K0.13 N1.47 O2.4 P0.8 | P n a 21 | 7.9362; 11.2076; 6.0017 90; 90; 90 | 533.83 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134479 | CIF | F H8 K0.04 N1.96 O3 P | P n a 21 | 7.9368; 11.2965; 6.0229 90; 90; 90 | 540 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134480 | CIF | F H8 K0.01 N2 O3 P | P n a 21 | 7.9319; 11.295; 6.019 90; 90; 90 | 539.25 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134481 | CIF | F0.8 H6.4 K0.03 N1.57 O2.4 P0.8 | P n a 21 | 7.9299; 11.2968; 6.0169 90; 90; 90 | 539.01 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134482 | CIF | F H8 K0.02 N1.98 O3 P | P n a 21 | 7.9285; 11.3009; 6.0152 90; 90; 90 | 538.96 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134483 | CIF | F H8 K0.04 N1.96 O3 P | P 1 21/n 1 | 6.041; 7.874; 11.1841 90; 92.26; 90 | 531.58 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134484 | CIF | F H8 K0.06 N1.94 O3 P | P 1 21/n 1 | 6.0404; 7.8708; 11.1807 90; 92.268; 90 | 531.15 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134485 | CIF | F H8 K0.05 N1.94 O3 P | P 1 21/n 1 | 6.0398; 7.8673; 11.1779 90; 92.279; 90 | 530.72 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134486 | CIF | F H8 K0.05 N1.95 O3 P | P 1 21/n 1 | 6.0398; 7.8659; 11.1767 90; 92.289; 90 | 530.56 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134487 | CIF | F H8 K0.06 N1.94 O3 P | P 1 21/n 1 | 6.0395; 7.8631; 11.1748 90; 92.309; 90 | 530.25 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134488 | CIF | F H8 K0.29 N1.71 O3 P | P n a 21 | 7.9297; 11.1111; 5.982 90; 90; 90 | 527.06 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134489 | CIF | F H8 K0.28 N1.72 O3 P | P n a 21 | 7.9247; 11.1134; 5.9812 90; 90; 90 | 526.77 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134490 | CIF | F H8 K0.3 N1.71 O3 P | P n a 21 | 7.9171; 11.109; 5.9766 90; 90; 90 | 525.65 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134491 | CIF | F H8 K0.28 N1.72 O3 P | P n a 21 | 7.9076; 11.0973; 5.9692 90; 90; 90 | 523.82 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134492 | CIF | F H6.89 K0.28 N1.72 O3 P | P n a 21 | 7.9057; 11.0964; 5.9676 90; 90; 90 | 523.51 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134493 | CIF | F H6.86 K0.28 N1.72 O3 P | P n a 21 | 7.9048; 11.0997; 5.9682 90; 90; 90 | 523.66 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134494 | CIF | F H8 K0.27 N1.73 O3 P | P 1 21/n 1 | 5.9813; 7.8672; 10.9965 90; 91.916; 90 | 517.16 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134495 | CIF | F H8 K0.27 N1.73 O3 P | P 1 21/n 1 | 5.9756; 7.862; 10.9873 90; 91.939; 90 | 515.89 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134496 | CIF | F H8 K0.27 N1.73 O3 P | P 1 21/n 1 | 5.9761; 7.8611; 10.987 90; 91.941; 90 | 515.86 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134497 | CIF | F H5.27 K0.68 N1.32 O3 P | P n a 21 | 7.9303; 10.8767; 5.933 90; 90; 90 | 511.75 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134498 | CIF | F H8 K0.03 N1.97 O3 P | P n a 21 | 7.9395; 11.3139; 6.0289 90; 90; 90 | 541.56 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134499 | CIF | F H8 K0.01 N1.99 O3 P | P n a 21 | 7.9325; 11.313; 6.0242 90; 90; 90 | 540.61 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134500 | CIF | F H8 K0.03 N1.97 O3 P | P n a 21 | 7.9299; 11.3151; 6.0217 90; 90; 90 | 540.31 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134501 | CIF | F H8 K0 N2 O3 P | P 1 21/n 1 | 6.0443; 7.8705; 11.1958 90; 92.271; 90 | 532.18 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134502 | CIF | F H8 K0.01 N1.99 O3 P | P 1 21/n 1 | 6.0447; 7.8661; 11.1926 90; 92.297; 90 | 531.76 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134503 | CIF | F H8 K0.03 N1.97 O3 P | P 1 21/n 1 | 6.0454; 7.8617; 11.189 90; 92.319; 90 | 531.35 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134504 | CIF | F H8 K0.03 N1.97 O3 P | P 1 21/n 1 | 6.0442; 7.8558; 11.1835 90; 92.34; 90 | 530.57 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134505 | CIF | F H8 K0.04 N1.97 O3 P | P 1 21/n 1 | 6.043; 7.8506; 11.178 90; 92.373; 90 | 529.84 | Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i><sub>c</sub>. Journal of the American Chemical Society, 2020, 142, 6423-6431 |
4134506 | CIF | C2 H11 I3 N2 Pb | P 1 21/c 1 | 10.8379; 15.0057; 7.9077 90; 107.595; 90 | 1225.9 | Huang, Xiaofeng; Chen, Ruihao; Deng, Guocheng; Han, Faming; Ruan, Pengpeng; Cheng, Fangwen; Yin, Jun; Wu, Binghui; Zheng, Nanfeng Methylamine-Dimer-Induced Phase Transition toward MAPbI<sub>3</sub> Films and High-Efficiency Perovskite Solar Modules. Journal of the American Chemical Society, 2020, 142, 6149-6157 |
4134507 | CIF | C7 H40 Cl0.23 I8.77 N7 Pb2 | P 1 21/c 1 | 13.7722; 14.9103; 19.1625 90; 69.247; 90 | 3679.7 | Huang, Xiaofeng; Chen, Ruihao; Deng, Guocheng; Han, Faming; Ruan, Pengpeng; Cheng, Fangwen; Yin, Jun; Wu, Binghui; Zheng, Nanfeng Methylamine-Dimer-Induced Phase Transition toward MAPbI<sub>3</sub> Films and High-Efficiency Perovskite Solar Modules. Journal of the American Chemical Society, 2020, 142, 6149-6157 |
4134508 | CIF | F3 K Mo O2 | P 21 21 21 | 11.3793; 11.8884; 12.7447 90; 90; 90 | 1724.12 | Hancock, Justin C.; Nisbet, Matthew L.; Zhang, Weiguo; Halasyamani, P. Shiv; Poeppelmeier, Kenneth R. Periodic Tendril Perversion and Helices in the AMoO<sub>2</sub>F<sub>3</sub> (A = K, Rb, NH<sub>4</sub>, Tl) Family. Journal of the American Chemical Society, 2020, 142, 6375-6380 |
4134509 | CIF | F3 K Mo O2 | P 21 21 21 | 11.3563; 11.8657; 12.7391 90; 90; 90 | 1716.6 | Hancock, Justin C.; Nisbet, Matthew L.; Zhang, Weiguo; Halasyamani, P. Shiv; Poeppelmeier, Kenneth R. Periodic Tendril Perversion and Helices in the AMoO<sub>2</sub>F<sub>3</sub> (A = K, Rb, NH<sub>4</sub>, Tl) Family. Journal of the American Chemical Society, 2020, 142, 6375-6380 |
4134510 | CIF | F3 Mo O2 Rb | C 1 2/c 1 | 8.4691; 13.3818; 28.188 90; 95.692; 90 | 3178.8 | Hancock, Justin C.; Nisbet, Matthew L.; Zhang, Weiguo; Halasyamani, P. Shiv; Poeppelmeier, Kenneth R. Periodic Tendril Perversion and Helices in the AMoO<sub>2</sub>F<sub>3</sub> (A = K, Rb, NH<sub>4</sub>, Tl) Family. Journal of the American Chemical Society, 2020, 142, 6375-6380 |
4134511 | CIF | F3 Mo O2 Tl | C 1 2/c 1 | 8.3492; 13.4494; 28.2717 90; 95.004; 90 | 3162.6 | Hancock, Justin C.; Nisbet, Matthew L.; Zhang, Weiguo; Halasyamani, P. Shiv; Poeppelmeier, Kenneth R. Periodic Tendril Perversion and Helices in the AMoO<sub>2</sub>F<sub>3</sub> (A = K, Rb, NH<sub>4</sub>, Tl) Family. Journal of the American Chemical Society, 2020, 142, 6375-6380 |
4134512 | CIF | F3 Mo N O2 | C 1 2/c 1 | 8.4774; 13.3966; 28.4385 90; 95.073; 90 | 3217.06 | Hancock, Justin C.; Nisbet, Matthew L.; Zhang, Weiguo; Halasyamani, P. Shiv; Poeppelmeier, Kenneth R. Periodic Tendril Perversion and Helices in the AMoO<sub>2</sub>F<sub>3</sub> (A = K, Rb, NH<sub>4</sub>, Tl) Family. Journal of the American Chemical Society, 2020, 142, 6375-6380 |
4134513 | CIF | C12 H20 N2 O2 S2 | P 21 21 21 | 7.4499; 10.1587; 19.0266 90; 90; 90 | 1439.96 | Roos, Casey B.; Demaerel, Joachim; Graff, David E.; Knowles, Robert R. Enantioselective Hydroamination of Alkenes with Sulfonamides Enabled by Proton-Coupled Electron Transfer. Journal of the American Chemical Society, 2020, 142, 5974-5979 |
4134514 | CIF | C15 H21 N O3 S | P 21 21 21 | 7.5385; 11.336; 17.2319 90; 90; 90 | 1472.58 | Roos, Casey B.; Demaerel, Joachim; Graff, David E.; Knowles, Robert R. Enantioselective Hydroamination of Alkenes with Sulfonamides Enabled by Proton-Coupled Electron Transfer. Journal of the American Chemical Society, 2020, 142, 5974-5979 |
4134515 | CIF | C37 H22 Au B Cl2 F4 N2 | C 1 2/c 1 | 26.4032; 17.2822; 15.4213 90; 113.881; 90 | 6434.4 | Reiersølmoen, Ann Christin; Csókás, Dániel; Øien-Ødegaard, Sigurd; Vanderkooy, Alan; Gupta, Arvind Kumar; Carlsson, Anna-Carin C; Orthaber, Andreas; Fiksdahl, Anne; Pápai, Imre; Erdélyi, Máté Catalytic Activity of <i>trans</i>-Bis(pyridine)gold Complexes. Journal of the American Chemical Society, 2020, 142, 6439-6446 |
4134516 | CIF | C26 H20 Au2 Cl6 N2 O2 | P n a 21 | 32.117; 12.282; 8.293 90; 90; 90 | 3271 | Reiersølmoen, Ann Christin; Csókás, Dániel; Øien-Ødegaard, Sigurd; Vanderkooy, Alan; Gupta, Arvind Kumar; Carlsson, Anna-Carin C; Orthaber, Andreas; Fiksdahl, Anne; Pápai, Imre; Erdélyi, Máté Catalytic Activity of <i>trans</i>-Bis(pyridine)gold Complexes. Journal of the American Chemical Society, 2020, 142, 6439-6446 |
4134517 | CIF | C73 H42 Au4 Cl10 N4 | C 1 c 1 | 26.339; 15.8633; 20.316 90; 125.911; 90 | 6875.1 | Reiersølmoen, Ann Christin; Csókás, Dániel; Øien-Ødegaard, Sigurd; Vanderkooy, Alan; Gupta, Arvind Kumar; Carlsson, Anna-Carin C; Orthaber, Andreas; Fiksdahl, Anne; Pápai, Imre; Erdélyi, Máté Catalytic Activity of <i>trans</i>-Bis(pyridine)gold Complexes. Journal of the American Chemical Society, 2020, 142, 6439-6446 |
4134518 | CIF | C84 H12 Cu6 F42 O18 | R -3 m :H | 14.22334; 14.22334; 37.3147 90; 90; 120 | 6537.53 | Zhan, Shun-Ze; Zhang, Guo-Hui; Li, Jing-Hong; Liu, Jia-Li; Zhu, Si-Hui; Lu, Weigang; Zheng, Ji; Ng, Seik Weng; Li, Dan Exohedral Cuprofullerene: Sequentially Expanding Metal Olefin Up to a C<sub>60</sub>@Cu<sub>24</sub> Rhombicuboctahedron. Journal of the American Chemical Society, 2020, 142, 5943-5947 |
4134519 | CIF | C137 H32 Cl2 Cu13 F113 O42 | P -1 | 13.5207; 18.2853; 18.8367 107.685; 108.685; 95.644 | 4103.1 | Zhan, Shun-Ze; Zhang, Guo-Hui; Li, Jing-Hong; Liu, Jia-Li; Zhu, Si-Hui; Lu, Weigang; Zheng, Ji; Ng, Seik Weng; Li, Dan Exohedral Cuprofullerene: Sequentially Expanding Metal Olefin Up to a C<sub>60</sub>@Cu<sub>24</sub> Rhombicuboctahedron. Journal of the American Chemical Society, 2020, 142, 5943-5947 |
4134520 | CIF | C148 H92 Cu24 F72 O78 | P -1 | 17.717; 17.7627; 17.8073 63.11; 88.8395; 86.946 | 4990.9 | Zhan, Shun-Ze; Zhang, Guo-Hui; Li, Jing-Hong; Liu, Jia-Li; Zhu, Si-Hui; Lu, Weigang; Zheng, Ji; Ng, Seik Weng; Li, Dan Exohedral Cuprofullerene: Sequentially Expanding Metal Olefin Up to a C<sub>60</sub>@Cu<sub>24</sub> Rhombicuboctahedron. Journal of the American Chemical Society, 2020, 142, 5943-5947 |
4134521 | CIF | C210 H162 Cl6 Cu24 O72 | R -3 :H | 25.6664; 25.6664; 24.6267 90; 90; 120 | 14049.7 | Zhan, Shun-Ze; Zhang, Guo-Hui; Li, Jing-Hong; Liu, Jia-Li; Zhu, Si-Hui; Lu, Weigang; Zheng, Ji; Ng, Seik Weng; Li, Dan Exohedral Cuprofullerene: Sequentially Expanding Metal Olefin Up to a C<sub>60</sub>@Cu<sub>24</sub> Rhombicuboctahedron. Journal of the American Chemical Society, 2020, 142, 5943-5947 |
4134522 | CIF | C29 H31 B N4 | P -1 | 10.3229; 10.4949; 12.5496 103.081; 93.1613; 99.9907 | 1297.9 | Dai, Wen; Geib, Steven J.; Curran, Dennis P. 1,4-Hydroboration Reactions of Electron-Poor Aromatic Rings by N-Heterocyclic Carbene Boranes. Journal of the American Chemical Society, 2020 |
4134523 | CIF | C14 H16 B N3 O2 | P 1 21/n 1 | 7.4387; 14.1565; 13.7009 90; 101.908; 90 | 1411.74 | Dai, Wen; Geib, Steven J.; Curran, Dennis P. 1,4-Hydroboration Reactions of Electron-Poor Aromatic Rings by N-Heterocyclic Carbene Boranes. Journal of the American Chemical Society, 2020 |
4134524 | CIF | C13 H15 B N4 | P 21 21 21 | 8.2143; 11.985; 13.161 90; 90; 90 | 1295.68 | Dai, Wen; Geib, Steven J.; Curran, Dennis P. 1,4-Hydroboration Reactions of Electron-Poor Aromatic Rings by N-Heterocyclic Carbene Boranes. Journal of the American Chemical Society, 2020 |
4134525 | CIF | C90 H114 N26 O22.33 P1.33 | P a -3 | 42.4955; 42.4955; 42.4955 90; 90; 90 | 76741 | Li, Boyang; Zheng, Bo; Zhang, Wenyao; Zhang, Dan; Yang, Xiao-Juan; Wu, Biao Site-Selective Binding of Peripheral Chiral Guests Induces Stereospecificity in A<sub>4</sub>L<sub>6</sub> Tetrahedral Anion Cages. Journal of the American Chemical Society, 2020, 142, 6304-6311 |
4134526 | CIF | C90 H110 N26 O22.33 P1.33 | P a -3 | 42.271; 42.271; 42.271 90; 90; 90 | 75531 | Li, Boyang; Zheng, Bo; Zhang, Wenyao; Zhang, Dan; Yang, Xiao-Juan; Wu, Biao Site-Selective Binding of Peripheral Chiral Guests Induces Stereospecificity in A<sub>4</sub>L<sub>6</sub> Tetrahedral Anion Cages. Journal of the American Chemical Society, 2020, 142, 6304-6311 |
4134527 | CIF | C86 H108 N24 O22.33 P1.33 | P 21 3 | 32.2178; 32.2178; 32.2178 90; 90; 90 | 33442 | Li, Boyang; Zheng, Bo; Zhang, Wenyao; Zhang, Dan; Yang, Xiao-Juan; Wu, Biao Site-Selective Binding of Peripheral Chiral Guests Induces Stereospecificity in A<sub>4</sub>L<sub>6</sub> Tetrahedral Anion Cages. Journal of the American Chemical Society, 2020, 142, 6304-6311 |
4134528 | CIF | C86 H89 N24 O22.33 P1.33 | P 21 3 | 32.135; 32.135; 32.135 90; 90; 90 | 33184 | Li, Boyang; Zheng, Bo; Zhang, Wenyao; Zhang, Dan; Yang, Xiao-Juan; Wu, Biao Site-Selective Binding of Peripheral Chiral Guests Induces Stereospecificity in A<sub>4</sub>L<sub>6</sub> Tetrahedral Anion Cages. Journal of the American Chemical Society, 2020, 142, 6304-6311 |
4134529 | CIF | Cs F O7 P2 Si | P 1 21 1 | 4.5525; 7.9999; 9.5565 90; 99.77; 90 | 343 | Ding, Qingran; Liu, Xiaomeng; Zhao, Sangen; Wang, Yusong; Li, Yanqiang; Li, Lina; Liu, Shuai; Lin, Zheshuai; Hong, Maochun; Luo, Junhua Designing a Deep-UV Nonlinear Optical Fluorooxosilicophosphate. Journal of the American Chemical Society, 2020 |
4134530 | CIF | In8 Ir2 Se | P 42/m n m | 9.9447; 9.9447; 10.1091 90; 90; 90 | 999.8 | Khoury, Jason F.; Rettie, Alexander J. E.; Robredo, Iñigo; Krogstad, Matthew J.; Malliakas, Christos D.; Bergara, Aitor; Vergniory, Maia G.; Osborn, Raymond; Rosenkranz, Stephan; Chung, Duck Young; Kanatzidis, Mercouri G. The Subchalcogenides Ir<sub>2</sub>In<sub>8</sub>Q (Q = S, Se, Te): Dirac Semimetal Candidates with Re-entrant Structural Modulation. Journal of the American Chemical Society, 2020, 142, 6312-6323 |
4134531 | CIF | In8 Ir2 Te | P 1 1 m | 10.005; 10.007; 10.196 90; 90; 89.991 | 1020.8 | Khoury, Jason F.; Rettie, Alexander J. E.; Robredo, Iñigo; Krogstad, Matthew J.; Malliakas, Christos D.; Bergara, Aitor; Vergniory, Maia G.; Osborn, Raymond; Rosenkranz, Stephan; Chung, Duck Young; Kanatzidis, Mercouri G. The Subchalcogenides Ir<sub>2</sub>In<sub>8</sub>Q (Q = S, Se, Te): Dirac Semimetal Candidates with Re-entrant Structural Modulation. Journal of the American Chemical Society, 2020, 142, 6312-6323 |
4134532 | CIF | In8 Ir2 Se | P 1 1 m | 9.92; 9.9262; 10.1092 90; 90; 89.9995 | 995.43 | Khoury, Jason F.; Rettie, Alexander J. E.; Robredo, Iñigo; Krogstad, Matthew J.; Malliakas, Christos D.; Bergara, Aitor; Vergniory, Maia G.; Osborn, Raymond; Rosenkranz, Stephan; Chung, Duck Young; Kanatzidis, Mercouri G. The Subchalcogenides Ir<sub>2</sub>In<sub>8</sub>Q (Q = S, Se, Te): Dirac Semimetal Candidates with Re-entrant Structural Modulation. Journal of the American Chemical Society, 2020, 142, 6312-6323 |
4134533 | CIF | In8 Ir2 S | P 42/m n m | 9.92; 9.92; 10.14 90; 90; 90 | 997.8 | Khoury, Jason F.; Rettie, Alexander J. E.; Robredo, Iñigo; Krogstad, Matthew J.; Malliakas, Christos D.; Bergara, Aitor; Vergniory, Maia G.; Osborn, Raymond; Rosenkranz, Stephan; Chung, Duck Young; Kanatzidis, Mercouri G. The Subchalcogenides Ir<sub>2</sub>In<sub>8</sub>Q (Q = S, Se, Te): Dirac Semimetal Candidates with Re-entrant Structural Modulation. Journal of the American Chemical Society, 2020, 142, 6312-6323 |
4134534 | CIF | In8 Ir2 Te | P 42/m n m | 10.124; 10.124; 10.291 90; 90; 90 | 1054.8 | Khoury, Jason F.; Rettie, Alexander J. E.; Robredo, Iñigo; Krogstad, Matthew J.; Malliakas, Christos D.; Bergara, Aitor; Vergniory, Maia G.; Osborn, Raymond; Rosenkranz, Stephan; Chung, Duck Young; Kanatzidis, Mercouri G. The Subchalcogenides Ir<sub>2</sub>In<sub>8</sub>Q (Q = S, Se, Te): Dirac Semimetal Candidates with Re-entrant Structural Modulation. Journal of the American Chemical Society, 2020, 142, 6312-6323 |
4134535 | CIF | C65.5 H61 Cl3 O2 | P 21 21 2 | 11.6067; 26.8486; 8.9726 90; 90; 90 | 2796.07 | Miró, Javier; Gensch, Tobias; Ellwart, Mario; Han, Seo-Jung; Lin, Hsin-Hui; Sigman, Matthew S.; Toste, F. Dean Enantioselective Allenoate-Claisen Rearrangement Using Chiral Phosphate Catalysts. Journal of the American Chemical Society, 2020, 142, 6390-6399 |
4134536 | CIF | C17 H24 B F4 N | P 21 21 21 | 8.7338; 13.7551; 14.4231 90; 90; 90 | 1732.71 | Miró, Javier; Gensch, Tobias; Ellwart, Mario; Han, Seo-Jung; Lin, Hsin-Hui; Sigman, Matthew S.; Toste, F. Dean Enantioselective Allenoate-Claisen Rearrangement Using Chiral Phosphate Catalysts. Journal of the American Chemical Society, 2020, 142, 6390-6399 |
4134537 | CIF | C38 H58 Ni O P2 | P -1 | 8.8378; 12.492; 16.4162 76.737; 78.709; 79.504 | 1711.92 | Malapit, Christian A.; Borrell, Margarida; Milbauer, Michael W.; Brigham, Conor E.; Sanford, Melanie S. Nickel-Catalyzed Decarbonylative Amination of Carboxylic Acid Esters. Journal of the American Chemical Society, 2020, 142, 5918-5923 |
4134538 | CIF | C40 H59 N Ni P2 | P 1 21/c 1 | 13.1407; 18.4231; 16.9248 90; 106.562; 90 | 3927.37 | Malapit, Christian A.; Borrell, Margarida; Milbauer, Michael W.; Brigham, Conor E.; Sanford, Melanie S. Nickel-Catalyzed Decarbonylative Amination of Carboxylic Acid Esters. Journal of the American Chemical Society, 2020, 142, 5918-5923 |
4134539 | CIF | C12 H6 Cl2 F2 N2 | P 1 21/n 1 | 11.806; 3.8446; 13.595 90; 113.794; 90 | 564.6 | Konrad, David B.; Savasci, Gökcen; Allmendinger, Lars; Trauner, Dirk; Ochsenfeld, Christian; Ali, Ahmed M. Computational Design and Synthesis of a Deeply Red-Shifted and Bistable Azobenzene Journal of the American Chemical Society, 2020 |
4134540 | CIF | C12 H6 Cl4 N2 | P -1 | 8.14609; 8.27819; 32.932 94.3451; 92.6148; 118.514 | 1937.28 | Konrad, David B.; Savasci, Gökcen; Allmendinger, Lars; Trauner, Dirk; Ochsenfeld, Christian; Ali, Ahmed M. Computational Design and Synthesis of a Deeply Red-Shifted and Bistable Azobenzene Journal of the American Chemical Society, 2020 |
4134541 | CIF | C12 H6 Cl4 N2 | P 1 21/c 1 | 10.9223; 7.4039; 16.2847 90; 107.709; 90 | 1254.5 | Konrad, David B.; Savasci, Gökcen; Allmendinger, Lars; Trauner, Dirk; Ochsenfeld, Christian; Ali, Ahmed M. Computational Design and Synthesis of a Deeply Red-Shifted and Bistable Azobenzene Journal of the American Chemical Society, 2020 |
4134542 | CIF | In16 Mn4 S43 Sb6 | C 1 2/c 1 | 38.053; 24.796; 37.323 90; 103.43; 90 | 34254 | Liu, Yong; Zhang, Jiaxu; Han, Bing; Wang, Xiang; Wang, Zhiqiang; Xue, Chaozhuang; Bian, Guoqing; Hu, Dandan; Zhou, Rui; Li, Dong-Sheng; Wang, Zhenxing; Ouyang, Zhongwen; Li, Mingde; Wu, Tao New Insights into Mn-Mn Coupling Interaction-Directed Photoluminescence Quenching Mechanism in Mn<sup>2+</sup>-Doped Semiconductors. Journal of the American Chemical Society, 2020 |
4134543 | CIF | C55 H53 Br Cl8 N6 Ni2 | P 1 21/c 1 | 13.2136; 17.6293; 24.0942 90; 102.685; 90 | 5475.7 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134544 | CIF | C51 H45 K N6 Ni2 | P 1 21/n 1 | 16.8007; 15.0508; 17.0678 90; 106.969; 90 | 4127.9 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134545 | CIF | C77 H99 K N8 Ni2 O8 | P 1 21/n 1 | 15.3579; 17.4833; 27.2615 90; 95.238; 90 | 7289.3 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134546 | CIF | C59 H61.25 N6 Na Ni2 O2 | P -1 | 14.29; 18.501; 19.5019 80.688; 82.043; 81.867 | 5001.4 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134547 | CIF | C67.25 H80 N6 Na Ni2 O3.75 | P -1 | 12.7288; 15.5; 17.7274 112.663; 92.988; 99.314 | 3159.7 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134548 | CIF | C68 H71 K N6 Ni2 O3.5 | C 1 2/c 1 | 30.8579; 14.7943; 25.3281 90; 95.187; 90 | 11515.5 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134549 | CIF | C57 H55 N6 Na0.5 Ni2 O1.5 | P 1 2/c 1 | 27.7413; 10.6411; 20.9606 90; 108.051; 90 | 5882.98 | Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition. Journal of the American Chemical Society, 2020 |
4134550 | CIF | C18 H16 F6 O7 S | P 1 21/c 1 | 6.0928; 9.2223; 35.161 90; 91.673; 90 | 1974.84 | Dibrell, Sara E.; Maser, Michael R.; Reisman, Sarah E. SeO<sub>2</sub>-Mediated Oxidative Transposition of Pauson-Khand Products. Journal of the American Chemical Society, 2020 |
4134551 | CIF | C19 H28 O3 | P 1 21/n 1 | 10.2573; 11.517; 14.0879 90; 106.2; 90 | 1598.17 | Qu, Yongzheng; Wang, Zheyuan; Zhang, Zhongchao; Zhang, Wendou; Huang, Jun; Yang, Zhen Asymmetric Total Synthesis of (+)-Waihoensene. Journal of the American Chemical Society, 2020 |
4134552 | CIF | C16 H20 O2 | P 21 21 21 | 7.3618; 12.5083; 27.8448 90; 90; 90 | 2564.05 | Qu, Yongzheng; Wang, Zheyuan; Zhang, Zhongchao; Zhang, Wendou; Huang, Jun; Yang, Zhen Asymmetric Total Synthesis of (+)-Waihoensene. Journal of the American Chemical Society, 2020 |
4134553 | CIF | C41 H38.5 F12 N6 O1.25 P2 Ru | P -1 | 12.8029; 13.1575; 16.201 79.9877; 75.692; 62.241 | 2334.63 | Karges, Johannes; Heinemann, Franz; Jakubaszek, Marta; Maschietto, Federica; Subecz, Chloé; Dotou, Mazzarine; Vinck, Robin; Blacque, Olivier; Tharaud, Mickaël; Goud, Bruno; Viñuelas Zahı Nos, Emilio; Spingler, Bernhard; Ciofini, Ilaria; Gasser, Gilles Rationally Designed Long-Wavelength Absorbing Ru(II) Polypyridyl Complexes as Photosensitizers for Photodynamic Therapy. Journal of the American Chemical Society, 2020 |
4134554 | CIF | C38 H28 Br2 F12 N8 P2 Ru | P -1 | 11.4219; 12.376; 15.0464 90.834; 98.147; 101.02 | 2064.73 | Karges, Johannes; Heinemann, Franz; Jakubaszek, Marta; Maschietto, Federica; Subecz, Chloé; Dotou, Mazzarine; Vinck, Robin; Blacque, Olivier; Tharaud, Mickaël; Goud, Bruno; Viñuelas Zahı Nos, Emilio; Spingler, Bernhard; Ciofini, Ilaria; Gasser, Gilles Rationally Designed Long-Wavelength Absorbing Ru(II) Polypyridyl Complexes as Photosensitizers for Photodynamic Therapy. Journal of the American Chemical Society, 2020 |
4134555 | CIF | C38 H30 F12 N8 P2 Ru | P 1 21/c 1 | 12.4678; 27.4167; 13.2004 90; 118.159; 90 | 3978.18 | Karges, Johannes; Heinemann, Franz; Jakubaszek, Marta; Maschietto, Federica; Subecz, Chloé; Dotou, Mazzarine; Vinck, Robin; Blacque, Olivier; Tharaud, Mickaël; Goud, Bruno; Viñuelas Zahı Nos, Emilio; Spingler, Bernhard; Ciofini, Ilaria; Gasser, Gilles Rationally Designed Long-Wavelength Absorbing Ru(II) Polypyridyl Complexes as Photosensitizers for Photodynamic Therapy. Journal of the American Chemical Society, 2020 |
4134556 | CIF | C62 H16 F32 N6.67 O5.33 | P 1 21/c 1 | 8.0988; 27.1807; 20.3015 90; 97.604; 90 | 4429.7 | Ning, YingYing; Liu, Yi-Wei; Yang, Zi-Shu; Yao, Yuhang; Kang, Lei; Sessler, Jonathan L.; Zhang, Jun-Long Split and Use: Structural Isomers for Diagnosis and Therapy. Journal of the American Chemical Society, 2020 |
4134557 | CIF | C58 H35 Co F24 N4 O14 P3 Yb | P -1 | 14.376; 15.2336; 15.5883 69.269; 80.43; 89.657 | 3143.17 | Ning, YingYing; Liu, Yi-Wei; Yang, Zi-Shu; Yao, Yuhang; Kang, Lei; Sessler, Jonathan L.; Zhang, Jun-Long Split and Use: Structural Isomers for Diagnosis and Therapy. Journal of the American Chemical Society, 2020 |
4134558 | CIF | C48 H12 Cl9 F24 N5 O4 | P 1 21/n 1 | 16.3562; 10.8491; 30.2782 90; 90.232; 90 | 5372.8 | Ning, YingYing; Liu, Yi-Wei; Yang, Zi-Shu; Yao, Yuhang; Kang, Lei; Sessler, Jonathan L.; Zhang, Jun-Long Split and Use: Structural Isomers for Diagnosis and Therapy. Journal of the American Chemical Society, 2020 |
4134559 | CIF | C56 H30 Co F24 N5 O13 P3 Yb | P -1 | 16.2705; 16.7757; 28.5174 79.887; 77.355; 70.447 | 7112.6 | Ning, YingYing; Liu, Yi-Wei; Yang, Zi-Shu; Yao, Yuhang; Kang, Lei; Sessler, Jonathan L.; Zhang, Jun-Long Split and Use: Structural Isomers for Diagnosis and Therapy. Journal of the American Chemical Society, 2020 |
4134560 | CIF | C6 H10 I6 N2 Sn2 | I 1 m 1 | 16.2885; 25.4252; 9.9795 90; 92.951; 90 | 4127.4 | Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G. Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse. Journal of the American Chemical Society, 2020 |
4134561 | CIF | C6 H10 I6 N2 Pb2 | I 1 a 1 | 25.696; 10.153; 16.283 90; 90.036; 90 | 4248.1 | Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G. Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse. Journal of the American Chemical Society, 2020 |
4134562 | CIF | C6 H10 I6 N2 Sn2 | I 1 m 1 | 16.3185; 25.4637; 10.0068 90; 92.49; 90 | 4154.2 | Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G. Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse. Journal of the American Chemical Society, 2020 |
4134563 | CIF | C6 H10 I6 N2 Sn2 | I 1 m 1 | 16.2208; 25.4537; 10.0307 90; 91.466; 90 | 4140.1 | Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G. Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse. Journal of the American Chemical Society, 2020 |
4134564 | CIF | C6 H10 I6 N2 Pb0.91 Sn1.09 | I 1 m 1 | 16.3397; 25.552; 10.0204 90; 93.13; 90 | 4177.4 | Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G. Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse. Journal of the American Chemical Society, 2020 |
4134565 | CIF | C6 H10 I6 N2 Pb2 | I 1 m 1 | 16.3698; 25.6376; 10.0435 90; 93.198; 90 | 4208.5 | Li, Xiaotong; He, Yihui; Kepenekian, Mikaël; Guo, Peijun; Ke, Weijun; Even, Jacky; Katan, Claudine; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G. Three-dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse. Journal of the American Chemical Society, 2020 |
4134566 | CIF | C52 H70 B3 F12 Fe2 N15 O6 | P -1 | 13.094; 13.229; 21.32 79.228; 80.542; 66.249 | 3304.4 | Jana, Manish; White, Corey J.; Pal, Nabhendu; Demeshko, Serhiy; Kupper, Claudia; Meyer, Franc; Lehnert, Nicolai; Majumdar, Amit Functional Models for the Mono- and Di-nitrosyl Intermediates of FNORs: Semireduction versus Superreduction of NO. Journal of the American Chemical Society, 2020 |
4134567 | CIF | C55 H78 B3 F12 Fe2 N14 O6 | P -1 | 11.489; 16.691; 17.688 85.673; 84.727; 69.969 | 3169.7 | Jana, Manish; White, Corey J.; Pal, Nabhendu; Demeshko, Serhiy; Kupper, Claudia; Meyer, Franc; Lehnert, Nicolai; Majumdar, Amit Functional Models for the Mono- and Di-nitrosyl Intermediates of FNORs: Semireduction versus Superreduction of NO. Journal of the American Chemical Society, 2020 |
4134568 | CIF | C104 H142 B4 F16 Fe4 N26 O10 | P n a 21 | 29.597; 14.1253; 29.688 90; 90; 90 | 12412 | Jana, Manish; White, Corey J.; Pal, Nabhendu; Demeshko, Serhiy; Kupper, Claudia; Meyer, Franc; Lehnert, Nicolai; Majumdar, Amit Functional Models for the Mono- and Di-nitrosyl Intermediates of FNORs: Semireduction versus Superreduction of NO. Journal of the American Chemical Society, 2020 |
4134569 | CIF | C86 H100 B4 F16 Fe4 N20 O5 | P -1 | 18.424; 18.6; 21.629 113.567; 90.687; 116.641 | 5905 | Jana, Manish; White, Corey J.; Pal, Nabhendu; Demeshko, Serhiy; Kupper, Claudia; Meyer, Franc; Lehnert, Nicolai; Majumdar, Amit Functional Models for the Mono- and Di-nitrosyl Intermediates of FNORs: Semireduction versus Superreduction of NO. Journal of the American Chemical Society, 2020 |
4134570 | CIF | C30.67 H26.67 Cu4 I4 N6 O0.67 P2 | R -3 :H | 30.4981; 30.4981; 11.5146 90; 90; 120 | 9275.2 | Liu, Chun-Yu; Chen, Xu-Ran; Chen, Hui-Xian; Niu, Zheng; Hirao, Hajime; Braunstein, Pierre; Lang, Jian-Ping Ultrafast Luminescent Light-Up Guest Detection Based on the Lock of the Host Molecular Vibration. Journal of the American Chemical Society, 2020 |
4134571 | CIF | C31.33 H28 Cu4 I4 N6 O0.67 P2 | R -3 :H | 30.0438; 30.0438; 11.4013 90; 90; 120 | 8912.4 | Liu, Chun-Yu; Chen, Xu-Ran; Chen, Hui-Xian; Niu, Zheng; Hirao, Hajime; Braunstein, Pierre; Lang, Jian-Ping Ultrafast Luminescent Light-Up Guest Detection Based on the Lock of the Host Molecular Vibration. Journal of the American Chemical Society, 2020 |
4134572 | CIF | C32 H31 N O8 S | P 1 21/c 1 | 10.0085; 20.427; 14.7521 90; 102.161; 90 | 2948.3 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134573 | CIF | C36 H42 N2 O5 S | P 1 21 1 | 10.755; 13.715; 11.281 90; 100.786; 90 | 1634.6 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134574 | CIF | C30 H28 Br N O6 S | P -1 | 7.1258; 11.6075; 17.716 99.633; 90.185; 103.543 | 1403.1 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134575 | CIF | C27 H23 I N2 Pd | P 1 21/n 1 | 10.4805; 14.527; 15.293 90; 100.045; 90 | 2292.7 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134576 | CIF | C29 H27 Cl N2 O6 S | P -1 | 10.262; 11.446; 12.83 72.823; 78.115; 75.963 | 1382 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134577 | CIF | C31 H33 N O4 S | P -1 | 9.2157; 10.454; 13.746 92.427; 93.426; 92.778 | 1319 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134578 | CIF | C30 H26 N2 O4 S2 | P 1 21/c 1 | 18.317; 15.482; 18.981 90; 94.555; 90 | 5366 | Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds. Journal of the American Chemical Society, 2020 |
4134579 | CIF | C83.5 H34.47 Au F30 N6 O Pd | P 1 21/n 1 | 19.7144; 19.2488; 20.5275 90; 109.682; 90 | 7334.6 | Wang, Yue; Kai, Hiroto; Ishida, Masatoshi; Gokulnath, Sabapathi; Mori, Shigeki; Murayama, Tomotaka; Muranaka, Atsuya; Uchiyama, Masanobu; Yasutake, Yuhsuke; Fukatsu, Susumu; Notsuka, Yusuke; Yamaoka, Yoshihisa; Hanafusa, Mamiko; Yoshizawa, Michito; Kim, Gakhyun; Kim, Dongho; Furuta, Hiroyuki Synthesis of a Black Dye with Absorption Capabilities Across the Visible-to-Near-Infrared Region: A MO-Mixing Approach via Heterometal Coordination of Expanded Porphyrinoid. Journal of the American Chemical Society, 2020 |
4134580 | CIF | C306 H102 Co34 O390.8 Ti17 | F d -3 m :2 | 73.5784; 73.5784; 73.5784 90; 90; 90 | 398337 | M Padial, Natalia; Lerma-Berlanga, Belen; Almora-Barrios, Neyvis; Castells-Gil, Javier; da Silva, Ivan; de la Mata, María; Molina, Sergio I.; Hernández-Saz, Jesús; Platero-Prats, Ana E; Tatay, Sergio; Marti-Gastaldo, Carlos Heterometallic titanium-organic frameworks by metal-induced dynamic topological transformations. Journal of the American Chemical Society, 2020 |
4134581 | CIF | C50 H46 Mg3 N2 O10 | C 1 2/c 1 | 24.196; 17.771; 10.927 90; 92.74; 90 | 4693.1 | He, Junpeng; Aggarwal, Kanchan; Katyal, Naman; He, Shichao; Chiang, Edward; Dunning, Samuel G.; Reynolds, 3rd, Joseph E; Steiner, Alexander; Henkelman, Graeme; Que, Emily L.; Humphrey, Simon M. Reversible Solid-State Isomerism of Azobenzene-Loaded Large-Pore Isoreticular Mg-CUK-1. Journal of the American Chemical Society, 2020 |
4134582 | CIF | C26 H54 Mg3 N2 O29 | C 1 2/c 1 | 23.44; 18.8301; 10.91659 90; 93.4812; 90 | 4809.45 | He, Junpeng; Aggarwal, Kanchan; Katyal, Naman; He, Shichao; Chiang, Edward; Dunning, Samuel G.; Reynolds, 3rd, Joseph E; Steiner, Alexander; Henkelman, Graeme; Que, Emily L.; Humphrey, Simon M. Reversible Solid-State Isomerism of Azobenzene-Loaded Large-Pore Isoreticular Mg-CUK-1. Journal of the American Chemical Society, 2020 |
4134583 | CIF | C26 H21 Mg3 N2 O12.5 | C 1 2/c 1 | 24.22; 17.812; 10.975 90; 92.83; 90 | 4728.9 | He, Junpeng; Aggarwal, Kanchan; Katyal, Naman; He, Shichao; Chiang, Edward; Dunning, Samuel G.; Reynolds, 3rd, Joseph E; Steiner, Alexander; Henkelman, Graeme; Que, Emily L.; Humphrey, Simon M. Reversible Solid-State Isomerism of Azobenzene-Loaded Large-Pore Isoreticular Mg-CUK-1. Journal of the American Chemical Society, 2020 |
4134584 | CIF | C50 H36 Mg3 N6 O10 | P -1 | 10.937; 14.947; 15.041 71.41; 86.86; 88.896 | 2327 | He, Junpeng; Aggarwal, Kanchan; Katyal, Naman; He, Shichao; Chiang, Edward; Dunning, Samuel G.; Reynolds, 3rd, Joseph E; Steiner, Alexander; Henkelman, Graeme; Que, Emily L.; Humphrey, Simon M. Reversible Solid-State Isomerism of Azobenzene-Loaded Large-Pore Isoreticular Mg-CUK-1. Journal of the American Chemical Society, 2020 |
4134585 | CIF | C80 H52 O4 | P 1 21/n 1 | 16.279; 17.6696; 19.8265 90; 101.277; 90 | 5592.86 | Moore, Jeffrey S.; Jiang, Xing; Laffoon, Summer D.; Chen, Dandan; Pérez-Estrada, Salvador; Danis, Andrew S.; Rodríguez-López, Joaquín; Garcia-Garibay, Miguel A; Zhu, Jun Kinetic Control in the Synthesis of a Möbius Tris((ethynyl)[5]helicene) Macrocycle Using Alkyne Metathesis. Journal of the American Chemical Society, 2020 |
4134586 | CIF | C70 H93 Cl O12 | P 1 21/n 1 | 11.47; 13.122; 22.181 90; 91.554; 90 | 3337.2 | Zhou, Yujuan; Jie, Kecheng; Zhao, Run; Li, Errui; Huang, Feihe Highly Selective Removal of Trace Isomers by Nonporous Adaptive Pillararene Crystals for Chlorobutane Purification. Journal of the American Chemical Society, 2020 |
4134587 | CIF | C70 H93 Cl O12 | P -1 | 12.3608; 14.645; 23.0103 79.48; 74.424; 65.366 | 3635.4 | Zhou, Yujuan; Jie, Kecheng; Zhao, Run; Li, Errui; Huang, Feihe Highly Selective Removal of Trace Isomers by Nonporous Adaptive Pillararene Crystals for Chlorobutane Purification. Journal of the American Chemical Society, 2020 |
4134588 | CIF | C20 H35 N3 O7 Os | P 1 21 1 | 12.3859; 15.1577; 13.1632 90; 103.212; 90 | 2405.87 | Smith, Kendrick L.; Padgett, Cody L.; Mackay, William D.; Johnson, Jeffrey S. Catalytic, Asymmetric Dearomative Synthesis of Complex Cyclohexanes via a Highly Regio- and Stereoselective Arene Cyclopropanation Using α-Cyanodiazoacetates Journal of the American Chemical Society, 2020 |
4134589 | CIF | C22 H22 N4 O4 | P 21 21 21 | 6.2622; 10.0039; 31.7656 90; 90; 90 | 1990 | Smith, Kendrick L.; Padgett, Cody L.; Mackay, William D.; Johnson, Jeffrey S. Catalytic, Asymmetric Dearomative Synthesis of Complex Cyclohexanes via a Highly Regio- and Stereoselective Arene Cyclopropanation Using α-Cyanodiazoacetates Journal of the American Chemical Society, 2020 |
4134590 | CIF | C98 H78 N2 O4 | P -1 | 7.8458; 19.9207; 24.0461 85.631; 83.572; 87.686 | 3721.85 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134591 | CIF | C102 H82 Cl12 N2 O4 | P 1 21 1 | 15.2028; 14.7948; 20.705 90; 104.281; 90 | 4513.1 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134592 | CIF | C72 H66 N2 O4 | P -1 | 15.1377; 19.4899; 22.4137 106.704; 98.601; 105.017 | 5935.33 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134593 | CIF | C99 H79 Cl3 N2 O4 | P -1 | 7.7158; 15.2504; 16.7377 69.44; 82.721; 80.783 | 1814.96 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134594 | CIF | C392 H312 N8 O16 | P -1 | 16.3803; 29.3997; 34.6846 70.914; 88.745; 88.207 | 15776.1 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134595 | CIF | C102 H82 Cl12 N2 O4 | P 1 21 1 | 15.2129; 14.7868; 20.7684 90; 103.878; 90 | 4535.5 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134596 | CIF | C98 H78 N2 O4 | P -1 | 13.86; 17.3797; 35.4965 83.053; 83.981; 77.853 | 8269.9 | Liu, Bo; Böckmann, Marcus; Jiang, Wei; Doltsinis, Nikos L.; Wang, Zhaohui Perylene Diimide-Embedded Double [8]Helicenes. Journal of the American Chemical Society, 2020 |
4134597 | CIF | C36 H12 Eu6 N6.23 O38.28 | F d -3 m :2 | 34.7822; 34.7822; 34.7822 90; 90; 90 | 42079.6 | Skorupskii, Grigorii; Dinca, Mircea Electrical conductivity in a porous, cubic rare-earth catecholate. Journal of the American Chemical Society, 2020 |
4134598 | CIF | C36 H12 La6 N3.9 O41.64 | F d -3 m :2 | 35.2393; 35.2393; 35.2393 90; 90; 90 | 43760 | Skorupskii, Grigorii; Dinca, Mircea Electrical conductivity in a porous, cubic rare-earth catecholate. Journal of the American Chemical Society, 2020 |
4134599 | CIF | C18 H6 N2.69 O18.69 Y3 | F d -3 m :2 | 34.785; 34.785; 34.785 90; 90; 90 | 42090 | Skorupskii, Grigorii; Dinca, Mircea Electrical conductivity in a porous, cubic rare-earth catecholate. Journal of the American Chemical Society, 2020 |
4134600 | CIF | C42.5 H32 Cl5 F3 N2 O Pd | P 21 21 2 | 17.8071; 20.7861; 11.1015 90; 90; 90 | 4109.1 | Tran, Quan H.; Brookhart, Maurice; Daugulis, Olafs New Neutral Nickel and Palladium Sandwich Catalysts: Synthesis of Ultra-High Molecular Weight Polyethylene (UHMWPE) via Highly Controlled Polymerization and Mechanistic Studies of Chain Propagation. Journal of the American Chemical Society, 2020, 142, 7198-7206 |
4134601 | CIF | C44 H27 Cl4 F3 N2 O Pd | P -1 | 11.4494; 18.261; 19.2278 91.268; 95.438; 95.772 | 3979.7 | Tran, Quan H.; Brookhart, Maurice; Daugulis, Olafs New Neutral Nickel and Palladium Sandwich Catalysts: Synthesis of Ultra-High Molecular Weight Polyethylene (UHMWPE) via Highly Controlled Polymerization and Mechanistic Studies of Chain Propagation. Journal of the American Chemical Society, 2020, 142, 7198-7206 |
4134602 | CIF | C45 H26 Cl4 F6 N2 Ni O | P 1 21/c 1 | 11.3097; 16.5092; 21.156 90; 91.13; 90 | 3949.4 | Tran, Quan H.; Brookhart, Maurice; Daugulis, Olafs New Neutral Nickel and Palladium Sandwich Catalysts: Synthesis of Ultra-High Molecular Weight Polyethylene (UHMWPE) via Highly Controlled Polymerization and Mechanistic Studies of Chain Propagation. Journal of the American Chemical Society, 2020, 142, 7198-7206 |
4134603 | CIF | C119.85 H139.65 Fe8 N31.95 O61.95 | P 21 3 | 27.604; 27.604; 27.604 90; 90; 90 | 21034 | Chiong, Jerika A.; Zhu, Jie; Bailey, Jake B.; Kalaj, Mark; Subramanian, Rohit; Xu, Wenqian; Cohen, Seth M.; Tezcan, F. Akif An Exceptionally Stable Metal-Organic Framework Constructed from Chelate-based Metal-Organic Polyhedra. Journal of the American Chemical Society, 2020 |
4134604 | CIF | C68 H71.5 Cl7.5 N6 O9 | P 21 21 21 | 13.4811; 19.2956; 26.5465 90; 90; 90 | 6905.4 | Yousefi, Roozbeh; Sarkar, Aritra; Ashtekar, Kumar; Whitehead, Daniel C.; Kakeshpour, Tayeb; Holmes, Daniel; Reed, Paul; Jackson, James E.; Borhan, Babak Mechanistic Insights into the Origin of Stereoselectivity in an Asymmetric Chlorolactonization Catalyzed by (DHQD)<sub>2</sub>PHAL. Journal of the American Chemical Society, 2020 |
4134605 | CIF | C24 H20 Cu F6 N8 Si | P -1 | 10.082; 10.59; 13.103 84.987; 86.295; 62.063 | 1230.8 | Song, Bai-Qiao; Yang, Qing-Yuan; Wang, Shi-Qiang; Vandichel, Matthias; Kumar, Amrit; Crowley, Clare M.; Kumar, Naveen; Deng, Cheng-Hua; Gascon Perez, Victoria; Lusi, Matteo; Wu, Hui; Zhou, Wei; Zaworotko, Michael J. Reversible switching between nonporous and porous phases of a new SIFSIX coordination network induced by a flexible linker ligand. Journal of the American Chemical Society, 2020 |
4134606 | CIF | C24 H22 Cu F6 N8 O Si | P -1 | 10.4165; 11.6479; 12.239 64.535; 71.549; 74.498 | 1256.77 | Song, Bai-Qiao; Yang, Qing-Yuan; Wang, Shi-Qiang; Vandichel, Matthias; Kumar, Amrit; Crowley, Clare M.; Kumar, Naveen; Deng, Cheng-Hua; Gascon Perez, Victoria; Lusi, Matteo; Wu, Hui; Zhou, Wei; Zaworotko, Michael J. Reversible switching between nonporous and porous phases of a new SIFSIX coordination network induced by a flexible linker ligand. Journal of the American Chemical Society, 2020 |
4134607 | CIF | C198 H208 N8 O16 | P 1 21/c 1 | 40.116; 20.2528; 23.0493 90; 100.858; 90 | 18391 | Schuster, Nathaniel J.; Joyce, Leo A.; Paley, Daniel W.; Ng, Fay; Steigerwald, Michael L.; Nuckolls, Colin The Structural Origins of Intense Circular Dichroism in a Waggling Helicene Nanoribbon. Journal of the American Chemical Society, 2020, 142, 7066-7074 |
4134608 | CIF | C16 H17 F3 | P 1 | 7.9199; 11.2795; 14.9844 91.4157; 90.3788; 90.853 | 1338 | Kutateladze, Dennis A.; Strassfeld, Daniel A.; Jacobsen, Eric N. Enantioselective Tail-to-Head Cyclizations Catalyzed by Dual-Hydrogen-Bond Donors. Journal of the American Chemical Society, 2020 |
4134609 | CIF | C24 H15 N3 O6 | P 1 21/n 1 | 28.8499; 30.8381; 41.3583 90; 92.334; 90 | 36765 | Li, Yu-Lin; Alexandrov, Eugeny V.; Yin, Qi; Li, Lan; Fang, Zhi-Bin; Yuan, Wenbing; Proserpio, Davide M.; Liu, Tian-Fu Record Complexity in the Polycatenation of Three Porous Hydrogen-bonded Organic Frameworks with Stepwise Adsorption Behaviors. Journal of the American Chemical Society, 2020 |
4134610 | CIF | C24 H15 N3 O6 | C m c e | 30.91; 27.384; 20.633 90; 90; 90 | 17464.6 | Li, Yu-Lin; Alexandrov, Eugeny V.; Yin, Qi; Li, Lan; Fang, Zhi-Bin; Yuan, Wenbing; Proserpio, Davide M.; Liu, Tian-Fu Record Complexity in the Polycatenation of Three Porous Hydrogen-bonded Organic Frameworks with Stepwise Adsorption Behaviors. Journal of the American Chemical Society, 2020 |
4134611 | CIF | C24 H15 N3 O6 | P b c n | 26.4904; 41.3829; 30.8788 90; 90; 90 | 33851 | Li, Yu-Lin; Alexandrov, Eugeny V.; Yin, Qi; Li, Lan; Fang, Zhi-Bin; Yuan, Wenbing; Proserpio, Davide M.; Liu, Tian-Fu Record Complexity in the Polycatenation of Three Porous Hydrogen-bonded Organic Frameworks with Stepwise Adsorption Behaviors. Journal of the American Chemical Society, 2020 |
4134612 | CIF | C178 H179 F72 N24 O0.5 S6 Se6 | P 21 21 21 | 21.493; 29.212; 36.334 90; 90; 90 | 22812 | Lin, Yingfu; Hirschi, William J.; Kunadia, Anuj; Paul, Anirudra; Ghiviriga, Ion; Abboud, Khalil A.; Karugu, Rachael W.; Vetticatt, Mathew J.; Hirschi, Jennifer S.; Seidel, Daniel A Selenourea-Thiourea Brønsted Acid Catalyst Facilitates Asymmetric Conjugate Additions of Amines to α,β-Unsaturated Esters. Journal of the American Chemical Society, 2020, 142, 5627-5635 |
4134613 | CIF | C8 H16 N4 Ni O7 | P 1 21 1 | 9.7669; 7.0025; 10.1992 90; 112.658; 90 | 643.71 | Deng, Bin-Bin; Xu, Chu-Chu; Cheng, Ting-Ting; Yang, Yi-Ting; Hu, Yan-Ting; Wang, Pan; He, Wen-Hui; Yang, Meng-Juan; Liao, Wei-Qiang Homochiral Nickel Nitrite ABX<sub>3</sub> (X = NO<sub>2</sub><sup>-</sup>) Perovskite Ferroelectrics. Journal of the American Chemical Society, 2020 |
4134614 | CIF | C8 H15 F N4 Ni O7 | P 1 21 1 | 9.9112; 6.8771; 10.4391 90; 113.921; 90 | 650.42 | Deng, Bin-Bin; Xu, Chu-Chu; Cheng, Ting-Ting; Yang, Yi-Ting; Hu, Yan-Ting; Wang, Pan; He, Wen-Hui; Yang, Meng-Juan; Liao, Wei-Qiang Homochiral Nickel Nitrite ABX<sub>3</sub> (X = NO<sub>2</sub><sup>-</sup>) Perovskite Ferroelectrics. Journal of the American Chemical Society, 2020 |
4134615 | CIF | C8 H16 N4 Ni O7 | P 1 21 1 | 9.7772; 7.006; 10.2094 90; 112.707; 90 | 645.13 | Deng, Bin-Bin; Xu, Chu-Chu; Cheng, Ting-Ting; Yang, Yi-Ting; Hu, Yan-Ting; Wang, Pan; He, Wen-Hui; Yang, Meng-Juan; Liao, Wei-Qiang Homochiral Nickel Nitrite ABX<sub>3</sub> (X = NO<sub>2</sub><sup>-</sup>) Perovskite Ferroelectrics. Journal of the American Chemical Society, 2020 |
4134616 | CIF | C8 H15 F N4 Ni O7 | P 1 21 1 | 9.9291; 6.87; 10.457 90; 114.028; 90 | 651.49 | Deng, Bin-Bin; Xu, Chu-Chu; Cheng, Ting-Ting; Yang, Yi-Ting; Hu, Yan-Ting; Wang, Pan; He, Wen-Hui; Yang, Meng-Juan; Liao, Wei-Qiang Homochiral Nickel Nitrite ABX<sub>3</sub> (X = NO<sub>2</sub><sup>-</sup>) Perovskite Ferroelectrics. Journal of the American Chemical Society, 2020 |
4134617 | CIF | C3 H4 N8 O4 | P -1 | 7.338; 7.4214; 8.9759 92.332; 102.352; 118.864 | 412.21 | Tang, Yongxing; Huang, Wei; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Enforced Planar FOX-7-like Molecules: A Strategy for Thermally Stable and Insensitive π-Conjugated Energetic Materials. Journal of the American Chemical Society, 2020 |
4134618 | CIF | C3 H6.33 N7 O2.67 | P -1 | 4.9771; 13.1099; 16.9277 101.61; 91.179; 90.05 | 1081.68 | Tang, Yongxing; Huang, Wei; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Enforced Planar FOX-7-like Molecules: A Strategy for Thermally Stable and Insensitive π-Conjugated Energetic Materials. Journal of the American Chemical Society, 2020 |
4134619 | CIF | C4 H6 N6 O2 | P b c a | 11.3834; 7.3039; 15.8799 90; 90; 90 | 1320.31 | Tang, Yongxing; Huang, Wei; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Enforced Planar FOX-7-like Molecules: A Strategy for Thermally Stable and Insensitive π-Conjugated Energetic Materials. Journal of the American Chemical Society, 2020 |
4134620 | CIF | C4 H8 N8 O5 | P 1 21/c 1 | 4.9044; 26.767; 7.71 90; 96.835; 90 | 1004.9 | Tang, Yongxing; Huang, Wei; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Enforced Planar FOX-7-like Molecules: A Strategy for Thermally Stable and Insensitive π-Conjugated Energetic Materials. Journal of the American Chemical Society, 2020 |
4134621 | CIF | C5 H7 N7 O2 | P 1 2/n 1 | 8.0844; 9.054; 10.5384 90; 96.114; 90 | 766.98 | Tang, Yongxing; Huang, Wei; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Enforced Planar FOX-7-like Molecules: A Strategy for Thermally Stable and Insensitive π-Conjugated Energetic Materials. Journal of the American Chemical Society, 2020 |
4134622 | CIF | C3 H8 N8 O2 | P n a 21 | 8.4672; 11.1265; 7.9409 90; 90; 90 | 748.11 | Tang, Yongxing; Huang, Wei; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Enforced Planar FOX-7-like Molecules: A Strategy for Thermally Stable and Insensitive π-Conjugated Energetic Materials. Journal of the American Chemical Society, 2020 |
4134623 | CIF | C28 H28 N2 O5 S | P -1 | 8.058; 8.2082; 19.263 81.733; 89.6948; 80.2803 | 1242.51 | Steiman, Talia J.; Liu, Junyi; Mengiste, Amanuella; Doyle, Abigail G. Synthesis of β-Phenethylamines via Ni/Photoredox Cross-Electrophile Coupling of Aliphatic Aziridines and Aryl Iodides. Journal of the American Chemical Society, 2020, 142, 7598-7605 |
4134624 | CIF | Fe Nb O6 Zn2 | R 3 c :H | 5.1739; 5.1739; 13.9856 90; 90; 120 | 324.226 | Han, Yifeng; Zeng, Yijie; Hendrickx, Mylène; Hadermann, Joke; Stephens, Peter W.; Zhu, Chuanhui; Grams, Christoph Paul; Hemberger, Joachim; Frank, Corey E.; Li, Shufang; Wu, MeiXia; Retuerto, Maria; Croft, Mark; Walker, David; Yao, Dao-Xin; Greenblatt, Martha; Li, Man-Rong Universal A-cation splitting in LiNbO3-type structure driven by intrapositional multivalent coupling. Journal of the American Chemical Society, 2020 |
4134625 | CIF | Fe O6 Ta Zn2 | R 3 c :H | 5.17022; 5.17022; 13.93338 90; 90; 120 | 322.556 | Han, Yifeng; Zeng, Yijie; Hendrickx, Mylène; Hadermann, Joke; Stephens, Peter W.; Zhu, Chuanhui; Grams, Christoph Paul; Hemberger, Joachim; Frank, Corey E.; Li, Shufang; Wu, MeiXia; Retuerto, Maria; Croft, Mark; Walker, David; Yao, Dao-Xin; Greenblatt, Martha; Li, Man-Rong Universal A-cation splitting in LiNbO3-type structure driven by intrapositional multivalent coupling. Journal of the American Chemical Society, 2020 |
4134626 | CIF | C17 H26 B10 O2 | P 1 21/c 1 | 9.9559; 12.4988; 17.2264 90; 104.392; 90 | 2076.33 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134627 | CIF | C22 H29 B10 N2 O2 | P c c n | 19.9522; 13.7412; 18.6004 90; 90; 90 | 5099.6 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134628 | CIF | C12 H24 B10 O | P 1 21/n 1 | 11.1222; 16.2539; 19.748 90; 96.326; 90 | 3548.3 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134629 | CIF | C31 H42 B10 N2 O8 | P -1 | 8.91; 13.323; 16.77 70.5; 74.6; 86.737 | 1808.1 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134630 | CIF | C29 H36 B10 N2 O3 S2 | P -1 | 8.7666; 11.1964; 17.168 100.936; 99.267; 94.811 | 1621.5 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134631 | CIF | C17 H28 B10 N2 O2 | P -1 | 6.9003; 11.8511; 14.2073 78.8301; 81.9861; 85.1877 | 1126.74 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134632 | CIF | C35 H48 B10 N2 O3 | P -1 | 13.4462; 16.1808; 18.8504 88.657; 71.508; 77.42 | 3791.5 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134633 | CIF | C20 H40 B10 N2 O3 | P 1 21/c 1 | 9.8763; 15.3708; 18.6884 90; 91.3929; 90 | 2836.2 | Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei Copper-Catalyzed Electrochemical Selective B-H Oxygenation of <i>o</i>-Carboranes at Room Temperature. Journal of the American Chemical Society, 2020 |
4134634 | CIF | C78 H68 Cl2 F4 N8 O2 Pt2 S2 | P 1 2/c 1 | 17.8979; 14.7783; 16.9268 90; 110.964; 90 | 4180.8 | Wu, Xiugang; Chen, Deng-Gao; Liu, Denghui; Liu, Shih-Hung; Shen, Shin-Wei; Wu, Chih-I; Xie, Guohua; Zhou, Jianwei; Huang, Zhi-Xuan; Huang, Chun-Ying; Su, Shi-Jian; Zhu, Weiguo; Chou, Pi-Tai Highly Emissive Dinuclear Platinum(III) Complexes. Journal of the American Chemical Society, 2020 |
4134635 | CIF | C115 H97 Fe3 N17 Na6 O6 | P 1 | 13.3029; 14.1443; 15.9246 112.076; 111.146; 92.244 | 2536.25 | Toniolo, Davide; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Assembly of High-Spin [Fe<sub>3</sub>] Clusters by Ligand-Based Multielectron Reduction. Journal of the American Chemical Society, 2020, 142, 7301-7305 |
4134636 | CIF | C176 H196 Fe6 N12 Na12 O26 | P 1 21/c 1 | 13.4845; 33.0195; 22.9829 90; 105.404; 90 | 9865.6 | Toniolo, Davide; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella Assembly of High-Spin [Fe<sub>3</sub>] Clusters by Ligand-Based Multielectron Reduction. Journal of the American Chemical Society, 2020, 142, 7301-7305 |
4134637 | CIF | C72.29 H39.16 Hf6.02 N6.02 O32.13 | I m -3 m | 38.585; 38.585; 38.585 90; 90; 90 | 57445 | Luo, Taokun; Ni, Kaiyuan; Culbert, August; Lan, Guangxu; Li, Zhe; Jiang, Xiaomin; Kaufmann, Michael; Lin, Wenbin Nanoscale Metal-Organic Frameworks Stabilize Bacteriochlorins for Type I and Type II Photodynamic Therapy. Journal of the American Chemical Society, 2020, 142, 7334-7339 |
4134638 | CIF | C70 H130 N10 Ni2 O56 | P -1 | 13.491; 13.711; 14.567 75.315; 84.23; 67.787 | 2413 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134639 | CIF | C68 H76 Co N12 O22 | P -1 | 10.617; 12.641; 13.803 106.8; 104.68; 93.65 | 1696.7 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134640 | CIF | C57 H55 Cl8 N11 O16 | P -1 | 8.767; 17.488; 20.607 97.49; 96.84; 93.45 | 3100.9 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134641 | CIF | C27 H31 Cl2 N5 O10 | P 1 21/n 1 | 11.0295; 17.5019; 15.1089 90; 92.126; 90 | 2914.57 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134642 | CIF | C54 H70 N10 O26 | P 1 21/c 1 | 13.8006; 16.4423; 12.8876 90; 93.84; 90 | 2917.81 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134643 | CIF | C54 H66 N10 O24 | P 1 21/n 1 | 14.0185; 7.0639; 28.6965 90; 95.382; 90 | 2829.15 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134644 | CIF | C90 H102 N14 O44 Sm2 | P -1 | 13.493; 13.659; 13.762 81.1; 77.9; 89.71 | 2449.2 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134645 | CIF | C68 H82 N12 Ni O31 | P -1 | 11.434; 13.195; 14.751 97.223; 111.87; 109.823 | 1860.2 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134646 | CIF | C90 H96 Gd2 N14 O41 | P -1 | 13.288; 13.453; 14.007 81.17; 79.33; 88.99 | 2431.3 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134647 | CIF | C54 H58 Br4 N10 O18 | P -1 | 10.5126; 11.5747; 13.0705 77.021; 77.706; 66.522 | 1407.86 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134648 | CIF | C73 H45 Cd2 F16 N11 O19 | P -1 | 10.641; 11.699; 15.585 99.44; 99.77; 105.65 | 1795.6 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134649 | CIF | C90 H102 N14 O44 Tb2 | P -1 | 13.41; 13.637; 13.674 81.29; 89.58; 77.57 | 2413 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134650 | CIF | C62 H90 Co N10 O40 | P -1 | 11.383; 13.133; 14.705 97.38; 111.98; 109.81 | 1833.9 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134651 | CIF | C111 H87 Cl16 Eu4 N13 O43 | P -1 | 14.1263; 14.7486; 17.1292 84.581; 67.137; 85.187 | 3269.34 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134652 | CIF | C60 H68 N12 O20 | P -1 | 8.6588; 12.578; 14.189 90.8; 98.72; 107.1 | 1457.1 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134653 | CIF | C58 H64 N10 O19 | P -1 | 9.222; 13.1187; 13.2147 66.628; 72.463; 80.647 | 1397.65 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134654 | CIF | C148 H307 N20 O138.5 Zn6 | C m c 21 | 28.526; 24.457; 30.314 90; 90; 90 | 21149 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134655 | CIF | C90 H102 N14 Nd2 O44 | P -1 | 13.505; 13.637; 13.752 98.74; 101.75; 90.05 | 2449.5 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134656 | CIF | C102 H99 Br16 Eu4 N10 O56.5 | P -1 | 14.0288; 14.7086; 17.4117 84.418; 67.062; 84.129 | 3284.9 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134657 | CIF | C90 H102 Eu2 N14 O44 | P -1 | 13.527; 13.726; 13.879 80.92; 77.64; 89.22 | 2485.1 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134658 | CIF | C62 H80 N10 O35 Zn | P -1 | 11.4584; 13.1978; 14.2186 94.837; 112.155; 112.422 | 1774.3 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134659 | CIF | C54 H78 N14 O24 | P -1 | 10.1496; 12.415; 13.5453 93.516; 104.544; 112.869 | 1497.89 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134660 | CIF | C78 H68 N10 O29 | P -1 | 8.155; 13.187; 17.132 96.26; 90.4; 107.24 | 1747.6 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134661 | CIF | C8 H18 Cd O11 | P c c a | 7.2423; 9.97; 19.83 90; 90; 90 | 1431.8 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134662 | CIF | C58 H78 N10 O22 | P -1 | 11.5353; 12.0569; 13.2156 83.027; 68.372; 65.893 | 1558.68 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134663 | CIF | C56 H61 I4 N11 O18 | P -1 | 8.4685; 15.1856; 25.6622 74.699; 89.369; 78.998 | 3121.95 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134664 | CIF | C65 H81 Cd N11 O33 | P 1 21/m 1 | 12.88; 20.339; 15.174 90; 114.07; 90 | 3629.4 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134665 | CIF | C30 H12 F4 N2 | P 1 21 1 | 9.1462; 7.02845; 16.4441 90; 90.62; 90 | 1057.02 | Sun, Yanqiu; Lei, Yilong; Hu, Wenping; Wong, Wai-Yeung Epitaxial Growth of Nanorod Meshes from Luminescent Organic Cocrystals via Crystal Transformation. Journal of the American Chemical Society, 2020, 142, 7265-7269 |
4134666 | CIF | C30 H12 F4 N2 | P 1 21/c 1 | 7.023; 33.943; 17.584 90; 90.07; 90 | 4191.7 | Sun, Yanqiu; Lei, Yilong; Hu, Wenping; Wong, Wai-Yeung Epitaxial Growth of Nanorod Meshes from Luminescent Organic Cocrystals via Crystal Transformation. Journal of the American Chemical Society, 2020, 142, 7265-7269 |
4134667 | CIF | C32 H52 Cu2 F6 N4 O6 S2 | C 1 2/c 1 | 23.2214; 20.51134; 17.808 90; 109.079; 90 | 8016.05 | Sharninghausen, Liam S.; Brooks, Allen F.; Winton, Wade P.; Makaravage, Katarina J.; Scott, Peter J. H.; Sanford, Melanie S. NHC-Copper Mediated Ligand-Directed Radiofluorination of Aryl Halides. Journal of the American Chemical Society, 2020, 142, 7362-7367 |
4134668 | CIF | C24 H34 Cl2 Cu F N2 | P -1 | 8.4835; 11.9653; 12.0408 87.075; 80.401; 71.73 | 1144.37 | Sharninghausen, Liam S.; Brooks, Allen F.; Winton, Wade P.; Makaravage, Katarina J.; Scott, Peter J. H.; Sanford, Melanie S. NHC-Copper Mediated Ligand-Directed Radiofluorination of Aryl Halides. Journal of the American Chemical Society, 2020, 142, 7362-7367 |
4134669 | CIF | C36 H46 Br Fe N5 O | P 21 21 21 | 8.9286; 16.9996; 22.4884 90; 90; 90 | 3413.35 | Yadav, Vishal; Rodriguez, Rodolfo J.; Siegler, Maxime A.; Goldberg, David P. Determining the Inherent Selectivity for Carbon Radical Hydroxylation versus Halogenation with Fe<sup>III</sup>(OH)(X) Complexes: Relevance to the Rebound Step in Non-heme Iron Halogenases. Journal of the American Chemical Society, 2020, 142, 7259-7264 |
4134670 | CIF | C36 H46 Cl Fe N5 O | P 21 21 21 | 8.77732; 17.1427; 22.6633 90; 90; 90 | 3410.08 | Yadav, Vishal; Rodriguez, Rodolfo J.; Siegler, Maxime A.; Goldberg, David P. Determining the Inherent Selectivity for Carbon Radical Hydroxylation versus Halogenation with Fe<sup>III</sup>(OH)(X) Complexes: Relevance to the Rebound Step in Non-heme Iron Halogenases. Journal of the American Chemical Society, 2020, 142, 7259-7264 |
4134671 | CIF | C36 H46.99 Br1.01 Fe N5 O1.99 | P 1 21/n 1 | 12.6479; 13.0462; 21.3658 90; 101.978; 90 | 3448.75 | Yadav, Vishal; Rodriguez, Rodolfo J.; Siegler, Maxime A.; Goldberg, David P. Determining the Inherent Selectivity for Carbon Radical Hydroxylation versus Halogenation with Fe<sup>III</sup>(OH)(X) Complexes: Relevance to the Rebound Step in Non-heme Iron Halogenases. Journal of the American Chemical Society, 2020, 142, 7259-7264 |
4134672 | CIF | C44 H62 Cl2 Fe N5 O3 | C 1 2/c 1 | 32.8869; 11.113; 23.5812 90; 90.019; 90 | 8618.3 | Yadav, Vishal; Rodriguez, Rodolfo J.; Siegler, Maxime A.; Goldberg, David P. Determining the Inherent Selectivity for Carbon Radical Hydroxylation versus Halogenation with Fe<sup>III</sup>(OH)(X) Complexes: Relevance to the Rebound Step in Non-heme Iron Halogenases. Journal of the American Chemical Society, 2020, 142, 7259-7264 |
4134673 | CIF | C36 H47 Cl1.06 Fe N5 O1.94 | P 1 21/n 1 | 12.6925; 13.0034; 21.3161 90; 102.247; 90 | 3438.06 | Yadav, Vishal; Rodriguez, Rodolfo J.; Siegler, Maxime A.; Goldberg, David P. Determining the Inherent Selectivity for Carbon Radical Hydroxylation versus Halogenation with Fe<sup>III</sup>(OH)(X) Complexes: Relevance to the Rebound Step in Non-heme Iron Halogenases. Journal of the American Chemical Society, 2020, 142, 7259-7264 |
4134674 | CIF | C103 H207 Mo10 N4 Nb2 O42 P | P 1 21 1 | 14.4887; 22.9828; 21.1268 90; 103.175; 90 | 6849.86 | Zhang, Guanyun; Gadot, Eyal; Gan-Or, Gal; Baranov, Mark; Tubul, Tal; Neyman, Alevtina; Li, Mu; Clotet, Anna; Poblet, Josep M.; Yin, Panchao; Weinstock, Ira A. Self-Assembly and Ionic-Lattice-like Secondary Structure of a Flexible Linear Polymer of Highly Charged Inorganic Building Blocks. Journal of the American Chemical Society, 2020, 142, 7295-7300 |
4134675 | CIF | C28 H26 I2 N O2 P | C 1 2 1 | 18.6068; 7.2917; 20.2774 90; 110.916; 90 | 2569.9 | Yan, Shengyi; Xia, Wang; Li, Shaoyu; Song, Qiuling; Xiang, Shao-Hua; Tan, Bin Michael Reaction Inspired Atroposelective Construction of Axially Chiral Biaryls. Journal of the American Chemical Society, 2020, 142, 7322-7327 |
4134676 | CIF | C20 H18 Cu F6 N4 O2.5 Zr | P n a 21 | 20.539; 14.8908; 15.0531 90; 90; 90 | 4603.9 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
4134677 | CIF | C20 H18 Cu F6 Hf N4 O2.5 | P n a 21 | 20.555; 14.8898; 15.0487 90; 90; 90 | 4605.8 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
4134678 | CIF | C20 H24 Cu2 F12 N4 O4 Zr2 | P -1 | 7.1475; 9.9867; 10.8497 91.854; 106.408; 104.499 | 714.81 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
4134679 | CIF | C10 H12 Cu F6 Hf N2 O2 | P 1 2/n 1 | 6.259; 9.2167; 12.2518 90; 90.846; 90 | 706.7 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
4134680 | CIF | C20 H18 Cu F6 N4 O2.5 Ti | P n a 21 | 20.3754; 14.6737; 14.8668 90; 90; 90 | 4444.9 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
4134681 | CIF | C10 H12 Cu F6 N2 O2 Ti | P n m a | 7.727; 14.3219; 12.3521 90; 90; 90 | 1366.95 | Nisbet, Matthew L.; Pendleton, Ian M.; Nolis, Gene M.; Griffith, Kent J.; Schrier, Joshua; Cabana, Jordi; Norquist, Alexander J.; Poeppelmeier, Kenneth R. Machine-Learning-Assisted Synthesis of Polar Racemates. Journal of the American Chemical Society, 2020, 142, 7555-7566 |
4134682 | CIF | C25 H18 F4 O | P -1 | 9.718; 10.43; 10.479 109.11; 102.3; 96.78 | 960.1 | Xie, Weilong; Heo, Joon; Kim, Dongwook; Chang, Sukbok Copper-Catalyzed Direct C-H Alkylation of Polyfluoroarenes by Using Hydrocarbons as an Alkylating Source. Journal of the American Chemical Society, 2020, 142, 7487-7496 |
4134683 | CIF | C36 H38 F4 O5 | P 21 21 21 | 9.609; 15.344; 21.494 90; 90; 90 | 3169 | Xie, Weilong; Heo, Joon; Kim, Dongwook; Chang, Sukbok Copper-Catalyzed Direct C-H Alkylation of Polyfluoroarenes by Using Hydrocarbons as an Alkylating Source. Journal of the American Chemical Society, 2020, 142, 7487-7496 |
4134684 | CIF | C23 H20 F4 O | P 1 21/n 1 | 11.057; 15.078; 22.516 90; 92.95; 90 | 3748.8 | Xie, Weilong; Heo, Joon; Kim, Dongwook; Chang, Sukbok Copper-Catalyzed Direct C-H Alkylation of Polyfluoroarenes by Using Hydrocarbons as an Alkylating Source. Journal of the American Chemical Society, 2020, 142, 7487-7496 |
4134685 | CIF | C23 H18 F4 O | P 1 21/c 1 | 13.666; 8.146; 16.531 90; 98.73; 90 | 1819 | Xie, Weilong; Heo, Joon; Kim, Dongwook; Chang, Sukbok Copper-Catalyzed Direct C-H Alkylation of Polyfluoroarenes by Using Hydrocarbons as an Alkylating Source. Journal of the American Chemical Society, 2020, 142, 7487-7496 |
4134686 | CIF | C300 H420 Mg24 O138 | R -3 :H | 34.417; 34.417; 26.544 90; 90; 120 | 27230 | Shao, Li; Hua, Bin; Hu, Xiangquan; Stalla, David; Kelley, Steven P.; Atwood, Jerry L. Construction of Polymeric Metal-Organic Nanocapsule Networks via Supramolecular Coordination-Driven Self-Assembly. Journal of the American Chemical Society, 2020, 142, 7270-7275 |
4134687 | CIF | C265 H296 Mg24 N2 O129 | P 1 21/c 1 | 37.025; 36.916; 26.53 90; 94.801; 90 | 36134 | Shao, Li; Hua, Bin; Hu, Xiangquan; Stalla, David; Kelley, Steven P.; Atwood, Jerry L. Construction of Polymeric Metal-Organic Nanocapsule Networks via Supramolecular Coordination-Driven Self-Assembly. Journal of the American Chemical Society, 2020, 142, 7270-7275 |
4134688 | CIF | C24 H16 N2 Ni O | P 1 21/n 1 | 9.4673; 11.3216; 32.085 90; 97.472; 90 | 3409.8 | Wong, Yip-Sang; Tang, Man-Chung; Ng, Maggie; Yam, Vivian Wing-Wah Toward the Design of Phosphorescent Emitters of Cyclometalated Earth-Abundant Nickel(II) and Their Supramolecular Study. Journal of the American Chemical Society, 2020, 142, 7638-7646 |
4134689 | CIF | C16 H11 Cl N2 Ni | C 1 2/c 1 | 9.772; 14.573; 9.077 90; 95.29; 90 | 1287.1 | Wong, Yip-Sang; Tang, Man-Chung; Ng, Maggie; Yam, Vivian Wing-Wah Toward the Design of Phosphorescent Emitters of Cyclometalated Earth-Abundant Nickel(II) and Their Supramolecular Study. Journal of the American Chemical Society, 2020, 142, 7638-7646 |
4134690 | CIF | C82 H108 Mn4 N20 O22 | P 1 21/n 1 | 7.66791; 35.5294; 18.9331 90; 90.5243; 90 | 5157.85 | Li, Zhi-Wei; Wang, Xin; Wei, Lian-Qiang; Ivanović-Burmazović, Ivana; Liu, Gao-Feng Subcomponent Self-Assembly of Covalent Metallacycles Templated by Catalytically Active Seven-Coordinate Transition Metal Centers. Journal of the American Chemical Society, 2020, 142, 7283-7288 |
4134691 | CIF | C166 H174 Mn4 N38 O16 | P 1 21/c 1 | 14.5195; 47.357; 14.8983 90; 101.308; 90 | 10045.2 | Li, Zhi-Wei; Wang, Xin; Wei, Lian-Qiang; Ivanović-Burmazović, Ivana; Liu, Gao-Feng Subcomponent Self-Assembly of Covalent Metallacycles Templated by Catalytically Active Seven-Coordinate Transition Metal Centers. Journal of the American Chemical Society, 2020, 142, 7283-7288 |
4134692 | CIF | C90 H84 Cl6 Co4 N24 O38 | C 1 2/c 1 | 47.019; 8.0598; 41.8518 90; 123.828; 90 | 13175.4 | Li, Zhi-Wei; Wang, Xin; Wei, Lian-Qiang; Ivanović-Burmazović, Ivana; Liu, Gao-Feng Subcomponent Self-Assembly of Covalent Metallacycles Templated by Catalytically Active Seven-Coordinate Transition Metal Centers. Journal of the American Chemical Society, 2020, 142, 7283-7288 |
4134693 | CIF | C37 H34 F3 N10 O10 S Zn2 | P 1 21/m 1 | 14.8683; 35.964; 15.7673 90; 115.88; 90 | 7585.6 | Li, Zhi-Wei; Wang, Xin; Wei, Lian-Qiang; Ivanović-Burmazović, Ivana; Liu, Gao-Feng Subcomponent Self-Assembly of Covalent Metallacycles Templated by Catalytically Active Seven-Coordinate Transition Metal Centers. Journal of the American Chemical Society, 2020, 142, 7283-7288 |
4134694 | CIF | C136 H94 Mn4 N32 O18 | P -1 | 10.8346; 16.7939; 19.7458 107.577; 92.476; 97.574 | 3382.1 | Li, Zhi-Wei; Wang, Xin; Wei, Lian-Qiang; Ivanović-Burmazović, Ivana; Liu, Gao-Feng Subcomponent Self-Assembly of Covalent Metallacycles Templated by Catalytically Active Seven-Coordinate Transition Metal Centers. Journal of the American Chemical Society, 2020, 142, 7283-7288 |
4134695 | CIF | C60 H120 N16 P4 U | R 3 :H | 20.6977; 20.6977; 14.1093 90; 90; 120 | 5234.6 | Rice, Natalie T.; McCabe, Karl; Bacsa, John; Maron, Laurent; La Pierre, Henry S. Two-Electron Oxidative Atom Transfer at a Homoleptic, Tetravalent Uranium Complex. Journal of the American Chemical Society, 2020, 142, 7368-7373 |
4134696 | CIF | C60 H120 N16 O P4 U | R 3 :H | 20.77; 20.77; 13.975 90; 90; 120 | 5221 | Rice, Natalie T.; McCabe, Karl; Bacsa, John; Maron, Laurent; La Pierre, Henry S. Two-Electron Oxidative Atom Transfer at a Homoleptic, Tetravalent Uranium Complex. Journal of the American Chemical Society, 2020, 142, 7368-7373 |
4134697 | CIF | C69 H131 N17 P4 U | P 1 21/c 1 | 14.9753; 22.266; 47.714 90; 97.018; 90 | 15791 | Rice, Natalie T.; McCabe, Karl; Bacsa, John; Maron, Laurent; La Pierre, Henry S. Two-Electron Oxidative Atom Transfer at a Homoleptic, Tetravalent Uranium Complex. Journal of the American Chemical Society, 2020, 142, 7368-7373 |
4134698 | CIF | C26 H23 N O | P 1 21/n 1 | 6.43; 12.1818; 25.8958 90; 96.497; 90 | 2015.36 | Lu, Zhiwu; Hu, Xu-Dong; Zhang, Hui; Zhang, Xiao-Wen; Cai, Jinhui; Usman, Muhammad; Cong, Hengjiang; Liu, Wen-Bo Enantioselective Assembly of Cycloenones with a Nitrile-Containing All-Carbon Quaternary Center from Malononitriles Enabled by Ni Catalysis. Journal of the American Chemical Society, 2020, 142, 7328-7333 |
4134699 | CIF | C26 H20 Br N O | C 1 2 1 | 23.866; 6.6629; 13.5743 90; 94.136; 90 | 2152.9 | Lu, Zhiwu; Hu, Xu-Dong; Zhang, Hui; Zhang, Xiao-Wen; Cai, Jinhui; Usman, Muhammad; Cong, Hengjiang; Liu, Wen-Bo Enantioselective Assembly of Cycloenones with a Nitrile-Containing All-Carbon Quaternary Center from Malononitriles Enabled by Ni Catalysis. Journal of the American Chemical Society, 2020, 142, 7328-7333 |
4134700 | CIF | C45 H31 B Cl2 N8 O | P -1 | 12.657; 12.75; 13.869 108.039; 115.597; 93.053 | 1873 | Winterfeld, Kim A.; Lavarda, Giulia; Yoshida, Kota; Bayerlein, Maximilian J.; Kise, Koki; Tanaka, Takayuki; Osuka, Atsuhiro; Guldi, Dirk M.; Torres, Tomás; Bottari, Giovanni Synthesis and Optical Features of Axially and Peripherally Substituted Subporphyrins. A Paradigmatic Example of Charge Transfer versus Exciplex States. Journal of the American Chemical Society, 2020, 142, 7920-7929 |
4134701 | CIF | C49.5 H32 B Cl N8 | P -1 | 11.0129; 13.4588; 15.067 108.158; 90.077; 94.144 | 2115.8 | Winterfeld, Kim A.; Lavarda, Giulia; Yoshida, Kota; Bayerlein, Maximilian J.; Kise, Koki; Tanaka, Takayuki; Osuka, Atsuhiro; Guldi, Dirk M.; Torres, Tomás; Bottari, Giovanni Synthesis and Optical Features of Axially and Peripherally Substituted Subporphyrins. A Paradigmatic Example of Charge Transfer versus Exciplex States. Journal of the American Chemical Society, 2020, 142, 7920-7929 |
4134702 | CIF | C49 H31 B N8 | P 1 21/c 1 | 10.6906; 12.2749; 28.911 90; 92.992; 90 | 3788.7 | Winterfeld, Kim A.; Lavarda, Giulia; Yoshida, Kota; Bayerlein, Maximilian J.; Kise, Koki; Tanaka, Takayuki; Osuka, Atsuhiro; Guldi, Dirk M.; Torres, Tomás; Bottari, Giovanni Synthesis and Optical Features of Axially and Peripherally Substituted Subporphyrins. A Paradigmatic Example of Charge Transfer versus Exciplex States. Journal of the American Chemical Society, 2020, 142, 7920-7929 |
4134703 | CIF | C15 H11 Cl2 N O | P 1 21/n 1 | 4.4481; 14.2679; 20.974 90; 92.061; 90 | 1330.25 | Cui, Wen-Jun; Wu, Zhi-Jie; Gu, Qing; You, Shu-Li Divergent Synthesis of Tunable Cyclopentadienyl Ligands and Their Application in Rh-Catalyzed Enantioselective Synthesis of Isoindolinone. Journal of the American Chemical Society, 2020, 142, 7379-7385 |
4134704 | CIF | C20 H29 F3 N2 O3 S Ti | P b c a | 13.4491; 16.3991; 20.2594 90; 90; 90 | 4468.3 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134705 | CIF | C19 H28 N2 Ti | P 1 21/c 1 | 15.4192; 8.5253; 14.8104 90; 112.358; 90 | 1800.52 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134706 | CIF | C39 H48 N2 O0 Ti2 | P 1 21/n 1 | 10.6267; 13.3909; 23.1232 90; 101.037; 90 | 3229.6 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134707 | CIF | C33 H42 N2 Ti2 | P -1 | 10.4518; 19.916; 21.075 99.063; 104.113; 90.366 | 4196.8 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134708 | CIF | C28 H46 N2 O2 Ti | P 1 21/c 1 | 11.7346; 30.286; 15.7125 90; 107.969; 90 | 5311.8 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134709 | CIF | C19 H29 N2 Ti | P 1 21/c 1 | 14.933; 8.546; 15.746 90; 114.223; 90 | 1832.5 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134710 | CIF | C19 H28 N2 S Ti | P n m a | 15.4482; 11.305; 10.4848 90; 90; 90 | 1831.09 | Beaumier, Evan P.; Gordon, Christopher P.; Harkins, Robin P.; McGreal, Meghan E.; Wen, Xuelan; Copéret, Christophe; Goodpaster, Jason D.; Tonks, Ian A. Cp<sub>2</sub>Ti(κ<sup>2</sup><i>-</i><sup> <i>t</i> </sup>BuNCN<sup> <i>t</i> </sup>Bu): A Complex with an Unusual κ<sup>2</sup> Coordination Mode of a Heterocumulene Featuring a Free Carbene. Journal of the American Chemical Society, 2020, 142, 8006-8018 |
4134711 | CIF | Li0.687 Nb5 O15 Pb2.157 | P n 21 m | 12.38233; 12.66874; 7.66215 90; 90; 90 | 1201.95 | Lin, Kun; Gong, Pifu; Chu, Shihang; Li, Qiang; Lin, Zheshuai; Wu, Hui; Wang, Qingxiao; Wang, Jinguo; Kim, Moon J.; Kato, Kenichi; Wang, Chin-Wei; Liu, Xinzhi; Huang, Qingzhen; Chen, Jun; Zhu, He; Deng, Jinxia; Xing, Xianran Strong Second Harmonic Generation in a Tungsten Bronze Oxide by Enhancing Local Structural Distortion. Journal of the American Chemical Society, 2020, 142, 7480-7486 |
4134712 | CIF | C20 H17 F O4 | P 1 21 1 | 8.9632; 8.3819; 12.045 90; 107.15; 90 | 864.7 | Yang, He; Sun, Jiawei; Gu, Wei; Tang, Wenjun Enantioselective Cross-Coupling for Axially Chiral Tetra-ortho-Substituted Biaryls and Asymmetric Synthesis of Gossypol. Journal of the American Chemical Society, 2020, 142, 8036-8043 |
4134713 | CIF | C82 H106 Cl O14 P2 Pd2 | C 1 2 1 | 29.794; 19.1363; 16.7518 90; 113.055; 90 | 8788.1 | Yang, He; Sun, Jiawei; Gu, Wei; Tang, Wenjun Enantioselective Cross-Coupling for Axially Chiral Tetra-ortho-Substituted Biaryls and Asymmetric Synthesis of Gossypol. Journal of the American Chemical Society, 2020, 142, 8036-8043 |
4134714 | CIF | C24 H22 O4 | P 1 21 1 | 11.6485; 7.7932; 11.8264 90; 115.44; 90 | 969.49 | Yang, He; Sun, Jiawei; Gu, Wei; Tang, Wenjun Enantioselective Cross-Coupling for Axially Chiral Tetra-ortho-Substituted Biaryls and Asymmetric Synthesis of Gossypol. Journal of the American Chemical Society, 2020, 142, 8036-8043 |
4134715 | CIF | C23 H20 O5 | P 21 21 21 | 8.4534; 8.7745; 26.1457 90; 90; 90 | 1939.34 | Yang, He; Sun, Jiawei; Gu, Wei; Tang, Wenjun Enantioselective Cross-Coupling for Axially Chiral Tetra-ortho-Substituted Biaryls and Asymmetric Synthesis of Gossypol. Journal of the American Chemical Society, 2020, 142, 8036-8043 |
4134716 | CIF | C32 H31 N O3 S | P 21 21 21 | 9.9875; 11.3241; 46.9874 90; 90; 90 | 5314.25 | Hong, Feng-Lin; Chen, Yang-Bo; Ye, Si-Han; Zhu, Guang-Yu; Zhu, Xin-Qi; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu Copper-Catalyzed Asymmetric Reaction of Alkenyl Diynes with Styrenes by Formal [3 + 2] Cycloaddition via Cu-Containing All-Carbon 1,3-Dipoles: Access to Chiral Pyrrole-Fused Bridged [2.2.1] Skeletons. Journal of the American Chemical Society, 2020, 142, 7618-7626 |
4134717 | CIF | C29 H27 N O3 S | P 1 21 1 | 9.7618; 10.0699; 12.2302 90; 101.541; 90 | 1177.93 | Hong, Feng-Lin; Chen, Yang-Bo; Ye, Si-Han; Zhu, Guang-Yu; Zhu, Xin-Qi; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu Copper-Catalyzed Asymmetric Reaction of Alkenyl Diynes with Styrenes by Formal [3 + 2] Cycloaddition via Cu-Containing All-Carbon 1,3-Dipoles: Access to Chiral Pyrrole-Fused Bridged [2.2.1] Skeletons. Journal of the American Chemical Society, 2020, 142, 7618-7626 |
4134718 | CIF | C35 H33 N O3 S | P 21 21 21 | 8.5056; 13.3487; 25.1954 90; 90; 90 | 2860.65 | Hong, Feng-Lin; Chen, Yang-Bo; Ye, Si-Han; Zhu, Guang-Yu; Zhu, Xin-Qi; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu Copper-Catalyzed Asymmetric Reaction of Alkenyl Diynes with Styrenes by Formal [3 + 2] Cycloaddition via Cu-Containing All-Carbon 1,3-Dipoles: Access to Chiral Pyrrole-Fused Bridged [2.2.1] Skeletons. Journal of the American Chemical Society, 2020, 142, 7618-7626 |
4134719 | CIF | C18 H15 O3 P | P 1 21/c 1 | 17.4434; 5.892; 14.9985 90; 97.462; 90 | 1528.44 | Walton, Finlay; Bolling, John; Farrell, Andrew; MacEwen, Jamie; Syme, Christopher D.; Jiménez, Mario González; Senn, Hans M.; Wilson, Claire; Cinque, Gianfelice; Wynne, Klaas Polyamorphism Mirrors Polymorphism in the Liquid-Liquid Transition of a Molecular Liquid. Journal of the American Chemical Society, 2020, 142, 7591-7597 |
4134720 | CIF | C37 H28 F18 N O2 P Pd | P -1 | 9.9613; 12.3262; 15.8096 89.843; 88.801; 82.682 | 1924.95 | Su, Bo; Bunescu, Ala; Qiu, Yehao; Zuend, Stephan J.; Ernst, Martin; Hartwig, John F. Palladium-catalyzed oxidation of β-C(sp3)-H bond of primary alkylamines through a rare four-membered palladacycle intermediate. Journal of the American Chemical Society, 2020 |
4134721 | CIF | C22 H28 N2 O2 Pd | C 1 2/c 1 | 19.1646; 7.6938; 14.4178 90; 108.664; 90 | 2014.09 | Su, Bo; Bunescu, Ala; Qiu, Yehao; Zuend, Stephan J.; Ernst, Martin; Hartwig, John F. Palladium-catalyzed oxidation of β-C(sp3)-H bond of primary alkylamines through a rare four-membered palladacycle intermediate. Journal of the American Chemical Society, 2020 |
4134722 | CIF | C26 H34 N2 O6 Pd2 | P 1 21/n 1 | 8.9433; 34.4853; 9.5969 90; 113.354; 90 | 2717.32 | Su, Bo; Bunescu, Ala; Qiu, Yehao; Zuend, Stephan J.; Ernst, Martin; Hartwig, John F. Palladium-catalyzed oxidation of β-C(sp3)-H bond of primary alkylamines through a rare four-membered palladacycle intermediate. Journal of the American Chemical Society, 2020 |
4134723 | CIF | C17 H27 Cl2 N O7 | P 1 21 1 | 9.3693; 9.1331; 12.3504 90; 107.386; 90 | 1008.55 | Vojáčková, Petra; Michalska, Lucyna; Nečas, Marek; Shcherbakov, Dimitri; Böttger, Erik C; Šponer, Jiří; Šponer, Judit E; Švenda, Jakub Stereocontrolled Synthesis of (-)-Bactobolin A. Journal of the American Chemical Society, 2020, 142, 7306-7311 |
4134724 | CIF | C17 H26 Cl2 N O7.5 | C 1 2/c 1 | 31.4309; 12.0536; 25.2006 90; 118.833; 90 | 8363.8 | Vojáčková, Petra; Michalska, Lucyna; Nečas, Marek; Shcherbakov, Dimitri; Böttger, Erik C; Šponer, Jiří; Šponer, Judit E; Švenda, Jakub Stereocontrolled Synthesis of (-)-Bactobolin A. Journal of the American Chemical Society, 2020, 142, 7306-7311 |
4134725 | CIF | C17 H25 Cl2 N O7 | P -1 | 10.4482; 10.733; 10.9047 91.558; 113.438; 118.425 | 950.51 | Vojáčková, Petra; Michalska, Lucyna; Nečas, Marek; Shcherbakov, Dimitri; Böttger, Erik C; Šponer, Jiří; Šponer, Judit E; Švenda, Jakub Stereocontrolled Synthesis of (-)-Bactobolin A. Journal of the American Chemical Society, 2020, 142, 7306-7311 |
4134726 | CIF | C17 H25 N O8 | C 1 2 1 | 24.6919; 7.6839; 9.7357 90; 91.381; 90 | 1846.62 | Vojáčková, Petra; Michalska, Lucyna; Nečas, Marek; Shcherbakov, Dimitri; Böttger, Erik C; Šponer, Jiří; Šponer, Judit E; Švenda, Jakub Stereocontrolled Synthesis of (-)-Bactobolin A. Journal of the American Chemical Society, 2020, 142, 7306-7311 |
4134727 | CIF | C16 H22 Cl2 N O5 | P b c a | 9.6479; 19.6056; 37.8797 90; 90; 90 | 7165.05 | Vojáčková, Petra; Michalska, Lucyna; Nečas, Marek; Shcherbakov, Dimitri; Böttger, Erik C; Šponer, Jiří; Šponer, Judit E; Švenda, Jakub Stereocontrolled Synthesis of (-)-Bactobolin A. Journal of the American Chemical Society, 2020, 142, 7306-7311 |
4134728 | CIF | C34 H15 Al F36 O4 S2 | P -1 | 10.975; 11.916; 17.67 92.41; 98.443; 103.385 | 2216.8 | Tang, Shuxuan; Zhang, Li; Ruan, Huapeng; Zhao, Yue; Wang, Xinping A Magnetically Robust Triplet Ground State Sulfur-Hydrocarbon Diradical Dication. Journal of the American Chemical Society, 2020, 142, 7340-7344 |
4134729 | CIF | C36 H30 S4 | P -1 | 11.8539; 11.8577; 11.8905 67.399; 74.886; 81.448 | 1487.4 | Tang, Shuxuan; Zhang, Li; Ruan, Huapeng; Zhao, Yue; Wang, Xinping A Magnetically Robust Triplet Ground State Sulfur-Hydrocarbon Diradical Dication. Journal of the American Chemical Society, 2020, 142, 7340-7344 |
4134730 | CIF | C66 H46 Al F36 O4 S4 | P 1 21/c 1 | 21.5825; 10.977; 30.8704 90; 98.337; 90 | 7236.3 | Tang, Shuxuan; Zhang, Li; Ruan, Huapeng; Zhao, Yue; Wang, Xinping A Magnetically Robust Triplet Ground State Sulfur-Hydrocarbon Diradical Dication. Journal of the American Chemical Society, 2020, 142, 7340-7344 |
4134731 | CIF | C68 H54 F24 N6 P4 | P -1 | 10.3835; 11.9083; 13.5373 80.634; 88.346; 76.95 | 1608.9 | Garci, Amine; Beldjoudi, Yassine; Kodaimati, Mohamad S.; Hornick, Jessica E.; Nguyen, Minh T.; Cetin, M. Mustafa; Stern, Charlotte L.; Roy, Indranil; Weiss, Emily A.; Stoddart, J. Fraser Mechanical-Bond-Induced Exciplex Fluorescence in an Anthracene-Based Homo[2]catenane. Journal of the American Chemical Society, 2020, 142, 7956-7967 |
4134732 | CIF | C82 H64 F24 N6 P4 | P -1 | 7.2668; 12.68; 20.209 80.52; 84.99; 87.23 | 1828.6 | Garci, Amine; Beldjoudi, Yassine; Kodaimati, Mohamad S.; Hornick, Jessica E.; Nguyen, Minh T.; Cetin, M. Mustafa; Stern, Charlotte L.; Roy, Indranil; Weiss, Emily A.; Stoddart, J. Fraser Mechanical-Bond-Induced Exciplex Fluorescence in an Anthracene-Based Homo[2]catenane. Journal of the American Chemical Society, 2020, 142, 7956-7967 |
4134733 | CIF | C68 H54 F24 N6 P4 | C 1 2/c 1 | 41.838; 12.659; 29.003 90; 94.518; 90 | 15313 | Garci, Amine; Beldjoudi, Yassine; Kodaimati, Mohamad S.; Hornick, Jessica E.; Nguyen, Minh T.; Cetin, M. Mustafa; Stern, Charlotte L.; Roy, Indranil; Weiss, Emily A.; Stoddart, J. Fraser Mechanical-Bond-Induced Exciplex Fluorescence in an Anthracene-Based Homo[2]catenane. Journal of the American Chemical Society, 2020, 142, 7956-7967 |
4134734 | CIF | C68 H54 F24 N6 P4 | C c c a :2 | 12.0098; 34.634; 39.679 90; 90; 90 | 16504 | Garci, Amine; Beldjoudi, Yassine; Kodaimati, Mohamad S.; Hornick, Jessica E.; Nguyen, Minh T.; Cetin, M. Mustafa; Stern, Charlotte L.; Roy, Indranil; Weiss, Emily A.; Stoddart, J. Fraser Mechanical-Bond-Induced Exciplex Fluorescence in an Anthracene-Based Homo[2]catenane. Journal of the American Chemical Society, 2020, 142, 7956-7967 |
4134735 | CIF | C65 H49.5 F24 N4.5 P4 | P 2 2 21 | 11.9331; 14.1803; 42.533 90; 90; 90 | 7197.2 | Garci, Amine; Beldjoudi, Yassine; Kodaimati, Mohamad S.; Hornick, Jessica E.; Nguyen, Minh T.; Cetin, M. Mustafa; Stern, Charlotte L.; Roy, Indranil; Weiss, Emily A.; Stoddart, J. Fraser Mechanical-Bond-Induced Exciplex Fluorescence in an Anthracene-Based Homo[2]catenane. Journal of the American Chemical Society, 2020, 142, 7956-7967 |
4134736 | CIF | C56 H68 Sn2 | P -1 | 10.0922; 11.2174; 12.9069 90.7726; 102.013; 114.075 | 1296.91 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134737 | CIF | C64 H36 I4 | P 1 | 9.2973; 10.4393; 15.0098 102.391; 99.151; 115.642 | 1229.1 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134738 | CIF | C2.6 H1.49 I0.19 | P 1 21/n 1 | 8.8782; 23.1887; 22.1751 90; 98.8238; 90 | 4511.2 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134739 | CIF | C31 H15 Cl3 I2 N2 | P 1 21/c 1 | 12.8601; 20.375; 11.4044 90; 108.467; 90 | 2834.4 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134740 | CIF | C56 H54 | P c a 21 | 28.313; 18.0423; 8.0929 90; 90; 90 | 4134.1 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134741 | CIF | C2.53 H1.4 I0.14 | P -1 | 9.1268; 18.1759; 18.251 99.0899; 90.13; 90.1473 | 2989.6 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134742 | CIF | C H I O | P -1 | 14.5262; 17.6511; 18.136 64.033; 69.797; 67.014 | 3762.4 | Gonzalez-Rodriguez, Edgar; Abdo, Miguel A.; Dos Passos Gomes, Gabriel; Ayad, Suliman; White, Frankie D.; Tsvetkov, Nikolay P.; Hanson, Kenneth; Alabugin, Igor V. Twofold π-Extension of Polyarenes via Double and Triple Radical Alkyne <i>peri</i>-Annulations: Radical Cascades Converging on the Same Aromatic Core. Journal of the American Chemical Society, 2020 |
4134743 | CIF | C40 H43 F18 N13 P3 V | P -1 | 11.483; 11.901; 18.093 90.88; 96.38; 91.6 | 2455.9 | Dorn, Matthias; Kalmbach, Jens; Boden, Pit; Päpcke, Ayla; Gómez, Sandra; Förster, Christoph; Kuczelinis, Felix; Carrella, Luca M.; Büldt, Laura A; Bings, Nicolas H.; Rentschler, Eva; Lochbrunner, Stefan; González, Leticia; Gerhards, Markus; Seitz, Michael; Heinze, Katja A Vanadium(III) Complex with Blue and NIR-II Spin-Flip Luminescence in Solution. Journal of the American Chemical Society, 2020, 142, 7947-7955 |
4134744 | CIF | C38.88 H51.66 Ni P2 S Si | P b c a | 19.6982; 18.6978; 20.3197 90; 90; 90 | 7484 | Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. H<sub>2</sub> Evolution from a Thiolate-Bound Ni(III) Hydride. Journal of the American Chemical Society, 2020, 142, 7827-7835 |
4134745 | CIF | C36 H45 K Ni P2 S Si | P 1 21/c 1 | 10.579; 26.7073; 13.485 90; 96.329; 90 | 3786.8 | Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. H<sub>2</sub> Evolution from a Thiolate-Bound Ni(III) Hydride. Journal of the American Chemical Society, 2020, 142, 7827-7835 |
4134746 | CIF | C40 H52 N Ni O P2 S Si | C 1 2/c 1 | 16.5609; 19.0517; 24.6555 90; 108.276; 90 | 7386.7 | Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. H<sub>2</sub> Evolution from a Thiolate-Bound Ni(III) Hydride. Journal of the American Chemical Society, 2020, 142, 7827-7835 |
4134747 | CIF | C36 H44 Ni P2 S Si | P 1 21/c 1 | 10.6333; 23.759; 13.7441 90; 107.008; 90 | 3320.4 | Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. H<sub>2</sub> Evolution from a Thiolate-Bound Ni(III) Hydride. Journal of the American Chemical Society, 2020, 142, 7827-7835 |
4134748 | CIF | C41 H57 Li Ni O P2 S Si | P 1 21/c 1 | 11.6307; 24.5754; 17.3135 90; 103.426; 90 | 4813.5 | Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. H<sub>2</sub> Evolution from a Thiolate-Bound Ni(III) Hydride. Journal of the American Chemical Society, 2020, 142, 7827-7835 |
4134749 | CIF | C36.87 H46.6 N0.26 Ni P2 S Si | P 1 21/n 1 | 12.5356; 17.6421; 15.1447 90; 91.473; 90 | 3348.2 | Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. H<sub>2</sub> Evolution from a Thiolate-Bound Ni(III) Hydride. Journal of the American Chemical Society, 2020, 142, 7827-7835 |
4134750 | CIF | C312 H210 Co6 F72 N72 O48 S24 | P -1 | 26.428; 34.545; 48.902 79.82; 85.36; 78.09 | 42951 | Rizzuto, Felix J.; Nitschke, Jonathan R. Narcissistic, Integrative, and Kinetic Self-Sorting within a System of Coordination Cages. Journal of the American Chemical Society, 2020, 142, 7749-7753 |
4134751 | CIF | C36 H66 O3 Si3 | P 1 21/c 1 | 24.6743; 10.7666; 14.6325 90; 100.481; 90 | 3822.39 | Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen Asymmetric Total Synthesis of (-)-Spirochensilide A. Journal of the American Chemical Society, 2020 |
4134752 | CIF | C33 H59 Cl O3 Si2 | P 1 21/n 1 | 10.9749; 24.6837; 13.5232 90; 95.884; 90 | 3644.15 | Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen Asymmetric Total Synthesis of (-)-Spirochensilide A. Journal of the American Chemical Society, 2020 |
4134753 | CIF | C33 H58 O3 Si2 | P -1 | 7.3602; 17.1118; 26.8552 93.828; 96.178; 92.265 | 3351.4 | Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen Asymmetric Total Synthesis of (-)-Spirochensilide A. Journal of the American Chemical Society, 2020 |
4134754 | CIF | C30 H42 O5 | P b c a | 14.4159; 12.894; 28.4623 90; 90; 90 | 5290.5 | Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen Asymmetric Total Synthesis of (-)-Spirochensilide A. Journal of the American Chemical Society, 2020 |
4134755 | CIF | C53 H86 Br2 O6 Si3 | P -1 | 11.6286; 15.8231; 17.4203 73.227; 81.077; 71.98 | 2910.8 | Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen Asymmetric Total Synthesis of (-)-Spirochensilide A. Journal of the American Chemical Society, 2020 |
4134756 | CIF | C36 H66 O3 Si3 | P 1 21/n 1 | 19.3242; 20.652; 19.7232 90; 97.318; 90 | 7807.1 | Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen Asymmetric Total Synthesis of (-)-Spirochensilide A. Journal of the American Chemical Society, 2020 |
4134757 | CIF | C94 H124 Al2 Cl4 Mn2 N4 O21 | P 21 21 21 | 15.6733; 23.5355; 26.0438 90; 90; 90 | 9607 | Lamb, Jessica R.; Hubbell, Aran K.; MacMillan, Samantha N.; Coates, Geoffrey W. Carbonylative, Catalytic Deoxygenation of 2,3-Disubstituted Epoxides with Inversion of Stereochemistry: An Alternative Alkene Isomerization Method. Journal of the American Chemical Society, 2020, 142, 8029-8035 |
4134758 | CIF | C20 H20 O2 Si | P -1 | 7.0319; 8.2216; 22.6065 100.434; 91.333; 93.497 | 1282.17 | Tang, Jinghua; Liu, Liu Leo; Yang, Shangru; Cong, Xuefeng; Luo, Meiming; Zeng, Xiaoming Chemoselective Cross-Coupling between Two Different and Unactivated C(aryl)-O Bonds Enabled by Chromium Catalysis. Journal of the American Chemical Society, 2020, 142, 7715-7720 |
4134759 | CIF | C76 H96 Fe2 N8 O2 P2 | P -1 | 10.6831; 16.4143; 20.2856 91.674; 98.011; 98.486 | 3479.41 | Liu, Tianchang; Gau, Michael R.; Tomson, Neil C. Mimicking the Constrained Geometry of a Nitrogen-Fixation Intermediate. Journal of the American Chemical Society, 2020 |
4134760 | CIF | C45 H81 Fe2 N8 O P2 | P -1 | 9.8631; 13.0959; 20.1607 91.874; 92.34; 106.816 | 2487.9 | Liu, Tianchang; Gau, Michael R.; Tomson, Neil C. Mimicking the Constrained Geometry of a Nitrogen-Fixation Intermediate. Journal of the American Chemical Society, 2020 |
4134761 | CIF | C109 H152 B20 Cl2 Ir4 N8 O5 S4 | P 1 21/c 1 | 16.121; 20.2886; 19.1144 90; 101.203; 90 | 6132.7 | Cui, Peng-Fei; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin Dihydrogen Bond Interaction Induced Separation of Hexane Isomers by Self-Assembled Carborane Metallacycles. Journal of the American Chemical Society, 2020 |
4134762 | CIF | C112 H152 B20 Ir4 N8 O8 S4 | P b c a | 22.3072; 17.7179; 30.6044 90; 90; 90 | 12096 | Cui, Peng-Fei; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin Dihydrogen Bond Interaction Induced Separation of Hexane Isomers by Self-Assembled Carborane Metallacycles. Journal of the American Chemical Society, 2020 |
4134763 | CIF | C8 H11 B5 N S | P 1 21/c 1 | 12.2385; 7.2735; 12.385 90; 106.522; 90 | 1057 | Cui, Peng-Fei; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin Dihydrogen Bond Interaction Induced Separation of Hexane Isomers by Self-Assembled Carborane Metallacycles. Journal of the American Chemical Society, 2020 |
4134764 | CIF | C101 H163 B20 F12 Ir4 N17 O19 S8 | C 1 2/c 1 | 30.973; 36.178; 26.393 90; 118.943; 90 | 25881 | Cui, Peng-Fei; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin Dihydrogen Bond Interaction Induced Separation of Hexane Isomers by Self-Assembled Carborane Metallacycles. Journal of the American Chemical Society, 2020 |
4134765 | CIF | C106 H136 F12 Ir4 N4 O26 S4 | P b c a | 21.999; 18.835; 27.602 90; 90; 90 | 11437 | Cui, Peng-Fei; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin Dihydrogen Bond Interaction Induced Separation of Hexane Isomers by Self-Assembled Carborane Metallacycles. Journal of the American Chemical Society, 2020 |
4134766 | CIF | C30 H29 Au N O0.5 P | P -1 | 9.1947; 12.5315; 12.6998 68.868; 72.203; 72.296 | 1268.24 | Zeman, Charles J.; Shen, Yu-Hsuan; Heller, Jessica; Abboud, Khalil A.; Schanze, Kirk S.; Veige, Adam S. Excited State Turn-On of Aurophilicity and Tunability of Relativistic Effects in a Series of Digold Triazolates Synthesized via iClick. Journal of the American Chemical Society, 2020 |
4134767 | CIF | C25.5 H22 Au Cl3 N3 P S | P 1 21/c 1 | 14.4013; 22.8626; 17.4326 90; 111.053; 90 | 5356.6 | Zeman, Charles J.; Shen, Yu-Hsuan; Heller, Jessica; Abboud, Khalil A.; Schanze, Kirk S.; Veige, Adam S. Excited State Turn-On of Aurophilicity and Tunability of Relativistic Effects in a Series of Digold Triazolates Synthesized via iClick. Journal of the American Chemical Society, 2020 |
4134768 | CIF | C43.5 H36 Au2 Cl3 N3 P2 S | P n a 21 | 17.4021; 22.787; 11.8185 90; 90; 90 | 4686.5 | Zeman, Charles J.; Shen, Yu-Hsuan; Heller, Jessica; Abboud, Khalil A.; Schanze, Kirk S.; Veige, Adam S. Excited State Turn-On of Aurophilicity and Tunability of Relativistic Effects in a Series of Digold Triazolates Synthesized via iClick. Journal of the American Chemical Society, 2020 |
4134769 | CIF | C49 H46 Au2 Cl6 N4 P2 | P -1 | 11.3232; 14.8436; 15.9362 108.324; 110.093; 91.327 | 2361.95 | Zeman, Charles J.; Shen, Yu-Hsuan; Heller, Jessica; Abboud, Khalil A.; Schanze, Kirk S.; Veige, Adam S. Excited State Turn-On of Aurophilicity and Tunability of Relativistic Effects in a Series of Digold Triazolates Synthesized via iClick. Journal of the American Chemical Society, 2020 |
4134770 | CIF | C48 H36 Au2 P2 S2 | P -1 | 11.4948; 12.7123; 13.9821 96.619; 93.383; 92.209 | 2023.86 | Zeman, Charles J.; Shen, Yu-Hsuan; Heller, Jessica; Abboud, Khalil A.; Schanze, Kirk S.; Veige, Adam S. Excited State Turn-On of Aurophilicity and Tunability of Relativistic Effects in a Series of Digold Triazolates Synthesized via iClick. Journal of the American Chemical Society, 2020 |
4134771 | CIF | C46 H35 Au2 N3 P2 S2 | P 1 21/n 1 | 12.5803; 13.1347; 25.578 90; 100.26; 90 | 4158.9 | Zeman, Charles J.; Shen, Yu-Hsuan; Heller, Jessica; Abboud, Khalil A.; Schanze, Kirk S.; Veige, Adam S. Excited State Turn-On of Aurophilicity and Tunability of Relativistic Effects in a Series of Digold Triazolates Synthesized via iClick. Journal of the American Chemical Society, 2020 |
4134772 | CIF | C84 H135 Fe2 K4 N8 O12.5 | P 1 21/n 1 | 18.267; 21.858; 23.701 90; 106.167; 90 | 9089 | Sorsche, Dieter; Miehlich, Matthias E.; Searles, Keith; Gouget, Guillaume; Zolnhofer, Eva M.; Fortier, Skye; Chen, Chun-Hsing; Gau, Michael; Carroll, Patrick J.; Murray, Christopher B.; Caulton, Kenneth G.; Khusniyarov, Marat M.; Meyer, Karsten; Mindiola, Daniel J. Unusual Dinitrogen Binding and Electron Storage in Dinuclear Iron Complexes. Journal of the American Chemical Society, 2020 |
4134773 | CIF | C79 H106 Fe2 K2 N8 | C 1 2/c 1 | 23.887; 13.743; 23.071 90; 99.689; 90 | 7466 | Sorsche, Dieter; Miehlich, Matthias E.; Searles, Keith; Gouget, Guillaume; Zolnhofer, Eva M.; Fortier, Skye; Chen, Chun-Hsing; Gau, Michael; Carroll, Patrick J.; Murray, Christopher B.; Caulton, Kenneth G.; Khusniyarov, Marat M.; Meyer, Karsten; Mindiola, Daniel J. Unusual Dinitrogen Binding and Electron Storage in Dinuclear Iron Complexes. Journal of the American Chemical Society, 2020 |
4134774 | CIF | C60.5 H88 Fe2 K2 N8 | P -1 | 11.038; 14.8077; 19.1696 103.576; 103.321; 93.031 | 2944.7 | Sorsche, Dieter; Miehlich, Matthias E.; Searles, Keith; Gouget, Guillaume; Zolnhofer, Eva M.; Fortier, Skye; Chen, Chun-Hsing; Gau, Michael; Carroll, Patrick J.; Murray, Christopher B.; Caulton, Kenneth G.; Khusniyarov, Marat M.; Meyer, Karsten; Mindiola, Daniel J. Unusual Dinitrogen Binding and Electron Storage in Dinuclear Iron Complexes. Journal of the American Chemical Society, 2020 |
4134775 | CIF | C71 H114 Fe2 K2 N6 O2 | P 1 21/c 1 | 15.2409; 19.6205; 25.0846 90; 95.114; 90 | 7471.3 | Sorsche, Dieter; Miehlich, Matthias E.; Searles, Keith; Gouget, Guillaume; Zolnhofer, Eva M.; Fortier, Skye; Chen, Chun-Hsing; Gau, Michael; Carroll, Patrick J.; Murray, Christopher B.; Caulton, Kenneth G.; Khusniyarov, Marat M.; Meyer, Karsten; Mindiola, Daniel J. Unusual Dinitrogen Binding and Electron Storage in Dinuclear Iron Complexes. Journal of the American Chemical Society, 2020 |
4134776 | CIF | C80 H118 Fe K2 N6 O2 | P -1 | 14.1935; 14.9296; 20.5175 106.481; 107.308; 99.2665 | 3834.6 | Sorsche, Dieter; Miehlich, Matthias E.; Searles, Keith; Gouget, Guillaume; Zolnhofer, Eva M.; Fortier, Skye; Chen, Chun-Hsing; Gau, Michael; Carroll, Patrick J.; Murray, Christopher B.; Caulton, Kenneth G.; Khusniyarov, Marat M.; Meyer, Karsten; Mindiola, Daniel J. Unusual Dinitrogen Binding and Electron Storage in Dinuclear Iron Complexes. Journal of the American Chemical Society, 2020 |
4134777 | CIF | C58 H82 Fe2 N6 | P -1 | 9.8917; 13.3478; 20.5374 81.598; 87.079; 89.906 | 2679 | Sorsche, Dieter; Miehlich, Matthias E.; Searles, Keith; Gouget, Guillaume; Zolnhofer, Eva M.; Fortier, Skye; Chen, Chun-Hsing; Gau, Michael; Carroll, Patrick J.; Murray, Christopher B.; Caulton, Kenneth G.; Khusniyarov, Marat M.; Meyer, Karsten; Mindiola, Daniel J. Unusual Dinitrogen Binding and Electron Storage in Dinuclear Iron Complexes. Journal of the American Chemical Society, 2020 |
4134778 | CIF | C55 H89.62 Cl Cu N4 O4.31 | P 1 21/c 1 | 10.1912; 26.8069; 20.4707 90; 100.862; 90 | 5492.3 | Bower, Jamey K.; Cypcar, Andrew D.; Henriquez, Brenda; Stieber, S Chantal E; Zhang, Shiyu C(sp<sup>3</sup>)-H Fluorination with a Copper(II)/(III) Redox Couple. Journal of the American Chemical Society, 2020 |
4134779 | CIF | C43 H47 Cu F3 N3 O2 | P 1 21/m 1 | 9.1436; 13.9372; 15.675 90; 97.531; 90 | 1980.3 | Bower, Jamey K.; Cypcar, Andrew D.; Henriquez, Brenda; Stieber, S Chantal E; Zhang, Shiyu C(sp<sup>3</sup>)-H Fluorination with a Copper(II)/(III) Redox Couple. Journal of the American Chemical Society, 2020 |
4134780 | CIF | C39 H57 Cl Cu N3 O4 | C 1 2/c 1 | 19.3809; 13.1487; 15.3938 90; 95.551; 90 | 3904.5 | Bower, Jamey K.; Cypcar, Andrew D.; Henriquez, Brenda; Stieber, S Chantal E; Zhang, Shiyu C(sp<sup>3</sup>)-H Fluorination with a Copper(II)/(III) Redox Couple. Journal of the American Chemical Society, 2020 |
4134781 | CIF | C87 H107 Cu F N4 O7 P2 | P 21 21 21 | 15.0248; 17.643; 30.044 90; 90; 90 | 7964.1 | Bower, Jamey K.; Cypcar, Andrew D.; Henriquez, Brenda; Stieber, S Chantal E; Zhang, Shiyu C(sp<sup>3</sup>)-H Fluorination with a Copper(II)/(III) Redox Couple. Journal of the American Chemical Society, 2020 |
4134782 | CIF | C39 H57 Br Cu N3 O4 | C 1 2/c 1 | 19.5193; 13.327; 15.3535 90; 94.521; 90 | 3981.5 | Bower, Jamey K.; Cypcar, Andrew D.; Henriquez, Brenda; Stieber, S Chantal E; Zhang, Shiyu C(sp<sup>3</sup>)-H Fluorination with a Copper(II)/(III) Redox Couple. Journal of the American Chemical Society, 2020 |
4134783 | CIF | C55 H89 Br Cu N4 O4 | P 1 21/c 1 | 10.2228; 26.7001; 20.482 90; 101.079; 90 | 5486.4 | Bower, Jamey K.; Cypcar, Andrew D.; Henriquez, Brenda; Stieber, S Chantal E; Zhang, Shiyu C(sp<sup>3</sup>)-H Fluorination with a Copper(II)/(III) Redox Couple. Journal of the American Chemical Society, 2020 |
4134784 | CIF | C38 H60 Br Co N3 O | P b c n | 39.604; 12.148; 15.6435 90; 90; 90 | 7526.2 | Sengupta, Debabrata; Sandoval-Pauker, Christian; Schueller, Emily C.; Encerrado-Manriquez, Angela M; Metta-Magana, Alejandro J; Lee, Wen-Yee; Seshadri, Ram; Pintér, Balázs; Fortier, Skye Isolation of a Bimetallic Cobalt(III) Nitride and Examination of Its Hydrogen Atom Abstraction Chemistry and Reactivity Towards H2. Journal of the American Chemical Society, 2020 |
4134785 | CIF | C76 H104 Co2 N12 O2 | P 1 21/c 1 | 17.7543; 21.2404; 10.2959 90; 91.993; 90 | 3880.3 | Sengupta, Debabrata; Sandoval-Pauker, Christian; Schueller, Emily C.; Encerrado-Manriquez, Angela M; Metta-Magana, Alejandro J; Lee, Wen-Yee; Seshadri, Ram; Pintér, Balázs; Fortier, Skye Isolation of a Bimetallic Cobalt(III) Nitride and Examination of Its Hydrogen Atom Abstraction Chemistry and Reactivity Towards H2. Journal of the American Chemical Society, 2020 |
4134786 | CIF | C235.11 H318 Co6 N24 | P -1 | 15.7471; 18.5697; 23.0557 78.769; 73.599; 68.813 | 5997.9 | Sengupta, Debabrata; Sandoval-Pauker, Christian; Schueller, Emily C.; Encerrado-Manriquez, Angela M; Metta-Magana, Alejandro J; Lee, Wen-Yee; Seshadri, Ram; Pintér, Balázs; Fortier, Skye Isolation of a Bimetallic Cobalt(III) Nitride and Examination of Its Hydrogen Atom Abstraction Chemistry and Reactivity Towards H2. Journal of the American Chemical Society, 2020 |
4134787 | CIF | C79 H124 Br0.19 Co2 N10.3 | P n a 21 | 30.437; 16.9734; 15.1227 90; 90; 90 | 7812.7 | Sengupta, Debabrata; Sandoval-Pauker, Christian; Schueller, Emily C.; Encerrado-Manriquez, Angela M; Metta-Magana, Alejandro J; Lee, Wen-Yee; Seshadri, Ram; Pintér, Balázs; Fortier, Skye Isolation of a Bimetallic Cobalt(III) Nitride and Examination of Its Hydrogen Atom Abstraction Chemistry and Reactivity Towards H2. Journal of the American Chemical Society, 2020 |
4134788 | CIF | C90 H130 Co2 N13 Na O4 | P -1 | 12.4567; 12.6505; 16.5318 70.454; 72.443; 70.308 | 2258.4 | Sengupta, Debabrata; Sandoval-Pauker, Christian; Schueller, Emily C.; Encerrado-Manriquez, Angela M; Metta-Magana, Alejandro J; Lee, Wen-Yee; Seshadri, Ram; Pintér, Balázs; Fortier, Skye Isolation of a Bimetallic Cobalt(III) Nitride and Examination of Its Hydrogen Atom Abstraction Chemistry and Reactivity Towards H2. Journal of the American Chemical Society, 2020 |
4134789 | CIF | C140 H120 F48 N12 O4 P8 Zn | P -1 | 14.6658; 17.54; 19.039 108.894; 106.654; 102.13 | 4184 | Liu, Wenqi; Lin, Chenjian; Weber, Jacob Andrew; Stern, Charlotte L.; Young, Ryan M.; Wasielewski, Michael R.; Stoddart, J. Fraser Cyclophane-Sustained Ultrastable Porphyrins. Journal of the American Chemical Society, 2020 |
4134790 | CIF | C134 H110 F48 N12 O2 P8 | P -1 | 14.66878; 17.5021; 19.14358 108.97; 106.693; 102.297 | 4189.71 | Liu, Wenqi; Lin, Chenjian; Weber, Jacob Andrew; Stern, Charlotte L.; Young, Ryan M.; Wasielewski, Michael R.; Stoddart, J. Fraser Cyclophane-Sustained Ultrastable Porphyrins. Journal of the American Chemical Society, 2020 |
4134791 | CIF | C12 H14 Cl F3 O | P n a 21 | 20.0407; 12.4313; 5.1226 90; 90; 90 | 1276.2 | Xu, Shiyan; Holst, Hannah Marie; McGuire, Shelby Barbara; Race, Nicholas James Reagent control enables selective and regiodivergent opening of unsymmetrical phenonium ions. Journal of the American Chemical Society, 2020 |
4134792 | CIF | C13 H17 Cl O3 | P 1 21/c 1 | 9.388; 5.204; 26.465 90; 98.911; 90 | 1277.3 | Xu, Shiyan; Holst, Hannah Marie; McGuire, Shelby Barbara; Race, Nicholas James Reagent control enables selective and regiodivergent opening of unsymmetrical phenonium ions. Journal of the American Chemical Society, 2020 |
4134793 | CIF | C21 H33 N O3 | P 1 21 1 | 13.1227; 6.1014; 14.7877 90; 111.106; 90 | 1104.58 | He, Rui; Huo, Xiaohong; Zhao, Ling; Wang, Feijun; Jiang, Liyin; Liao, Jian; Zhang, Wanbin Stereodivergent Pd/Cu Catalysis for the Dynamic Kinetic Asymmetric Transformation of Racemic Unsymmetrical 1,3-Disubstituted Allyl Acetates. Journal of the American Chemical Society, 2020 |
4134794 | CIF | C21 H33 N O3 | P 21 21 21 | 6.367; 17.479; 19.6003 90; 90; 90 | 2181.29 | He, Rui; Huo, Xiaohong; Zhao, Ling; Wang, Feijun; Jiang, Liyin; Liao, Jian; Zhang, Wanbin Stereodivergent Pd/Cu Catalysis for the Dynamic Kinetic Asymmetric Transformation of Racemic Unsymmetrical 1,3-Disubstituted Allyl Acetates. Journal of the American Chemical Society, 2020 |
4134795 | CIF | C29 H31 N5 O9 S | P 1 21/n 1 | 8.2796; 32.4638; 24.8002 90; 98.611; 90 | 6590.8 | Walker, Morgan M.; Koronkiewicz, Brian; Chen, Shuming; Houk, K. N.; Mayer, James M.; Ellman, Jonathan A. Highly Diastereoselective Functionalization of Piperidines by Photoredox Catalyzed α-Amino C-H Arylation and Epimerization. Journal of the American Chemical Society, 2020 |
4134796 | CIF | C29.5 H29 N5 O10 S | P -1 | 8.9495; 9.6147; 18.2756 81.734; 86.081; 75.2 | 1503.77 | Walker, Morgan M.; Koronkiewicz, Brian; Chen, Shuming; Houk, K. N.; Mayer, James M.; Ellman, Jonathan A. Highly Diastereoselective Functionalization of Piperidines by Photoredox Catalyzed α-Amino C-H Arylation and Epimerization. Journal of the American Chemical Society, 2020 |
4134797 | CIF | C25.5 H32 N4 O9 S | P 1 21/c 1 | 8.0919; 21.6444; 15.449 90; 90.114; 90 | 2705.8 | Walker, Morgan M.; Koronkiewicz, Brian; Chen, Shuming; Houk, K. N.; Mayer, James M.; Ellman, Jonathan A. Highly Diastereoselective Functionalization of Piperidines by Photoredox Catalyzed α-Amino C-H Arylation and Epimerization. Journal of the American Chemical Society, 2020 |
4134798 | CIF | C29 H31 N5 O9 S | P 1 21/c 1 | 9.7906; 17.229; 18.2219 90; 102.724; 90 | 2998.2 | Walker, Morgan M.; Koronkiewicz, Brian; Chen, Shuming; Houk, K. N.; Mayer, James M.; Ellman, Jonathan A. Highly Diastereoselective Functionalization of Piperidines by Photoredox Catalyzed α-Amino C-H Arylation and Epimerization. Journal of the American Chemical Society, 2020 |
4134799 | CIF | C29 H31 N5 O9 S | P 1 21/c 1 | 8.1117; 19.7564; 18.3015 90; 92.656; 90 | 2929.8 | Walker, Morgan M.; Koronkiewicz, Brian; Chen, Shuming; Houk, K. N.; Mayer, James M.; Ellman, Jonathan A. Highly Diastereoselective Functionalization of Piperidines by Photoredox Catalyzed α-Amino C-H Arylation and Epimerization. Journal of the American Chemical Society, 2020 |
4134800 | CIF | C21 H19 N O2 | P b c a | 16.6583; 9.9298; 19.3483 90; 90; 90 | 3200.47 | Wang, Hao; Gao, Yuzhen; Zhou, Chunlin; Li, Gang Visible-Light-Driven Reductive Carboarylation of Styrenes with CO<sub>2</sub> and Aryl Halides. Journal of the American Chemical Society, 2020 |
4134801 | CIF | C35 H44 B20 Cu2 N O9 | I 4 2 2 | 20.9233; 20.9233; 26.342 90; 90; 90 | 11532.1 | Gan, Lei; Chidambaram, Arunraj; Fonquernie, Pol G.; Light, Mark E.; Choquesillo-Lazarte, Duane; Huang, Hongliang; Solano, Eduardo; Fraile, Julio; Viñas, Clara; Teixidor, Francesc; Navarro, Jorge A. R.; Stylianou, Kyriakos C.; Planas, José G. A Highly Water-Stable meta-Carborane-Based Copper Metal‒Organic Framework for Efficient High-Temperature Butanol Separation Journal of the American Chemical Society, 2020 |
4134802 | CIF | C68 H56 O9 | P 1 21 1 | 11.1897; 22.9476; 11.9706 90; 97.33; 90 | 3048.65 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134803 | CIF | C69 H58 Cl2 O8 | I 1 2/a 1 | 15.7416; 18.3691; 18.8001 90; 98.056; 90 | 5382.6 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134804 | CIF | C68 H56 O8 | P 1 21 1 | 11.23; 22.991; 11.992 90; 97.123; 90 | 3072.31 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134805 | CIF | C70 H60 Cl4 O8 | P 1 21/c 1 | 22.3783; 23.7901; 10.9436 90; 100.149; 90 | 5735.01 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134806 | CIF | C75 H66 F6 N O8 P | P 1 21/n 1 | 11.5052; 26.1338; 21.4462 90; 105.098; 90 | 6225.74 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134807 | CIF | C73 H65 F6 N2 O8 P | P 1 21/c 1 | 11.5277; 25.8886; 21.7575 90; 101.989; 90 | 6351.6 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134808 | CIF | C77 H77 O8 | P 1 21/n 1 | 11.8713; 21.3316; 24.2532 90; 100.206; 90 | 6044.55 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134809 | CIF | C68 H56 O8 | P -1 | 11.2952; 16.2834; 16.3725 86.306; 82.719; 75.013 | 2883.84 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134810 | CIF | C74 H64 N2 O8 | P 1 21/c 1 | 12.1031; 21.4125; 25.1008 90; 100.874; 90 | 6388.26 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134811 | CIF | C68 H56 O8 | P 21 21 21 | 11.7975; 11.833; 43.114 90; 90; 90 | 6018.7 | Han, Xiao-Ni; Han, Ying; Chen, Chuan-Feng Pagoda[4]arene and <i>i</i>-Pagoda[4]arene. Journal of the American Chemical Society, 2020 |
4134812 | CIF | C7 H21 Br7 N4 Pb2 | P 1 c 1 | 16.138; 11.909; 11.905 90; 90; 90 | 2288 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134813 | CIF | C7 H21 Br7 N4 Pb2 | C 1 m 1 | 8.4615; 8.465; 16.004 90; 89.99; 90 | 1146.3 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134814 | CIF | C8 H26 Br7 N4 Pb2 | P 1 c 1 | 16.0142; 8.4185; 8.4164 90; 90.024; 90 | 1134.66 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134815 | CIF | C7 H22 Br7 N4 Pb2 | C 1 2 1 | 8.4121; 8.4176; 15.9228 90; 89.983; 90 | 1127.5 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134816 | CIF | C7 H22 Br7 N3 Pb2 | C 1 c 1 | 33.433; 8.3738; 8.376 90; 104.45; 90 | 2270.8 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134817 | CIF | C7 H0.5 Br7 N3 Pb2 | P 1 c 1 | 16.193; 8.3678; 8.3469 90; 89.921; 90 | 1131 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134818 | CIF | C7 H21 Br7 N4 Pb2 | P 1 c 1 | 16.0382; 8.4484; 8.4494 90; 89.994; 90 | 1144.87 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134819 | CIF | C7 H22 Br7 N3 Pb2 | P 1 c 1 | 15.952; 8.4134; 8.4135 90; 90.07; 90 | 1129.2 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134820 | CIF | C7 H22 Br7 N3 Pb2 | C 1 c 1 | 33.2368; 8.3841; 8.3801 90; 104.599; 90 | 2259.8 | Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Spanopoulos, Ioannis; He, Yihui; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Seshadri, Ram; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb<sub>2</sub>Br<sub>7</sub>. Journal of the American Chemical Society, 2020 |
4134821 | CIF | C53.5 H110 O15 Si10 U | P 1 2/c 1 | 25.785; 13.9805; 20.86 90; 106.277; 90 | 7218.4 | Assefa, Mikiyas K.; Wu, Guang; Hayton, Trevor W. Uranyl oxo silylation promoted by silsesquioxane coordination. Journal of the American Chemical Society, 2020 |
4134822 | CIF | C102 H189 N5 O32 Si14 U3 | P 1 21/c 1 | 19.266; 31.423; 24.877 90; 92.053; 90 | 15051 | Assefa, Mikiyas K.; Wu, Guang; Hayton, Trevor W. Uranyl oxo silylation promoted by silsesquioxane coordination. Journal of the American Chemical Society, 2020 |
4134823 | CIF | C84 H154 O24 Si14 U | C m c e | 18.9919; 25.2308; 21.8579 90; 90; 90 | 10473.9 | Assefa, Mikiyas K.; Wu, Guang; Hayton, Trevor W. Uranyl oxo silylation promoted by silsesquioxane coordination. Journal of the American Chemical Society, 2020 |
4134824 | CIF | C116 H218 Li2 O32 Si14 U | P 1 21/c 1 | 18.8172; 28.943; 26.8419 90; 103.13; 90 | 14236.6 | Assefa, Mikiyas K.; Wu, Guang; Hayton, Trevor W. Uranyl oxo silylation promoted by silsesquioxane coordination. Journal of the American Chemical Society, 2020 |
4134825 | CIF | C92.5 H171 Cl Li O26 Si14 U | P -1 | 14.417; 15.026; 30.501 78.946; 77.534; 64.451 | 5784 | Assefa, Mikiyas K.; Wu, Guang; Hayton, Trevor W. Uranyl oxo silylation promoted by silsesquioxane coordination. Journal of the American Chemical Society, 2020 |
4134826 | CIF | C4 H8 B N2 O3 Zn2 | P 3 2 1 | 8.65271; 8.65271; 15.0844 90; 90; 120 | 978.054 | Cao, Lei; Dai, Pengcheng; Tang, Jing; Li, Dong; Chen, Ruihua; Liu, Dandan; Gu, Xin; Li, Liangjun; Bando, Yoshio; Ok, Yong Sik; Zhao, Xuebo; Yamauchi, Yusuke Spherical Superstructure of Boron Nitride Nanosheets Derived from Boron-Containing Metal-Organic Frameworks. Journal of the American Chemical Society, 2020 |
4134827 | CIF | C52 H36 B Cl8 I N2 O2 | P -1 | 13.1334; 14.2586; 31.8035 86.195; 83.239; 69.168 | 5525.68 | Heinen, Flemming; Engelage, Elric; Cramer, Christopher J.; Huber, Stefan M. Hypervalent Iodine(III) Compounds as Biaxial Halogen Bond Donors. Journal of the American Chemical Society, 2020 |
4134828 | CIF | C16 H16 N2 O2 | P 1 21/c 1 | 9.4757; 18.517; 8.3509 90; 103.09; 90 | 1427.19 | Heinen, Flemming; Engelage, Elric; Cramer, Christopher J.; Huber, Stefan M. Hypervalent Iodine(III) Compounds as Biaxial Halogen Bond Donors. Journal of the American Chemical Society, 2020 |
4134829 | CIF | C24 H44 Cr2 Si2 | P 1 21/n 1 | 7.7739; 11.619; 15.966 90; 96.442; 90 | 1433 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134830 | CIF | C42 H79 Cr3 Si3 | R -3 :H | 20.6422; 20.6422; 19.1449 90; 90; 120 | 7064.7 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134831 | CIF | C54 H100 Cr4 N2 Si4 | P 1 21/c 1 | 24.5565; 11.8827; 21.1647 90; 107.75; 90 | 5881.8 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134832 | CIF | C48 H86 Cr4 N2 Si4 | P b c n | 11.8059; 20.8085; 43.452 90; 90; 90 | 10674.6 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134833 | CIF | C48 H86 Cr4 N2 Si4 | C 1 2/c 1 | 28.9967; 11.1756; 32.7459 90; 94.35; 90 | 10580.9 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134834 | CIF | C54 H92 Cr4 N2 Si4 | C 1 2/c 1 | 24.137; 11.8989; 21.1755 90; 108.438; 90 | 5769.5 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134835 | CIF | C36 H65 Cr3 N2 Si3 | P 1 21/c 1 | 37.955; 10.84; 19.797 90; 92.239; 90 | 8139 | Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes. Journal of the American Chemical Society, 2020 |
4134836 | CIF | C8 H22 I6 N2 Sn2 | I b a m | 13.721; 20.3857; 8.8553 90; 90; 90 | 2476.9 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Guo, Peijun; Sidhik, Siraj; Kepenekian, Mikaël; Even, Jacky; Mohite, Aditya D.; Schaller, Richard D.; Kanatzidis, Mercouri G. Water Stable 1D Hybrid Tin(II) Iodide Emits Broad Light with 36% Photoluminescence Quantum Efficiency. Journal of the American Chemical Society, 2020 |
4134837 | CIF | C8 H22 I6 N2 Sn2 | C 1 2/c 1 | 21.0227; 13.4267; 8.6803 90; 108.817; 90 | 2319.2 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Guo, Peijun; Sidhik, Siraj; Kepenekian, Mikaël; Even, Jacky; Mohite, Aditya D.; Schaller, Richard D.; Kanatzidis, Mercouri G. Water Stable 1D Hybrid Tin(II) Iodide Emits Broad Light with 36% Photoluminescence Quantum Efficiency. Journal of the American Chemical Society, 2020 |
4134838 | CIF | C8 H22 I6 N2 Sn2 | C 1 2/c 1 | 21.1574; 13.5267; 8.75 90; 108.89; 90 | 2369.3 | Spanopoulos, Ioannis; Hadar, Ido; Ke, Weijun; Guo, Peijun; Sidhik, Siraj; Kepenekian, Mikaël; Even, Jacky; Mohite, Aditya D.; Schaller, Richard D.; Kanatzidis, Mercouri G. Water Stable 1D Hybrid Tin(II) Iodide Emits Broad Light with 36% Photoluminescence Quantum Efficiency. Journal of the American Chemical Society, 2020 |
4134839 | CIF | C50 H62.5 Fe N1.5 O P2 S4 Si4 | P 1 21/n 1 | 12.0899; 35.279; 52.6465 90; 93.8197; 90 | 22404.9 | Chiang, Chuan-Kuei; Chu, Kai-Ti; Lin, Chia-Chin; Xie, Shi-Rou; Liu, Yu-Chiao; Demeshko, Serhiy; Lee, Gene-Hsiang; Meyer, Franc; Tsai, Ming-Li; Chiang, Ming-Hsi; Lee, Chien-Ming Photoinduced NO and HNO Production from Mononuclear {FeNO}<sup>6</sup> Complex Bearing a Pendant Thiol. Journal of the American Chemical Society, 2020 |
4134840 | CIF | C53 H69 Fe O P2 S4 Si4 | P 1 21/c 1 | 11.6404; 17.7643; 27.4234 90; 99.8809; 90 | 5586.6 | Chiang, Chuan-Kuei; Chu, Kai-Ti; Lin, Chia-Chin; Xie, Shi-Rou; Liu, Yu-Chiao; Demeshko, Serhiy; Lee, Gene-Hsiang; Meyer, Franc; Tsai, Ming-Li; Chiang, Ming-Hsi; Lee, Chien-Ming Photoinduced NO and HNO Production from Mononuclear {FeNO}<sup>6</sup> Complex Bearing a Pendant Thiol. Journal of the American Chemical Society, 2020 |
4134841 | CIF | C49 H64 Cl2 Fe P2 S4 Si4 | P 1 21/c 1 | 11.1747; 17.9172; 27.6759 90; 99.7297; 90 | 5461.5 | Chiang, Chuan-Kuei; Chu, Kai-Ti; Lin, Chia-Chin; Xie, Shi-Rou; Liu, Yu-Chiao; Demeshko, Serhiy; Lee, Gene-Hsiang; Meyer, Franc; Tsai, Ming-Li; Chiang, Ming-Hsi; Lee, Chien-Ming Photoinduced NO and HNO Production from Mononuclear {FeNO}<sup>6</sup> Complex Bearing a Pendant Thiol. Journal of the American Chemical Society, 2020 |
4134842 | CIF | C65 H71 Mn N2 O2 P3 S3 Si3 | P b c a | 27.3961; 17.5818; 28.1908 90; 90; 90 | 13578.7 | Chiang, Chuan-Kuei; Chu, Kai-Ti; Lin, Chia-Chin; Xie, Shi-Rou; Liu, Yu-Chiao; Demeshko, Serhiy; Lee, Gene-Hsiang; Meyer, Franc; Tsai, Ming-Li; Chiang, Ming-Hsi; Lee, Chien-Ming Photoinduced NO and HNO Production from Mononuclear {FeNO}<sup>6</sup> Complex Bearing a Pendant Thiol. Journal of the American Chemical Society, 2020 |
4134843 | CIF | C27 H36 Mn N O P S3 Si3 | P 1 21/n 1 | 11.2716; 14.8244; 19.6616 90; 90.5417; 90 | 3285.2 | Chiang, Chuan-Kuei; Chu, Kai-Ti; Lin, Chia-Chin; Xie, Shi-Rou; Liu, Yu-Chiao; Demeshko, Serhiy; Lee, Gene-Hsiang; Meyer, Franc; Tsai, Ming-Li; Chiang, Ming-Hsi; Lee, Chien-Ming Photoinduced NO and HNO Production from Mononuclear {FeNO}<sup>6</sup> Complex Bearing a Pendant Thiol. Journal of the American Chemical Society, 2020 |
4134844 | CIF | C50 H63 Cl4 Fe N O P2 S4 Si4 | P 1 21/c 1 | 11.6493; 18.6748; 27.5515 90; 93.9162; 90 | 5979.8 | Chiang, Chuan-Kuei; Chu, Kai-Ti; Lin, Chia-Chin; Xie, Shi-Rou; Liu, Yu-Chiao; Demeshko, Serhiy; Lee, Gene-Hsiang; Meyer, Franc; Tsai, Ming-Li; Chiang, Ming-Hsi; Lee, Chien-Ming Photoinduced NO and HNO Production from Mononuclear {FeNO}<sup>6</sup> Complex Bearing a Pendant Thiol. Journal of the American Chemical Society, 2020 |
4134845 | CIF | C19 H22 O5 | P 21 21 21 | 6.1878; 14.9676; 17.511 90; 90; 90 | 1621.8 | Hafeman, Nicholas J.; Loskot, Steven A.; Reimann, Christopher E.; Pritchett, Beau P.; Virgil, Scott C.; Stoltz, Brian M. The Total Synthesis of (-)-Scabrolide A. Journal of the American Chemical Society, 2020 |
4134846 | CIF | C19 H32 O9 | P 21 21 21 | 9.0245; 13.383; 16.329 90; 90; 90 | 1972.1 | Hafeman, Nicholas J.; Loskot, Steven A.; Reimann, Christopher E.; Pritchett, Beau P.; Virgil, Scott C.; Stoltz, Brian M. The Total Synthesis of (-)-Scabrolide A. Journal of the American Chemical Society, 2020 |
4134847 | CIF | C27 H34 O4 Si | P 1 21 1 | 6.9085; 10.3765; 17.058 90; 90.92; 90 | 1222.7 | Hafeman, Nicholas J.; Loskot, Steven A.; Reimann, Christopher E.; Pritchett, Beau P.; Virgil, Scott C.; Stoltz, Brian M. The Total Synthesis of (-)-Scabrolide A. Journal of the American Chemical Society, 2020 |
4134848 | CIF | C19 H26 O6 | P 21 21 21 | 10.221; 12.581; 13.333 90; 90; 90 | 1714.5 | Hafeman, Nicholas J.; Loskot, Steven A.; Reimann, Christopher E.; Pritchett, Beau P.; Virgil, Scott C.; Stoltz, Brian M. The Total Synthesis of (-)-Scabrolide A. Journal of the American Chemical Society, 2020 |
4134849 | CIF | C20 H22 | P 1 21/c 1 | 13.3703; 6.6693; 8.8119 90; 103.953; 90 | 762.577 | Zhang, Sheng; Bedi, Deepika; Cheng, L. U.; Unruh, Daniel K.; Li, Guigen; Findlater, Michael Cobalt (II)-Catalyzed Stereoselective Olefin Isomerization: Facile Access to Acyclic Trisubstituted Alkenes. Journal of the American Chemical Society, 2020 |
4134850 | CIF | C15 H17 Cl3 N2 O3 S | P -1 | 7.4; 9.556; 13.814 104.002; 101.714; 100.72 | 899.2 | Estrada, Jesús G; Williams, Wendy L.; Ting, Stephen I.; Doyle, Abigail G. Role of Electron-Deficient Olefin Ligands in a Ni-Catalyzed Aziridine Cross-Coupling To Generate Quaternary Carbons. Journal of the American Chemical Society, 2020 |
4134851 | CIF | C124 H82 Cl6 | P 1 21/n 1 | 18.0821; 24.2024; 24.6475 90; 110.073; 90 | 10131.3 | Schaub, Tobias A.; Prantl, Ephraim A.; Kohn, Julia; Bursch, Markus; Marshall, Checkers R.; Leonhardt, Erik James; Lovell, Terri C.; Zakharov, Lev N.; Brozek, Carl K.; Waldvogel, Siegfried R.; Grimme, Stefan; Jasti, Ramesh Exploration of the Solid-State Sorption Properties of Shape-persistent Macrocyclic Nanocarbons as Bulk Materials and Small Aggregates. Journal of the American Chemical Society, 2020 |
4134852 | CIF | C101.83 H64.83 Cl14.48 | P -1 | 20.902; 20.9356; 22.3508 71.185; 88.023; 83.811 | 9204 | Schaub, Tobias A.; Prantl, Ephraim A.; Kohn, Julia; Bursch, Markus; Marshall, Checkers R.; Leonhardt, Erik James; Lovell, Terri C.; Zakharov, Lev N.; Brozek, Carl K.; Waldvogel, Siegfried R.; Grimme, Stefan; Jasti, Ramesh Exploration of the Solid-State Sorption Properties of Shape-persistent Macrocyclic Nanocarbons as Bulk Materials and Small Aggregates. Journal of the American Chemical Society, 2020 |
4134853 | CIF | C123 H116 N4 O7.5 | C 1 2/c 1 | 38.384; 15.8148; 32.575 90; 93.97; 90 | 19727 | Schaub, Tobias A.; Prantl, Ephraim A.; Kohn, Julia; Bursch, Markus; Marshall, Checkers R.; Leonhardt, Erik James; Lovell, Terri C.; Zakharov, Lev N.; Brozek, Carl K.; Waldvogel, Siegfried R.; Grimme, Stefan; Jasti, Ramesh Exploration of the Solid-State Sorption Properties of Shape-persistent Macrocyclic Nanocarbons as Bulk Materials and Small Aggregates. Journal of the American Chemical Society, 2020 |
4134854 | CIF | C168 H277 N72 Pd12 | P 21 21 21 | 24.943; 25.029; 48.678 90; 90; 90 | 30390 | Howlader, Prodip; Zangrando, Ennio; Mukherjee, Partha Sarathi Self-Assembly of Enantiopure Pd12 Tetrahedral Homochiral Nano-Cages with Tetrazole Linkers and Chiral Recognition. Journal of the American Chemical Society, 2020 |
4134855 | CIF | C37 H36 Cu N | P b c a | 14.765; 16.931; 22.655 90; 90; 90 | 5663 | Gernert, Markus; Balles-Wolf, Lukas; Kerner, Florian; M Uuml Ller, Ulrich; Schmiedel, Alexander; Holzapfel, Marco; Marian, Christel M.; Pflaum, Jens; Lambert, Christoph; Steffen, Andreas Cyclic (amino)(aryl)carbenes (CAArCs) enter the field of chromophore ligands - Expanded π system leads to unusually deep red emitting Cu<sup>I</sup> compounds. Journal of the American Chemical Society, 2020 |
4134856 | CIF | C42 H46 Cu N | P -1 | 11.549; 14.169; 21.429 73.816; 89.477; 88.83 | 3366.9 | Gernert, Markus; Balles-Wolf, Lukas; Kerner, Florian; M Uuml Ller, Ulrich; Schmiedel, Alexander; Holzapfel, Marco; Marian, Christel M.; Pflaum, Jens; Lambert, Christoph; Steffen, Andreas Cyclic (amino)(aryl)carbenes (CAArCs) enter the field of chromophore ligands - Expanded π system leads to unusually deep red emitting Cu<sup>I</sup> compounds. Journal of the American Chemical Society, 2020 |
4134857 | CIF | C41 H46 Cu N O3 | P n a 21 | 23.615; 10.033; 14.816 90; 90; 90 | 3510 | Gernert, Markus; Balles-Wolf, Lukas; Kerner, Florian; M Uuml Ller, Ulrich; Schmiedel, Alexander; Holzapfel, Marco; Marian, Christel M.; Pflaum, Jens; Lambert, Christoph; Steffen, Andreas Cyclic (amino)(aryl)carbenes (CAArCs) enter the field of chromophore ligands - Expanded π system leads to unusually deep red emitting Cu<sup>I</sup> compounds. Journal of the American Chemical Society, 2020 |
4134858 | CIF | C44 H39 Cu N2 | P 1 21/n 1 | 14.836; 12.399; 18.325 90; 98.24; 90 | 3336 | Gernert, Markus; Balles-Wolf, Lukas; Kerner, Florian; M Uuml Ller, Ulrich; Schmiedel, Alexander; Holzapfel, Marco; Marian, Christel M.; Pflaum, Jens; Lambert, Christoph; Steffen, Andreas Cyclic (amino)(aryl)carbenes (CAArCs) enter the field of chromophore ligands - Expanded π system leads to unusually deep red emitting Cu<sup>I</sup> compounds. Journal of the American Chemical Society, 2020 |
4134859 | CIF | C32 H31 Br Cu N | P -1 | 10.565; 10.704; 12.752 92.177; 95.452; 116.018 | 1285 | Gernert, Markus; Balles-Wolf, Lukas; Kerner, Florian; M Uuml Ller, Ulrich; Schmiedel, Alexander; Holzapfel, Marco; Marian, Christel M.; Pflaum, Jens; Lambert, Christoph; Steffen, Andreas Cyclic (amino)(aryl)carbenes (CAArCs) enter the field of chromophore ligands - Expanded π system leads to unusually deep red emitting Cu<sup>I</sup> compounds. Journal of the American Chemical Society, 2020 |
4134860 | CIF | C47 H42 Cu N O2 | P -1 | 9.793; 10.8202; 18.064 97.741; 97.949; 105.42 | 1797.8 | Gernert, Markus; Balles-Wolf, Lukas; Kerner, Florian; M Uuml Ller, Ulrich; Schmiedel, Alexander; Holzapfel, Marco; Marian, Christel M.; Pflaum, Jens; Lambert, Christoph; Steffen, Andreas Cyclic (amino)(aryl)carbenes (CAArCs) enter the field of chromophore ligands - Expanded π system leads to unusually deep red emitting Cu<sup>I</sup> compounds. Journal of the American Chemical Society, 2020 |
4134861 | CIF | Mn38.869 N0.841 Si9.131 | P n m a | 12.0826; 11.9195; 16.5709 90; 90; 90 | 2386.52 | Peterson, Gordon G. C.; Berns, Veronica M.; Fredrickson, Daniel C. Mn39Si9Nx: Epitaxial Stabilization as a Pathway to the Formation of Intermetallic Nitrides. Journal of the American Chemical Society, 2020 |
4134862 | CIF | C15 H18 O4 | P c a 21 | 19.8814; 5.9438; 21.4591 90; 90; 90 | 2535.8 | Wang, Chengpeng; Naren, Nevin A.; Zheng, Pengfei; Dong, Guangbin Intramolecular β-Alkenylation of Cyclohexanones via Pd-Catalyzed Desaturation-Mediated C(sp3)-H/Alkyne Coupling. Journal of the American Chemical Society, 2020 |
4134863 | CIF | C21 H20 N4 O5 | P 1 21/n 1 | 7.604; 20.0492; 12.5383 90; 97.511; 90 | 1895.11 | Wang, Chengpeng; Naren, Nevin A.; Zheng, Pengfei; Dong, Guangbin Intramolecular β-Alkenylation of Cyclohexanones via Pd-Catalyzed Desaturation-Mediated C(sp3)-H/Alkyne Coupling. Journal of the American Chemical Society, 2020 |
4134864 | CIF | C16 H15 N O | P 1 21/n 1 | 12.714; 7.5056; 13.686 90; 90.064; 90 | 1306 | Hwang, Yeongyu; Jung, Hoimin; Lee, Euijae; Kim, Dongwook; Chang, Sukbok Quantitative Analysis on Two-Point Ligand Modulation of Iridium Catalysts for Chemodivergent C-H Amidation. Journal of the American Chemical Society, 2020 |
4134865 | CIF | C18 H18 Cl Ir N2 O3 | P -1 | 6.159; 8.188; 18.031 98.91; 91.7; 105.15 | 864.8 | Hwang, Yeongyu; Jung, Hoimin; Lee, Euijae; Kim, Dongwook; Chang, Sukbok Quantitative Analysis on Two-Point Ligand Modulation of Iridium Catalysts for Chemodivergent C-H Amidation. Journal of the American Chemical Society, 2020 |
4134866 | CIF | C11 H11 N O | P n a 21 | 16.063; 9.074; 24.195 90; 90; 90 | 3526.6 | Hwang, Yeongyu; Jung, Hoimin; Lee, Euijae; Kim, Dongwook; Chang, Sukbok Quantitative Analysis on Two-Point Ligand Modulation of Iridium Catalysts for Chemodivergent C-H Amidation. Journal of the American Chemical Society, 2020 |
4134867 | CIF | C24 H29 Cl I2 Ir N O | P 21 21 21 | 7.571; 14.723; 23.143 90; 90; 90 | 2579.7 | Hwang, Yeongyu; Jung, Hoimin; Lee, Euijae; Kim, Dongwook; Chang, Sukbok Quantitative Analysis on Two-Point Ligand Modulation of Iridium Catalysts for Chemodivergent C-H Amidation. Journal of the American Chemical Society, 2020 |
4134868 | CIF | C64 H128 La4 N32 O80 Rb4 | R 3 :H | 20.4511; 20.4511; 25.0437 90; 90; 120 | 9071.2 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134869 | CIF | C16 H34 La N8 O20 Rb | P 21 3 | 14.502; 14.502; 14.502 90; 90; 90 | 3049.89 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134870 | CIF | C16 H34 La N8 O20 Rb | P 21 3 | 14.549; 14.549; 14.549 90; 90; 90 | 3079.64 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134871 | CIF | C64 H128 La4 N33.33 O80 | R 3 :H | 20.5225; 20.5225; 25.052 90; 90; 120 | 9137.6 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134872 | CIF | C16 H36 La N9 O20 | P 21 3 | 14.5479; 14.5479; 14.5479 90; 90; 90 | 3078.94 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134873 | CIF | C17 H19 Br Cl F2 N O | P 1 21 1 | 11.3777; 6.86536; 11.42344 90; 104.831; 90 | 862.58 | Miller, Edward; Kim, Suhong; Gibson, Katarina; Derrick, Jeffrey S.; Toste, F. Dean Regio- and Enantioselective Bromocyclization of Difluoroalkenes as a Strategy to Access Tetrasubstituted Difluoromethylene-Containing Stereocenters. Journal of the American Chemical Society, 2020 |
4134874 | CIF | C14 H12 Br Cl F2 N4 O3 | P 62 | 18.0955; 18.0955; 10.6307 90; 90; 120 | 3014.63 | Miller, Edward; Kim, Suhong; Gibson, Katarina; Derrick, Jeffrey S.; Toste, F. Dean Regio- and Enantioselective Bromocyclization of Difluoroalkenes as a Strategy to Access Tetrasubstituted Difluoromethylene-Containing Stereocenters. Journal of the American Chemical Society, 2020 |
4134875 | CIF | C19 H29 N O8 | P 1 21 1 | 8.5167; 18.5743; 13.0021 90; 105.163; 90 | 1985.22 | McClymont, Kyle S.; Wang, Feng-Yuan; Minakar, Amin; Baran, Phil S. Total Synthesis of (-)-Maximiscin. Journal of the American Chemical Society, 2020 |
4134876 | CIF | C25 H31 N3 O2 Pt | P 1 21/c 1 | 11.707; 19.744; 11.109 90; 117.839; 90 | 2270.6 | McClymont, Kyle S.; Wang, Feng-Yuan; Minakar, Amin; Baran, Phil S. Total Synthesis of (-)-Maximiscin. Journal of the American Chemical Society, 2020 |
4134877 | CIF | C13 H20 O4 | P 31 | 9.3492; 9.3492; 13.5555 90; 90; 120 | 1026.11 | McClymont, Kyle S.; Wang, Feng-Yuan; Minakar, Amin; Baran, Phil S. Total Synthesis of (-)-Maximiscin. Journal of the American Chemical Society, 2020 |
4134878 | CIF | C30 H32 B N O4 | P 1 21 1 | 9.8361; 21.0549; 13.1959 90; 97.5578; 90 | 2709.1 | Li, Xiangyu; Hall, Dennis G. Stereodivergent Asymmetric Synthesis of α,β-Disubstituted β-Aminoalkylboronic Acid Derivatives via Group-Selective Protodeboronation Enabling Access to the Elusive Anti Isomer. Journal of the American Chemical Society, 2020 |
4134879 | CIF | C16 H24 D2 F12 N6 O8 S4 | P 1 21/n 1 | 12.652; 17.037; 16.19 90; 112.834; 90 | 3216 | Song, Xian-Jiang; Zhang, Zhi-Xu; Chen, Xiao-Gang; Zhang, Han-Yue; Pan, Qiang; Yao, Jie; You, Yu-Meng; Xiong, Ren-Gen Bistable State of Protons for Low-Voltage Memories. Journal of the American Chemical Society, 2020 |
4134880 | CIF | C16 H26 F12 N6 O8 S4 | P 1 21/n 1 | 12.606; 16.924; 16.08 90; 112.775; 90 | 3163.1 | Song, Xian-Jiang; Zhang, Zhi-Xu; Chen, Xiao-Gang; Zhang, Han-Yue; Pan, Qiang; Yao, Jie; You, Yu-Meng; Xiong, Ren-Gen Bistable State of Protons for Low-Voltage Memories. Journal of the American Chemical Society, 2020 |
4134881 | CIF | C8 H13 F6 N3 O4 S2 | P 1 21 1 | 12.5; 16.911; 15.921 90; 112.905; 90 | 3100 | Song, Xian-Jiang; Zhang, Zhi-Xu; Chen, Xiao-Gang; Zhang, Han-Yue; Pan, Qiang; Yao, Jie; You, Yu-Meng; Xiong, Ren-Gen Bistable State of Protons for Low-Voltage Memories. Journal of the American Chemical Society, 2020 |
4134882 | CIF | C8 H12 D F6 N3 O4 S2 | P 1 21 1 | 12.542; 16.952; 15.994 90; 113.037; 90 | 3129.3 | Song, Xian-Jiang; Zhang, Zhi-Xu; Chen, Xiao-Gang; Zhang, Han-Yue; Pan, Qiang; Yao, Jie; You, Yu-Meng; Xiong, Ren-Gen Bistable State of Protons for Low-Voltage Memories. Journal of the American Chemical Society, 2020 |
4134883 | CIF | C23 H45 Al Br N O Si2 | C 1 2/c 1 | 31.9312; 11.0163; 15.5333 90; 97.144; 90 | 5421.6 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134884 | CIF | C53 H81 Al K N O8 Si2 | P -1 | 11.3322; 15.847; 16.6312 88.823; 71.777; 73.126 | 2706.6 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134885 | CIF | C41.5 H74 Al2 N2 Si4 | P -1 | 12.1403; 12.5843; 16.9735 82.54; 77.864; 63.527 | 2267.4 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134886 | CIF | C35 H70 Al K N2 O8 Si2 | P 21 21 21 | 15.8845; 19.0232; 28.713 90; 90; 90 | 8676.3 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134887 | CIF | C35 H73 Al B2 K N O8 Si2 | P 21 21 21 | 12.363; 17.201; 21.419 90; 90; 90 | 4555 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134888 | CIF | C41 H74 Al K N O8 Si3 | P -1 | 13.286; 13.384; 14.255 93.101; 97.062; 91.57 | 2510 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134889 | CIF | C35 H67 Al K N O8 Si2 | P 1 21/n 1 | 11.3793; 13.5186; 27.8039 90; 98.587; 90 | 4229.2 | Koshino, Kota; Kinjo, Rei Construction of σ-aromatic AlB2 ring via A Borane Coupling with A Dicoordinate Cyclic (Alkyl)(Amino)Aluminyl Anion. Journal of the American Chemical Society, 2020 |
4134890 | CIF | C32 H30 Bi N2 O10 | P 1 21/n 1 | 8.0268; 23.535; 16.7335 90; 97.682; 90 | 3132.77 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134891 | CIF | C32 H31 Cu N2 O10 | P -1 | 7.9251; 12.738; 16.6928 74.195; 86.514; 82.047 | 1605.4 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134892 | CIF | C120 H112 Fe4 N4 O24 | P 1 21 1 | 16.696; 21.624; 16.696 90; 120; 90 | 5220 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134893 | CIF | C52 H44 N2 O14 Zn2 | C 1 2/c 1 | 29.1139; 16.3925; 11.4361 90; 99.919; 90 | 5376.3 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134894 | CIF | C26 H20 Cu N O6 | I 1 2/a 1 | 12.8598; 29.261; 13.8247 90; 103.98; 90 | 5048 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134895 | CIF | C64 H58 Fe4 N4 O20 | P 1 2/c 1 | 29.1661; 16.1141; 13.9552 90; 98.847; 90 | 6480.7 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134896 | CIF | C64 H58 Co4 N4 O20 | P 1 2/c 1 | 29.075; 16.016; 13.826 90; 98.39; 90 | 6369 | Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets. Journal of the American Chemical Society, 2020 |
4134897 | CIF | C12 H6 N1.5 O2 Pd0.25 Zn0.5 | P 4/m m m | 16.5927; 16.5927; 22.318 90; 90; 90 | 6144.5 | Danowski, Wojciech; Castiglioni, Fabio; Sardjan, Andy; Krause, Simon; Pfeifer, Lukas; Roke, Diederik; Comotti, Angiolina; Browne, Wesley R.; Feringa, Ben L. Visible Light Driven Rotation of Molecular Motors in a Dual-Function Metal Organic Framework Enabled by Energy Transfer. Journal of the American Chemical Society, 2020 |
4134898 | CIF | C48 H24 N6 O8 Pd Zn2 | P 4/m m m | 16.6421; 16.6421; 16.1146 90; 90; 90 | 4463.1 | Danowski, Wojciech; Castiglioni, Fabio; Sardjan, Andy; Krause, Simon; Pfeifer, Lukas; Roke, Diederik; Comotti, Angiolina; Browne, Wesley R.; Feringa, Ben L. Visible Light Driven Rotation of Molecular Motors in a Dual-Function Metal Organic Framework Enabled by Energy Transfer. Journal of the American Chemical Society, 2020 |
4134899 | CIF | C36 H24 N4 O6 Pd0.5 Zn | P 1 21/n 1 | 7.8815; 15.761; 33.58 90; 93.75; 90 | 4162.4 | Danowski, Wojciech; Castiglioni, Fabio; Sardjan, Andy; Krause, Simon; Pfeifer, Lukas; Roke, Diederik; Comotti, Angiolina; Browne, Wesley R.; Feringa, Ben L. Visible Light Driven Rotation of Molecular Motors in a Dual-Function Metal Organic Framework Enabled by Energy Transfer. Journal of the American Chemical Society, 2020 |
4134900 | CIF | C16 H17 F6 I O2 | P 1 21/c 1 | 11.0535; 13.1232; 12.7009 90; 108.368; 90 | 1748.5 | Ding, Wei; Chai, Jinkui; Wang, Chen; Wu, Junliang; Yoshikai, Naohiko Stereoselective Access to Highly Substituted Vinyl Ethers via <i>trans</i>-Difunctionalization of Alkynes with Alcohols and Iodine(III) Electrophile. Journal of the American Chemical Society, 2020, 142, 8619-8624 |
4134901 | CIF | C18.5 H14 Cl F6 I O2 | P c a 21 | 16.2807; 12.2181; 21.3944 90; 90; 90 | 4255.76 | Ding, Wei; Chai, Jinkui; Wang, Chen; Wu, Junliang; Yoshikai, Naohiko Stereoselective Access to Highly Substituted Vinyl Ethers via <i>trans</i>-Difunctionalization of Alkynes with Alcohols and Iodine(III) Electrophile. Journal of the American Chemical Society, 2020, 142, 8619-8624 |
4134902 | CIF | C15 H17 F6 I O2 Si | P -1 | 7.442; 11.8848; 12.5542 116.944; 95.0969; 102.62 | 943.14 | Ding, Wei; Chai, Jinkui; Wang, Chen; Wu, Junliang; Yoshikai, Naohiko Stereoselective Access to Highly Substituted Vinyl Ethers via <i>trans</i>-Difunctionalization of Alkynes with Alcohols and Iodine(III) Electrophile. Journal of the American Chemical Society, 2020, 142, 8619-8624 |
4134903 | CIF | C19 H15 F6 I O2 | P 1 21/n 1 | 15.095; 12.5082; 20.9361 90; 105.178; 90 | 3815.08 | Ding, Wei; Chai, Jinkui; Wang, Chen; Wu, Junliang; Yoshikai, Naohiko Stereoselective Access to Highly Substituted Vinyl Ethers via <i>trans</i>-Difunctionalization of Alkynes with Alcohols and Iodine(III) Electrophile. Journal of the American Chemical Society, 2020, 142, 8619-8624 |
4134904 | CIF | C37 H38 Cl F6 N6 O3 P Ru | P -1 | 8.7791; 11.6967; 18.8185 82.514; 79.563; 81.077 | 1867.02 | Gonell, Sergio; Assaf, Eric A.; Duffee, Kyle D.; Schauer, Cynthia K.; Miller, Alexander J. M. Kinetics of the <i>Trans</i> Effect in Ruthenium Complexes Provide Insight into the Factors That Control Activity and Stability in CO<sub>2</sub> Electroreduction. Journal of the American Chemical Society, 2020 |
4134905 | CIF | C32 H31.35 Cl2 F12 N6 O P2 Ru | P b c a | 17.6809; 13.9926; 30.1337 90; 90; 90 | 7455.1 | Gonell, Sergio; Assaf, Eric A.; Duffee, Kyle D.; Schauer, Cynthia K.; Miller, Alexander J. M. Kinetics of the <i>Trans</i> Effect in Ruthenium Complexes Provide Insight into the Factors That Control Activity and Stability in CO<sub>2</sub> Electroreduction. Journal of the American Chemical Society, 2020 |
4134906 | CIF | C36 H28 F12 N6 O P2 Ru | P 1 21/c 1 | 11.039; 24.302; 13.6393 90; 98.537; 90 | 3618.47 | Gonell, Sergio; Assaf, Eric A.; Duffee, Kyle D.; Schauer, Cynthia K.; Miller, Alexander J. M. Kinetics of the <i>Trans</i> Effect in Ruthenium Complexes Provide Insight into the Factors That Control Activity and Stability in CO<sub>2</sub> Electroreduction. Journal of the American Chemical Society, 2020 |
4134907 | CIF | C438 H420 Cd6 F36 N60 O60 S12 | P b c n | 24.8897; 50.19; 90.1828 90; 90; 90 | 112658 | Zhang, Dawei; Ronson, Tanya K.; Xu, Lin; Nitschke, Jonathan R. Transformation Network Culminating in a Heteroleptic Cd<sub>6</sub>L<sub>6</sub>L'<sub>2</sub> Twisted Trigonal Prism. Journal of the American Chemical Society, 2020, 142, 9152-9157 |
4134908 | CIF | C246.5 H171.75 Cd4 F24 N41.25 O36 S8 | P -1 | 22.9361; 23.5657; 48.429 90.316; 93.473; 99.963 | 25731 | Zhang, Dawei; Ronson, Tanya K.; Xu, Lin; Nitschke, Jonathan R. Transformation Network Culminating in a Heteroleptic Cd<sub>6</sub>L<sub>6</sub>L'<sub>2</sub> Twisted Trigonal Prism. Journal of the American Chemical Society, 2020, 142, 9152-9157 |
4134909 | CIF | C164 H117 F24 Fe2 N25 O16 S8 | P 1 21/n 1 | 18.925; 19.158; 48.752 90; 93.26; 90 | 17647 | Zhang, Dawei; Ronson, Tanya K.; Xu, Lin; Nitschke, Jonathan R. Transformation Network Culminating in a Heteroleptic Cd<sub>6</sub>L<sub>6</sub>L'<sub>2</sub> Twisted Trigonal Prism. Journal of the American Chemical Society, 2020, 142, 9152-9157 |
4134910 | CIF | C115.01 H107.4 F12 N12.64 O23.65 Ru4 S4 | R 3 :H | 42.315; 42.315; 19.337 90; 90; 120 | 29985 | Singh, Jatinder; Kim, Dong Hwan; Kim, Eun-Hee; Kim, Hyunuk; Hadiputra, Rizky; Jung, Jaehoon; Chi, Ki-Whan The first quantitative synthesis of a closed three‒link chain (6<sup>3</sup><sub>1</sub>) using coordination and non-covalent interactions‒driven self‒assembly. Journal of the American Chemical Society, 2020 |
4134911 | CIF | C29 H32 O3 | P 21 21 21 | 5.8373; 8.5386; 47.775 90; 90; 90 | 2381.2 | Dong, Xiao-Yang; Cheng, Jiang-Tao; Zhang, Yu-Feng; Li, Zhong-Liang; Zhan, Tian-Ya; Chen, Ji-Jun; Wang, Fu-Li; Yang, Ning-Yuan; Ye, Liu; Gu, Qiang-Shuai; Liu, Xin-Yuan Copper-Catalyzed Asymmetric Radical 1,2-Carboalkynylation of Alkenes with Alkyl Halides and Terminal Alkynes. Journal of the American Chemical Society, 2020 |
4134912 | CIF | C32 H28 Cl N3 O2 S | P 21 21 21 | 8.983; 12.8241; 24.4677 90; 90; 90 | 2818.7 | Whyte, Andrew; Torelli, Alexa; Mirabi, Bijan; Prieto, Liher; Rodríguez, José F; Lautens, Mark Cobalt-Catalyzed Enantioselective Hydroarylation of 1,6-Enynes. Journal of the American Chemical Society, 2020 |
4134913 | CIF | C17 H15 Cu N3 O5 | C 1 2/m 1 | 10.17; 18.68; 10.35 90; 101.22; 90 | 1928.7 | Ortín-Rubio, Borja; Ghasempour, Hosein; Guillerm, Vincent; Morsali, Ali; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-Clipping: An Approach to Deduce the Topology of Metal-Organic Frameworks Built with Zigzag Ligands. Journal of the American Chemical Society, 2020, 142, 9135-9140 |
4134914 | CIF | C10.5 H6 O4.5 Tb0.75 | P 1 21/n 1 | 17.29; 17.43; 24.11 90; 91.22; 90 | 7264 | Ortín-Rubio, Borja; Ghasempour, Hosein; Guillerm, Vincent; Morsali, Ali; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-Clipping: An Approach to Deduce the Topology of Metal-Organic Frameworks Built with Zigzag Ligands. Journal of the American Chemical Society, 2020, 142, 9135-9140 |
4134915 | CIF | C17 H17 Br Cl N3 O | P 21 21 21 | 6.9388; 15.0508; 32.586 90; 90; 90 | 3403.1 | Strassfeld, Daniel A.; Wickens, Zachary K.; Picazo, Elias; Jacobsen, Eric N. Highly Enantioselective, Hydrogen-Bond-Donor Catalyzed Additions to Oxetanes. Journal of the American Chemical Society, 2020, 142, 9175-9180 |
4134916 | CIF | C16 H21 Br Cl N3 O | P 1 21 1 | 7.0227; 15.3766; 15.8486 90; 99.589; 90 | 1687.5 | Strassfeld, Daniel A.; Wickens, Zachary K.; Picazo, Elias; Jacobsen, Eric N. Highly Enantioselective, Hydrogen-Bond-Donor Catalyzed Additions to Oxetanes. Journal of the American Chemical Society, 2020, 142, 9175-9180 |
4134917 | CIF | C20 H24 Br F3 O2 Si | P 1 | 9.7525; 10.9189; 11.7345 115.117; 96.8758; 106.146 | 1045.39 | Strassfeld, Daniel A.; Wickens, Zachary K.; Picazo, Elias; Jacobsen, Eric N. Highly Enantioselective, Hydrogen-Bond-Donor Catalyzed Additions to Oxetanes. Journal of the American Chemical Society, 2020, 142, 9175-9180 |
4134918 | CIF | C23 H28 Br Cl N3 O1.5 | C 1 2 1 | 31.216; 8.4388; 8.5385 90; 93.3905; 90 | 2245.3 | Strassfeld, Daniel A.; Wickens, Zachary K.; Picazo, Elias; Jacobsen, Eric N. Highly Enantioselective, Hydrogen-Bond-Donor Catalyzed Additions to Oxetanes. Journal of the American Chemical Society, 2020, 142, 9175-9180 |
4134919 | CIF | C55 H33 Co4.5 N4 O17.5 | P -4 n 2 | 21.8423; 21.8423; 39.3731 90; 90; 90 | 18784.4 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134920 | CIF | C54 H32 Co4.5 N5 O17.5 | P -4 n 2 | 21.8132; 21.8132; 39.0403 90; 90; 90 | 18576 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134921 | CIF | C52 H30 Co4.5 N7 O17.5 | P -4 n 2 | 21.7735; 21.7735; 39.2031 90; 90; 90 | 18585.6 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134922 | CIF | C58 H40 Co4.5 N4 O17.5 | P -4 n 2 | 21.8598; 21.8598; 39.3559 90; 90; 90 | 18806.3 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134923 | CIF | C55 H23.5 Co4.5 F4 N4 O17.5 | P -4 n 2 | 21.8545; 21.8545; 39.3775 90; 90; 90 | 18807.4 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134924 | CIF | C57 H33 Co4.5 N4 O17.5 | P -4 n 2 | 21.9069; 21.9069; 39.6456 90; 90; 90 | 19026.4 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134925 | CIF | C55 H31 Br0.5 Co4.5 N4 O17.5 | P -4 n 2 | 21.9081; 21.9081; 39.4769 90; 90; 90 | 18947.5 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134926 | CIF | C55 H34 N4 Ni4.5 O17.5 | P -4 n 2 | 21.6973; 21.6973; 39.0746 90; 90; 90 | 18395.3 | Liu, Lizhen; Yao, Zizhu; Ye, Yingxiang; Yang, Yike; Lin, Quanjie; Zhang, Zhangjing; O'Keeffe, Michael; Xiang, Shengchang Integrating pillared-layer strategy and pore-space partition method to construct multicomponent MOFs for C2H2/CO2 separation. Journal of the American Chemical Society, 2020 |
4134927 | CIF | C84 H60 O24 Pu3 | P 1 21/c 1 | 22.596; 15.3727; 25.369 90; 116.2; 90 | 7906.8 | Hastings, Ashley; Ray, Debmalya; Jeong, WooSeok; Gagliardi, Laura; Farha, Omar K.; Hixon, Amy E. Advancement of Actinide Metal-Organic Framework Chemistry via Synthesis of Pu-UiO-66. Journal of the American Chemical Society, 2020 |
4134928 | CIF | C21 H15 N3 | C m c 21 | 19.1389; 10.964; 7.0851 90; 90; 90 | 1486.73 | Torresi, Stefano; Famulari, Antonino; Marti-Rujas, Javier Kinetically controlled fast crystallization of M12L8 poly-[n]-catenanes using the 2,4,6-tris(4-pyridyl)benzene ligand and ZnCl2 in aromatic environment. Journal of the American Chemical Society, 2020 |
4134929 | CIF | C12 H7 Cl2 I N2 | P -1 | 7.0496; 7.3004; 12.5978 95.981; 91.257; 103.049 | 627.47 | Santos Hurtado, Carina; Bastien, Guillaume; Mašát, Milan; Stoček, Jakub Radek; Dracinsky, Martin; Rončević, Igor; Císařová, Ivana; Rogers, Charles T.; Kaleta, Jiří Regular 2-D Arrays of Surface-Mounted Molecular Switches: Switching Monitored by UV-vis and NMR Spectroscopy. Journal of the American Chemical Society, 2020 |
4134930 | CIF | C13 H15 F3 Hg O2 | P 1 21/c 1 | 6.9334; 20.6646; 9.3354 90; 91.617; 90 | 1337.01 | Santos Hurtado, Carina; Bastien, Guillaume; Mašát, Milan; Stoček, Jakub Radek; Dracinsky, Martin; Rončević, Igor; Císařová, Ivana; Rogers, Charles T.; Kaleta, Jiří Regular 2-D Arrays of Surface-Mounted Molecular Switches: Switching Monitored by UV-vis and NMR Spectroscopy. Journal of the American Chemical Society, 2020 |
4134931 | CIF | C14 H21 N O | I b a 2 | 16.9364; 18.8622; 16.6935 90; 90; 90 | 5332.9 | Santos Hurtado, Carina; Bastien, Guillaume; Mašát, Milan; Stoček, Jakub Radek; Dracinsky, Martin; Rončević, Igor; Císařová, Ivana; Rogers, Charles T.; Kaleta, Jiří Regular 2-D Arrays of Surface-Mounted Molecular Switches: Switching Monitored by UV-vis and NMR Spectroscopy. Journal of the American Chemical Society, 2020 |
4134932 | CIF | C12 H6 Cl4 N2 O2 | P 1 21/c 1 | 7.2162; 7.3078; 12.8297 90; 100.577; 90 | 665.07 | Santos Hurtado, Carina; Bastien, Guillaume; Mašát, Milan; Stoček, Jakub Radek; Dracinsky, Martin; Rončević, Igor; Císařová, Ivana; Rogers, Charles T.; Kaleta, Jiří Regular 2-D Arrays of Surface-Mounted Molecular Switches: Switching Monitored by UV-vis and NMR Spectroscopy. Journal of the American Chemical Society, 2020 |
4134933 | CIF | C20 H25 I N2 | P n m a | 19.8411; 15.7283; 5.9355 90; 90; 90 | 1852.27 | Santos Hurtado, Carina; Bastien, Guillaume; Mašát, Milan; Stoček, Jakub Radek; Dracinsky, Martin; Rončević, Igor; Císařová, Ivana; Rogers, Charles T.; Kaleta, Jiří Regular 2-D Arrays of Surface-Mounted Molecular Switches: Switching Monitored by UV-vis and NMR Spectroscopy. Journal of the American Chemical Society, 2020 |
4134934 | CIF | C24 H32 Cl6 N2 O2 | P -1 | 6.2193; 9.1548; 13.0735 108.089; 95.389; 100.572 | 686.43 | Santos Hurtado, Carina; Bastien, Guillaume; Mašát, Milan; Stoček, Jakub Radek; Dracinsky, Martin; Rončević, Igor; Císařová, Ivana; Rogers, Charles T.; Kaleta, Jiří Regular 2-D Arrays of Surface-Mounted Molecular Switches: Switching Monitored by UV-vis and NMR Spectroscopy. Journal of the American Chemical Society, 2020 |
4134935 | CIF | C13 H10 Cl N3 O3 | P b c a | 6.8955; 15.5594; 21.9079 90; 90; 90 | 2350.5 | Siddiqi, Zohaib; Wertjes, William C.; Sarlah, David Chemical Equivalent of Arene Monooxygenases: Dearomative Synthesis of Arene Oxides and Oxepines. Journal of the American Chemical Society, 2020, 142, 10125-10131 |
4134936 | CIF | C13.5 H9 Cl2 F3 N4 O3 | C 1 2/c 1 | 24.6871; 6.8296; 21.0493 90; 119.699; 90 | 3082.8 | Siddiqi, Zohaib; Wertjes, William C.; Sarlah, David Chemical Equivalent of Arene Monooxygenases: Dearomative Synthesis of Arene Oxides and Oxepines. Journal of the American Chemical Society, 2020, 142, 10125-10131 |
4134937 | CIF | C10 H8 O | P 1 21/c 1 | 7.8858; 6.0451; 8.4347 90; 114.305; 90 | 366.45 | Siddiqi, Zohaib; Wertjes, William C.; Sarlah, David Chemical Equivalent of Arene Monooxygenases: Dearomative Synthesis of Arene Oxides and Oxepines. Journal of the American Chemical Society, 2020, 142, 10125-10131 |
4134938 | CIF | C9 H9 N3 O3 | P 1 21/n 1 | 7.5594; 15.3365; 7.7117 90; 98.206; 90 | 884.9 | Siddiqi, Zohaib; Wertjes, William C.; Sarlah, David Chemical Equivalent of Arene Monooxygenases: Dearomative Synthesis of Arene Oxides and Oxepines. Journal of the American Chemical Society, 2020, 142, 10125-10131 |
4134939 | CIF | C76 H190 Gd2 K2 N8 O19 Si12 | P -1 | 15.658; 16.014; 24.347 78.975; 77.363; 82.456 | 5821.6 | Ryan, Austin J.; Balasubramani, Sreeganesh; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Formation of the End-on Bound Lanthanide Dinitrogen Complexes, [(R2N)3Ln-N=N-Ln(NR2)3]2-, from Divalent [(R2N)3Ln]1- Salts (R = SiMe3). Journal of the American Chemical Society, 2020 |
4134940 | CIF | C80 H200 K2 N12 O14 Si12 Tb2 | P -1 | 15.437; 16.218; 26.133 102.911; 96.0143; 104.664 | 6078.5 | Ryan, Austin J.; Balasubramani, Sreeganesh; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Formation of the End-on Bound Lanthanide Dinitrogen Complexes, [(R2N)3Ln-N=N-Ln(NR2)3]2-, from Divalent [(R2N)3Ln]1- Salts (R = SiMe3). Journal of the American Chemical Society, 2020 |
4134941 | CIF | C48 H120 Gd K N4 O6 Si8 | C 1 2/c 1 | 26.421; 30.378; 17.244 90; 90.8796; 90 | 13839 | Ryan, Austin J.; Balasubramani, Sreeganesh; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Formation of the End-on Bound Lanthanide Dinitrogen Complexes, [(R2N)3Ln-N=N-Ln(NR2)3]2-, from Divalent [(R2N)3Ln]1- Salts (R = SiMe3). Journal of the American Chemical Society, 2020 |
4134942 | CIF | C58 H146 Gd2 K N7 O7 Si10 | P 1 21 1 | 12.6104; 20.7558; 16.9683 90; 93.7131; 90 | 4431.9 | Ryan, Austin J.; Balasubramani, Sreeganesh; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Formation of the End-on Bound Lanthanide Dinitrogen Complexes, [(R2N)3Ln-N=N-Ln(NR2)3]2-, from Divalent [(R2N)3Ln]1- Salts (R = SiMe3). Journal of the American Chemical Society, 2020 |
4134943 | CIF | C84 H210 Gd2 K2 N12 O15 Si12 | P -1 | 15.237; 20.708; 21.341 75.118; 79.221; 76.734 | 6275 | Ryan, Austin J.; Balasubramani, Sreeganesh; Ziller, Joseph W.; Furche, Filipp; Evans, William J. Formation of the End-on Bound Lanthanide Dinitrogen Complexes, [(R2N)3Ln-N=N-Ln(NR2)3]2-, from Divalent [(R2N)3Ln]1- Salts (R = SiMe3). Journal of the American Chemical Society, 2020 |
4134944 | CIF | C23 H33 Cl N O Rh | P 1 21/n 1 | 13.1985; 7.991; 21.6147 90; 107.357; 90 | 2175.88 | Kim, Sangmin; Zhong, Hongyu; Park, Yoonsu; Loose, Florian; Chirik, Paul J. Catalytic Hydrogenation of a Manganese(V) Nitride to Ammonia. Journal of the American Chemical Society, 2020 |
4134945 | CIF | C19 H26 N Rh | P 1 21/c 1 | 12.8238; 7.5442; 17.2155 90; 102.9; 90 | 1623.48 | Kim, Sangmin; Zhong, Hongyu; Park, Yoonsu; Loose, Florian; Chirik, Paul J. Catalytic Hydrogenation of a Manganese(V) Nitride to Ammonia. Journal of the American Chemical Society, 2020 |
4134946 | CIF | C21 H28 N Rh | P 1 21/c 1 | 13.5272; 7.7023; 18.0407 90; 111.505; 90 | 1748.82 | Kim, Sangmin; Zhong, Hongyu; Park, Yoonsu; Loose, Florian; Chirik, Paul J. Catalytic Hydrogenation of a Manganese(V) Nitride to Ammonia. Journal of the American Chemical Society, 2020 |
4134947 | CIF | C38 H48 N2 Rh2 | P -1 | 8.6741; 9.5339; 10.0675 99.45; 109.73; 90.874 | 770.81 | Kim, Sangmin; Zhong, Hongyu; Park, Yoonsu; Loose, Florian; Chirik, Paul J. Catalytic Hydrogenation of a Manganese(V) Nitride to Ammonia. Journal of the American Chemical Society, 2020 |
4134948 | CIF | C53 H40 B F24 N2 Rh | P -1 | 12.8596; 12.8714; 16.7648 92.496; 96.418; 105.15 | 2654.03 | Kim, Sangmin; Zhong, Hongyu; Park, Yoonsu; Loose, Florian; Chirik, Paul J. Catalytic Hydrogenation of a Manganese(V) Nitride to Ammonia. Journal of the American Chemical Society, 2020 |
4134949 | CIF | C10 H16 Br N O2 | P 21 21 21 | 5.9297; 9.0915; 19.9795 90; 90; 90 | 1077.09 | Lin, You-Chen; Ribaucourt, Aubert; Moazami, Yasamin; Pierce, Joshua G. Concise Synthesis and Antimicrobial Evaluation of the Guanidinium Alkaloid Batzelladine D: Development of a Stereodivergent Strategy. Journal of the American Chemical Society, 2020, 142, 9850-9857 |
4134950 | CIF | C15 H29 N O2 Si | P 1 21/c 1 | 12.8389; 11.5893; 11.69 90; 90.6262; 90 | 1739.3 | Lin, You-Chen; Ribaucourt, Aubert; Moazami, Yasamin; Pierce, Joshua G. Concise Synthesis and Antimicrobial Evaluation of the Guanidinium Alkaloid Batzelladine D: Development of a Stereodivergent Strategy. Journal of the American Chemical Society, 2020, 142, 9850-9857 |
4134951 | CIF | C58 H38 I0 N0 O17 Zr3 | R 3 2 :H | 30.5594; 30.5594; 25.331 90; 90; 120 | 20487 | Jiang, Hong; Zhang, Wenqiang; Kang, Xing; Cao, Ziping; Chen, Xu; Liu, Yan; Cui, Yong Topology-Based Functionalization of Robust Chiral Zr-Based Metal-Organic Frameworks for Catalytic Enantioselective Hydrogenation. Journal of the American Chemical Society, 2020, 142, 9642-9652 |
4134952 | CIF | C42 H30 O17 Zr3 | R 3 2 :H | 30.654; 30.654; 24.9 90; 90; 120 | 20263 | Jiang, Hong; Zhang, Wenqiang; Kang, Xing; Cao, Ziping; Chen, Xu; Liu, Yan; Cui, Yong Topology-Based Functionalization of Robust Chiral Zr-Based Metal-Organic Frameworks for Catalytic Enantioselective Hydrogenation. Journal of the American Chemical Society, 2020, 142, 9642-9652 |
4134953 | CIF | C56 H30 O20 Zr3 | F m m m | 16.031; 36.971; 44.102 90; 90; 90 | 26138 | Jiang, Hong; Zhang, Wenqiang; Kang, Xing; Cao, Ziping; Chen, Xu; Liu, Yan; Cui, Yong Topology-Based Functionalization of Robust Chiral Zr-Based Metal-Organic Frameworks for Catalytic Enantioselective Hydrogenation. Journal of the American Chemical Society, 2020, 142, 9642-9652 |
4134954 | CIF | C40 H22 O20 Zr3 | F m m m | 18.1834; 33.744; 34.489 90; 90; 90 | 21162 | Jiang, Hong; Zhang, Wenqiang; Kang, Xing; Cao, Ziping; Chen, Xu; Liu, Yan; Cui, Yong Topology-Based Functionalization of Robust Chiral Zr-Based Metal-Organic Frameworks for Catalytic Enantioselective Hydrogenation. Journal of the American Chemical Society, 2020, 142, 9642-9652 |
4134955 | CIF | C58 H76 F6 N2 O13 | P -1 | 13.2744; 14.5586; 16.0139 74.834; 76.745; 81.664 | 2895.51 | Tian, Chong; Fielden, Stephen D. P.; Pérez-Saavedra, Borja; Vitorica-Yrezabal, Iñigo J; Leigh, David A. Single-Step Enantioselective Synthesis of Mechanically Planar Chiral [2]Rotaxanes Using a Chiral Leaving Group Strategy. Journal of the American Chemical Society, 2020, 142, 9803-9808 |
4134956 | CIF | C468 H396 Cu24 N12 O278 S24 Zr24 | P -3 m 1 | 31.6505; 31.6505; 28.6511 90; 90; 120 | 24856.1 | Gosselin, Eric J.; Decker, Gerald E.; Antonio, Alexandra M.; Lorzing, Gregory R.; Yap, Glenn P. A.; Bloch, Eric D. A Charged Coordination Cage-Based Porous Salt. Journal of the American Chemical Society, 2020, 142, 9594-9598 |
4134957 | CIF | C300 H348 Cu24 N36 O204 S24 | P 4/m n c | 35.9458; 35.9458; 28.285 90; 90; 90 | 36547.1 | Gosselin, Eric J.; Decker, Gerald E.; Antonio, Alexandra M.; Lorzing, Gregory R.; Yap, Glenn P. A.; Bloch, Eric D. A Charged Coordination Cage-Based Porous Salt. Journal of the American Chemical Society, 2020, 142, 9594-9598 |
4134958 | CIF | C124 H120 F12 O52 S4 Zr12 | P 1 21/c 1 | 35.291; 17.2056; 35.416 90; 117.236; 90 | 19120 | Gosselin, Eric J.; Decker, Gerald E.; Antonio, Alexandra M.; Lorzing, Gregory R.; Yap, Glenn P. A.; Bloch, Eric D. A Charged Coordination Cage-Based Porous Salt. Journal of the American Chemical Society, 2020, 142, 9594-9598 |
4134959 | CIF | C120 H120 Cl4 O40 Zr12 | F m -3 m | 36.587; 36.587; 36.587 90; 90; 90 | 48976 | Gosselin, Eric J.; Decker, Gerald E.; Antonio, Alexandra M.; Lorzing, Gregory R.; Yap, Glenn P. A.; Bloch, Eric D. A Charged Coordination Cage-Based Porous Salt. Journal of the American Chemical Society, 2020, 142, 9594-9598 |
4134960 | CIF | C400 H280 Cu24 O272 S24 Zr24 | F m -3 m | 43.599; 43.599; 43.599 90; 90; 90 | 82876 | Gosselin, Eric J.; Decker, Gerald E.; Antonio, Alexandra M.; Lorzing, Gregory R.; Yap, Glenn P. A.; Bloch, Eric D. A Charged Coordination Cage-Based Porous Salt. Journal of the American Chemical Society, 2020, 142, 9594-9598 |
4134961 | CIF | C22 H26 Cu F6 N4 O4 S2 Si | C m m m | 9.8817; 19.0615; 7.877 90; 90; 90 | 1483.71 | Wang, Jun; Zhang, Yan; Zhang, Peixin; Hu, Jianbo; Lin, Rui-Biao; Deng, Qiang; Zeng, Zheling; Xing, Huabin; Deng, Shuguang; Chen, Banglin Optimizing Pore Space for Flexible-Robust Metal-Organic Framework to Boost Trace Acetylene Removal. Journal of the American Chemical Society, 2020, 142, 9744-9751 |
4134962 | CIF | C20 H28 Cu F6 N4 O6 S2 Si | I b a m | 19.04; 9.9063; 15.835 90; 90; 90 | 2986.7 | Wang, Jun; Zhang, Yan; Zhang, Peixin; Hu, Jianbo; Lin, Rui-Biao; Deng, Qiang; Zeng, Zheling; Xing, Huabin; Deng, Shuguang; Chen, Banglin Optimizing Pore Space for Flexible-Robust Metal-Organic Framework to Boost Trace Acetylene Removal. Journal of the American Chemical Society, 2020, 142, 9744-9751 |
4134963 | CIF | C25 H24 O3 | P 1 21 1 | 8.9325; 10.847; 10.2984 90; 96.103; 90 | 992.17 | Wang, Huanan; Luo, Hongwen; Zhang, Zhan-Ming; Zheng, Wei-Feng; Yin, Yu; Qian, Hui; Zhang, Junliang; Ma, Shengming Pd-Catalyzed Enantioselective Syntheses of Trisubstituted Allenes via Coupling of Propargylic Benzoates with Organoboronic Acids. Journal of the American Chemical Society, 2020, 142, 9763-9771 |
4134964 | CIF | C65 H52 Cl2 N2 | P b c a | 19.7281; 15.4483; 30.7824 90; 90; 90 | 9381.4 | Nakamura, Kimihiro; Li, Qiang-Qiang; Krejčí, Ondřej; Foster, Adam S.; Sun, Kewei; Kawai, Shigeki; Ito, Shingo On-Surface Synthesis of a π-Extended Diaza[8]circulene. Journal of the American Chemical Society, 2020 |
4134965 | CIF | C40 H29 N | P -1 | 9.9506; 11.7661; 12.7401 105.8; 95.355; 105.473 | 1360.9 | Nakamura, Kimihiro; Li, Qiang-Qiang; Krejčí, Ondřej; Foster, Adam S.; Sun, Kewei; Kawai, Shigeki; Ito, Shingo On-Surface Synthesis of a π-Extended Diaza[8]circulene. Journal of the American Chemical Society, 2020 |
4134966 | CIF | C41 H35 Cl2 N | P -1 | 10.8065; 12.0091; 12.1365 76.3184; 82.9885; 84.3141 | 1514.86 | Nakamura, Kimihiro; Li, Qiang-Qiang; Krejčí, Ondřej; Foster, Adam S.; Sun, Kewei; Kawai, Shigeki; Ito, Shingo On-Surface Synthesis of a π-Extended Diaza[8]circulene. Journal of the American Chemical Society, 2020 |
4134967 | CIF | C67.51 H54.04 Cl N2 | P 1 21/c 1 | 15.8416; 20.2505; 15.2623 90; 100.626; 90 | 4812.2 | Nakamura, Kimihiro; Li, Qiang-Qiang; Krejčí, Ondřej; Foster, Adam S.; Sun, Kewei; Kawai, Shigeki; Ito, Shingo On-Surface Synthesis of a π-Extended Diaza[8]circulene. Journal of the American Chemical Society, 2020 |
4134968 | CIF | C33 H21 N3 S | I 1 2/a 1 | 18.7383; 11.5764; 22.1767 90; 93.211; 90 | 4803.06 | Usui, Ryosuke; Yamamoto, Katsuya; Okajima, Hajime; Mutoh, Katsuya; Sakamoto, Akira; Abe, Jiro; Kobayashi, Yoichi Photochromic Radical Complexes That Show Heterolytic Bond Dissociation. Journal of the American Chemical Society, 2020, 142, 10132-10142 |
4134969 | CIF | C33 H21 N3 O | P -1 | 6.8256; 12.4886; 14.5776 92.607; 93.237; 105.501 | 1193.14 | Usui, Ryosuke; Yamamoto, Katsuya; Okajima, Hajime; Mutoh, Katsuya; Sakamoto, Akira; Abe, Jiro; Kobayashi, Yoichi Photochromic Radical Complexes That Show Heterolytic Bond Dissociation. Journal of the American Chemical Society, 2020, 142, 10132-10142 |
4134970 | CIF | C242 H172 B F20 N10 O22 Pd2 | P -1 | 16.6921; 24.5705; 30.887 74.761; 85.289; 73.432 | 11714.6 | Kishida, Natsuki; Matsumoto, Kyosuke; Tanaka, Yuya; Akita, Munetaka; Sakurai, Hidehiro; Yoshizawa, Michito Anisotropic Contraction of a Polyaromatic Capsule and Its Cavity-Induced Compression Effect. Journal of the American Chemical Society, 2020, 142, 9599-9603 |
4134971 | CIF | C14 H12 Br F9 O2 S | P 1 21 1 | 5.7339; 46.854; 6.9754 90; 96.287; 90 | 1862.7 | Tu, Hai-Yong; Wang, Fang; Huo, Liping; Li, Yuanbo; Zhu, Shengqing; Zhao, Xian; Li, Huan; Qing, Feng-Ling; Chu, Lingling Enantioselective Three-Component Fluoroalkylarylation of Unactivated Olefins through Nickel-Catalyzed Cross-Electrophile Coupling. Journal of the American Chemical Society, 2020, 142, 9604-9611 |
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