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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
4131750	CIF	C32 H32 Cl4 N4 O8 Pb2	P 1 21/c 1	13.4033; 7.6867; 17.4828 90; 92.257; 90	1799.8	Sun, Cai; Xu, Gang; Jiang, Xiao-Ming; Wang, Guan-E; Guo, Pei-Yu; Wang, Ming-Sheng; Guo, Guo-Cong Design Strategy for Improving Optical and Electrical Properties and Stability of Lead-Halide Semiconductors. Journal of the American Chemical Society, 2018, 140, 2805-2811
4131751	CIF	C16 H18 Cl6 N2 O5 Pb3	P 21 21 21	4.3181; 22.051; 25.387 90; 90; 90	2417.3	Sun, Cai; Xu, Gang; Jiang, Xiao-Ming; Wang, Guan-E; Guo, Pei-Yu; Wang, Ming-Sheng; Guo, Guo-Cong Design Strategy for Improving Optical and Electrical Properties and Stability of Lead-Halide Semiconductors. Journal of the American Chemical Society, 2018, 140, 2805-2811
4131752	CIF	C16 H22 O9	P 21 21 21	9.9474; 10.9082; 15.4415 90; 90; 90	1675.53	Zhao, Jin-Xin; Yu, Yan-Yan; Wang, Sha-Sha; Huang, Su-Ling; Shen, Yu; Gao, Xin-Hua; Sheng, Li; Li, Jing-Ya; Leng, Ying; Li, Jia; Yue, Jian-Min Structural Elucidation and Bioinspired Total Syntheses of Ascorbylated Diterpenoid Hongkonoids A-D. Journal of the American Chemical Society, 2018, 140, 2485-2492
4131801	CIF	C68 H98 F6 N2 O Sb	P 1	9.311; 13.035; 14.124 98.484; 93.383; 96.918	1678	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131802	CIF	C54 H74 Br6.12 N2	P 1 2/c 1	15.4517; 9.0569; 20.8129 90; 105.163; 90	2811.2	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131803	CIF	C54 H74 N2	P 1 21/n 1	10.7485; 13.164; 17.4642 90; 104.046; 90	2397.18	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131804	CIF	C70 H94 N2	P 1	12.3025; 16.8211; 18.2404 90.61; 100.148; 99.052	3666.5	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131805	CIF	C64 H90 N2	P 1	9.242; 9.965; 15.328 94.187; 93.093; 95.429	1398.9	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131806	CIF	C54 H74 F12 N2 Sb2	P 1 21/c 1	15.2342; 9.4798; 23.3954 90; 106.598; 90	3237.9	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131807	CIF	C64 H90 N2	P 1	9.1599; 9.876; 15.304 95.2; 94.29; 92.92	1372.6	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131808	CIF	C70 H76 Cl4 N6 O4	P 1 21/n 1	9.8881; 21.821; 18.424 90; 92.142; 90	3972.5	Hansmann, Max M.; Melaimi, Mohand; Munz, Dominik; Bertrand, Guy Modular Approach to Kekulé Diradicaloids Derived from Cyclic (Alkyl)(amino)carbenes. Journal of the American Chemical Society, 2018, 140, 2546-2554
4131823	CIF	C342 H334 Cl16 Co8 N72 O29	R -3 :H	33.0793; 33.0793; 34.2247 90; 90; 120	32432.7	Cullen, William; Metherell, Alexander J.; Wragg, Ashley B.; Taylor, Christopher G. P.; Williams, Nicholas H.; Ward, Michael D. Catalysis in a Cationic Coordination Cage Using a Cavity-Bound Guest and Surface-Bound Anions: Inhibition, Activation, and Autocatalysis. Journal of the American Chemical Society, 2018, 140, 2821-2828
4131824	CIF	C174 H170 B0.5 Co4 F2 I7.5 N36 O14	C 1 2/c 1	32.939; 29.973; 40.4 90; 96.126; 90	39658	Cullen, William; Metherell, Alexander J.; Wragg, Ashley B.; Taylor, Christopher G. P.; Williams, Nicholas H.; Ward, Michael D. Catalysis in a Cationic Coordination Cage Using a Cavity-Bound Guest and Surface-Bound Anions: Inhibition, Activation, and Autocatalysis. Journal of the American Chemical Society, 2018, 140, 2821-2828
4131826	CIF	C17 H26 F6 Fe N4 O7 S2	P n a 21	17.9397; 10.0271; 13.5393 90; 90; 90	2435.5	Fan, Ruixi; Serrano-Plana, Joan; Oloo, Williamson N.; Draksharapu, Apparao; Delgado-Pinar, Estefanía; Company, Anna; Martin-Diaconescu, Vlad; Borrell, Margarida; Lloret-Fillol, Julio; García-España, Enrique; Guo, Yisong; Bominaar, Emile L.; Que, Jr, Lawrence; Costas, Miquel; Münck, Eckard Spectroscopic and DFT Characterization of a Highly Reactive Nonheme Fe<sup>V</sup>-Oxo Intermediate. Journal of the American Chemical Society, 2018, 140, 3916-3928
4131827	CIF	C38 H39 F3 N6 O8 S Zn2	P -1	10.0025; 12.9467; 16.8634 80.333; 76.467; 84.106	2088.44	White, Corey J.; Speelman, Amy L.; Kupper, Claudia; Demeshko, Serhiy; Meyer, Franc; Shanahan, James P.; Alp, E. Ercan; Hu, Michael; Zhao, Jiyong; Lehnert, Nicolai The Semireduced Mechanism for Nitric Oxide Reduction by Non-Heme Diiron Complexes: Modeling Flavodiiron Nitric Oxide Reductases. Journal of the American Chemical Society, 2018, 140, 2562-2574
4131828	CIF	C44 H51 F3 Fe2 N6 O9 S	P -1	9.95848; 13.0629; 18.7207 97.0851; 97.0567; 95.8092	2381.61	White, Corey J.; Speelman, Amy L.; Kupper, Claudia; Demeshko, Serhiy; Meyer, Franc; Shanahan, James P.; Alp, E. Ercan; Hu, Michael; Zhao, Jiyong; Lehnert, Nicolai The Semireduced Mechanism for Nitric Oxide Reduction by Non-Heme Diiron Complexes: Modeling Flavodiiron Nitric Oxide Reductases. Journal of the American Chemical Society, 2018, 140, 2562-2574
4131830	CIF	C63 H75.66 Nd O3.33	P 1 21/c 1	11.4694; 36.8012; 11.974 90; 106.846; 90	4837.2	Halter, Dominik P.; Palumbo, Chad T.; Ziller, Joseph W.; Gembicky, Milan; Rheingold, Arnold L.; Evans, William J.; Meyer, Karsten Electrocatalytic H<sub>2</sub>O Reduction with f-Elements: Mechanistic Insight and Overpotential Tuning in a Series of Lanthanide Complexes. Journal of the American Chemical Society, 2018, 140, 2587-2594
4131831	CIF	C81 H112 K N2 Nd O10	P 21 3	19.894; 19.894; 19.894 90; 90; 90	7873	Halter, Dominik P.; Palumbo, Chad T.; Ziller, Joseph W.; Gembicky, Milan; Rheingold, Arnold L.; Evans, William J.; Meyer, Karsten Electrocatalytic H<sub>2</sub>O Reduction with f-Elements: Mechanistic Insight and Overpotential Tuning in a Series of Lanthanide Complexes. Journal of the American Chemical Society, 2018, 140, 2587-2594
4131832	CIF	C91 H141 Hf3 N9 O25	P 4/m n c	18.8699; 18.8699; 33.0822 90; 90; 90	11779.7	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131833	CIF	C88 H72 Hf6 O32	P 4/m n c	19.5041; 19.5041; 32.072 90; 90; 90	12200.5	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131834	CIF	C88 H72 Hf6 O32	P 4/m n c	19.4378; 19.4378; 32.104 90; 90; 90	12129.8	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131835	CIF	C88 H72 Hf6 O32	P 4/m n c	19.3567; 19.3567; 32.036 90; 90; 90	12003	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131836	CIF	C88 H72 Hf6 O32	P 4/m n c	19.465; 19.465; 32.371 90; 90; 90	12265	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131837	CIF	C88 H72 Hf6 O32	P 4/m n c	19.343; 19.343; 32.3072 90; 90; 90	12087.8	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131838	CIF	C88 H72 Hf6 O32	P 4/m n c	19.3785; 19.3785; 32.523 90; 90; 90	12213.2	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131839	CIF	C88 H72 Hf6 O32	P 4/m n c	19.177; 19.177; 32.827 90; 90; 90	12072	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131840	CIF	C88 H72 Hf6 O32	P 4/m n c	19.1867; 19.1867; 32.543 90; 90; 90	11980	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131841	CIF	C88 H72 Hf6 O32	P 4/m n c	19.1631; 19.1631; 32.547 90; 90; 90	11952.1	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131842	CIF	C88 H72 Hf6 O32	P 4/m n c	19.082; 19.082; 32.674 90; 90; 90	11897.3	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131843	CIF	C88 H72 Hf6 O32	P 4/m n c	18.9396; 18.9396; 32.817 90; 90; 90	11771.7	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131844	CIF	C88 H72 Hf6 O32	P 4/m n c	19.079; 19.079; 32.905 90; 90; 90	11978	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131845	CIF	C88 H72 Hf6 O32	P 4/m n c	18.932; 18.932; 33.138 90; 90; 90	11877.3	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131846	CIF	C88 H72 Hf6 O32	P 4/m n c	18.8445; 18.8445; 32.896 90; 90; 90	11681.9	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131847	CIF	C88 H72 Hf6 O32	P 4/m n c	18.243; 18.243; 33.845 90; 90; 90	11264	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131848	CIF	C46 H34 O16 Zr3	P 4/m n c	19.0173; 19.0173; 32.8783 90; 90; 90	11890.7	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131849	CIF	C46 H34 O16 Zr3	P 4/m n c	19.4481; 19.4481; 32.575 90; 90; 90	12321	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131850	CIF	C46 H34 O16 Zr3	P 4/m n c	19.3348; 19.3348; 32.768 90; 90; 90	12250	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131851	CIF	C46 H34 O16 Zr3	P 4/m n c	19.188; 19.188; 32.964 90; 90; 90	12137	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131852	CIF	C46 H34 O16 Zr3	P 4/m n c	19.1326; 19.1326; 33.039 90; 90; 90	12094	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131853	CIF	C46 H34 O16 Zr3	P 4/m n c	18.9366; 18.9366; 32.864 90; 90; 90	11784.9	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131854	CIF	C46 H34 O16 Zr3	P 4/m n c	19.1146; 19.1146; 33.047 90; 90; 90	12074	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131855	CIF	C46 H34 O16 Zr3	P 4/m n c	19.0765; 19.0765; 33.061 90; 90; 90	12031	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131856	CIF	C46 H34 O16 Zr3	P 4/m n c	19.037; 19.037; 33.159 90; 90; 90	12017	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131857	CIF	C46 H34 O16 Zr3	P 4/m n c	19.0243; 19.0243; 33.174 90; 90; 90	12006	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131858	CIF	C46 H34 O16 Zr3	P 4/m n c	19.041; 19.041; 33.134 90; 90; 90	12013	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131859	CIF	C46 H34 O16 Zr3	P 4/m n c	19.0375; 19.0375; 33.133 90; 90; 90	12008	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131860	CIF	C46 H34 O16 Zr3	P 4/m n c	19.0042; 19.0042; 33.152 90; 90; 90	11973	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131861	CIF	C46 H34 O16 Zr3	P 4/m n c	18.779; 18.779; 33.087 90; 90; 90	11668	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131862	CIF	C46 H34 O16 Zr3	P 4/m n c	18.8806; 18.8806; 33.2413 90; 90; 90	11849.8	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131863	CIF	C46 H34 O16 Zr3	P 4/m n c	18.9111; 18.9111; 33.1966 90; 90; 90	11872.1	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131864	CIF	C46 H34 O16 Zr3	P 4/m n c	18.9092; 18.9092; 33.2222 90; 90; 90	11878.9	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131865	CIF	C46 H34 O16 Zr3	P 4/m n c	19.1734; 19.1734; 33.032 90; 90; 90	12143	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131866	CIF	C46 H34 O16 Zr3	P 4/m n c	19.28; 19.28; 32.89 90; 90; 90	12226	Yan, Yong; O'Connor, Alice E; Kanthasamy, Gopikkaa; Atkinson, George; Allan, David R.; Blake, Alexander J.; Schröder, Martin Unusual and Tunable Negative Linear Compressibility in the Metal-Organic Framework MFM-133(M) (M = Zr, Hf). Journal of the American Chemical Society, 2018, 140, 3952-3958
4131867	CIF	C29 H28 B F10 N	C 1 2/c 1	29.854; 10.5623; 23.234 90; 129.007; 90	5693	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131868	CIF	C30 H32 B F10 N	C 1 2/c 1	30.8901; 10.7574; 23.1166 90; 129.511; 90	5926.4	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131869	CIF	C30 H21 B F15 N	P 1 21/n 1	16.6005; 15.9553; 22.3028 90; 108.385; 90	5605.7	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131870	CIF	C32 H30 B F10 N	P 1 21/c 1	13.1325; 14.4932; 16.2201 90; 107.206; 90	2949.04	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131871	CIF	C40 H34 B F10 N	P -1	9.4038; 10.8415; 18.5386 96.508; 101.595; 105.266	1758.27	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131872	CIF	C42 H36 B F10 N O	P 1 21/c 1	21.1713; 9.5824; 20.2501 90; 117.812; 90	3633.61	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131873	CIF	C38 H36 B F10 N O	P 1 21/n 1	13.959; 14.6616; 17.3506 90; 102.255; 90	3470.08	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131874	CIF	C37 H36 B F10 N O	P -1	10.0116; 10.3869; 16.58 75.778; 79.29; 83.508	1638.07	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131875	CIF	C43 H42 B2 F15 N	P -1	11.3453; 12.0116; 16.1572 74.992; 72.799; 85.628	2031.6	Wang, Tongdao; Daniliuc, Constantin G.; Mück-Lichtenfeld, Christian; Kehr, Gerald; Erker, Gerhard Formation of Reactive π-Conjugated Frustrated N/B Pairs by Borane-Induced Propargyl Amine Rearrangement. Journal of the American Chemical Society, 2018, 140, 3635-3643
4131876	CIF	C46 H248 N23 Na9 O254 P4 Se4 W64	P 42/n :2	34.8679; 34.8679; 14.1884 90; 90; 90	17249.8	Zheng, Qi; Vilà-Nadal, Laia; Lang, Zhongling; Chen, Jia-Jia; Long, De-Liang; Mathieson, Jennifer S.; Poblet, Josep M.; Cronin, Leroy Self-Sorting of Heteroanions in the Assembly of Cross-Shaped Polyoxometalate Clusters. Journal of the American Chemical Society, 2018, 140, 2595-2601
4131877	CIF	C26 H168 N13 Na19 O254 P4 Te4 W64	P 1 21/m 1	15.2204; 37.8175; 29.2768 90; 103.518; 90	16384.8	Zheng, Qi; Vilà-Nadal, Laia; Lang, Zhongling; Chen, Jia-Jia; Long, De-Liang; Mathieson, Jennifer S.; Poblet, Josep M.; Cronin, Leroy Self-Sorting of Heteroanions in the Assembly of Cross-Shaped Polyoxometalate Clusters. Journal of the American Chemical Society, 2018, 140, 2595-2601
4131878	CIF	C30 H188 N15 Na17 O254 P8 W64	P 42/n :2	34.7924; 34.7924; 14.1405 90; 90; 90	17117.2	Zheng, Qi; Vilà-Nadal, Laia; Lang, Zhongling; Chen, Jia-Jia; Long, De-Liang; Mathieson, Jennifer S.; Poblet, Josep M.; Cronin, Leroy Self-Sorting of Heteroanions in the Assembly of Cross-Shaped Polyoxometalate Clusters. Journal of the American Chemical Society, 2018, 140, 2595-2601
4131879	CIF	C38 H276 As4 N19 Na17 O284 P4 W64	C 1 2/c 1	57.258; 15.0627; 77.278 90; 91.453; 90	66628	Zheng, Qi; Vilà-Nadal, Laia; Lang, Zhongling; Chen, Jia-Jia; Long, De-Liang; Mathieson, Jennifer S.; Poblet, Josep M.; Cronin, Leroy Self-Sorting of Heteroanions in the Assembly of Cross-Shaped Polyoxometalate Clusters. Journal of the American Chemical Society, 2018, 140, 2595-2601
4131880	CIF	C260 H378 Cl12 N56 O71.5 S14	P 1 2 1	18.981; 25.97; 21.424 90; 110.983; 90	9860	Teng, Peng; Niu, Zheng; She, Fengyu; Zhou, Mi; Sang, Peng; Gray, Geoffrey M.; Verma, Gaurav; Wojtas, Lukasz; van der Vaart, Arjan; Ma, Shengqian; Cai, Jianfeng Hydrogen-Bonding-Driven 3D Supramolecular Assembly of Peptidomimetic Zipper. Journal of the American Chemical Society, 2018, 140, 5661-5665
4131881	CIF	C123 H166 Cl7 N33 O30 S7	P 41 21 2	17.0979; 17.0979; 28.8128 90; 90; 90	8423.1	Teng, Peng; Niu, Zheng; She, Fengyu; Zhou, Mi; Sang, Peng; Gray, Geoffrey M.; Verma, Gaurav; Wojtas, Lukasz; van der Vaart, Arjan; Ma, Shengqian; Cai, Jianfeng Hydrogen-Bonding-Driven 3D Supramolecular Assembly of Peptidomimetic Zipper. Journal of the American Chemical Society, 2018, 140, 5661-5665
4131883	CIF	C252 H246 Ag26 P6 Pt S18	R -3 c :H	31.446; 31.446; 49.095 90; 90; 120	42043	He, Lizhong; Yuan, Jinyun; Xia, Nan; Liao, Lingwen; Liu, Xu; Gan, Zibao; Wang, Chengming; Yang, Jinlong; Wu, Zhikun Kernel Tuning and Nonuniform Influence on Optical and Electrochemical Gaps of Bimetal Nanoclusters. Journal of the American Chemical Society, 2018, 140, 3487-3490
4131884	CIF	C20 H30 O4	P 1 21 1	6.1913; 8.7775; 17.654 90; 96.821; 90	952.6	Tsai, Erica Y.; Liu, Richard Y.; Yang, Yang; Buchwald, Stephen L. A Regio- and Enantioselective CuH-Catalyzed Ketone Allylation with Terminal Allenes. Journal of the American Chemical Society, 2018, 140, 2007-2011
4131885	CIF	C36 H60 B6 O12	P 1 21/n 1	10.9587; 19.3545; 19.5983 90; 96.063; 90	4133.6	Yan, Lu; Meng, Yan; Haeffner, Fredrik; Leon, Robert M.; Crockett, Michael P.; Morken, James P. Carbohydrate/DBU Cocatalyzed Alkene Diboration: Mechanistic Insight Provides Enhanced Catalytic Efficiency and Substrate Scope. Journal of the American Chemical Society, 2018, 140, 3663-3673
4131886	CIF	C26 H23 Au F3 N O2	P n a 21	6.4976; 14.353; 24.8911 90; 90; 90	2321.35	Jin, Mingoo; Sumitani, Toshiki; Sato, Hiroyasu; Seki, Tomohiro; Ito, Hajime Mechanical-Stimulation-Triggered and Solvent-Vapor-Induced Reverse Single-Crystal-to-Single-Crystal Phase Transitions with Alterations of the Luminescence Color. Journal of the American Chemical Society, 2018, 140, 2875-2879
4131887	CIF	C26 H23 Au F3 N O2	P n a 21	6.5333; 14.3788; 24.7773 90; 90; 90	2327.6	Jin, Mingoo; Sumitani, Toshiki; Sato, Hiroyasu; Seki, Tomohiro; Ito, Hajime Mechanical-Stimulation-Triggered and Solvent-Vapor-Induced Reverse Single-Crystal-to-Single-Crystal Phase Transitions with Alterations of the Luminescence Color. Journal of the American Chemical Society, 2018, 140, 2875-2879
4131888	CIF	C24 H15 Au F3 N	P -1	8.7329; 9.2722; 11.9521 87.876; 81.512; 82.835	949.55	Jin, Mingoo; Sumitani, Toshiki; Sato, Hiroyasu; Seki, Tomohiro; Ito, Hajime Mechanical-Stimulation-Triggered and Solvent-Vapor-Induced Reverse Single-Crystal-to-Single-Crystal Phase Transitions with Alterations of the Luminescence Color. Journal of the American Chemical Society, 2018, 140, 2875-2879
4131889	CIF	C24 H15 Au F3 N	P -1	8.7264; 9.3243; 11.9764 87.967; 81.741; 82.7141	956.45	Jin, Mingoo; Sumitani, Toshiki; Sato, Hiroyasu; Seki, Tomohiro; Ito, Hajime Mechanical-Stimulation-Triggered and Solvent-Vapor-Induced Reverse Single-Crystal-to-Single-Crystal Phase Transitions with Alterations of the Luminescence Color. Journal of the American Chemical Society, 2018, 140, 2875-2879
4131890	CIF	C88 H142 N8 Ni2 O12	P 1 21 1	10.9543; 23.5971; 20.4838 90; 95.962; 90	5266.2	Lin, Xiaobin; Tang, Yu; Yang, Wei; Tan, Fei; Lin, Lili; Liu, Xiaohua; Feng, Xiaoming Chiral Nickel(II) Complex Catalyzed Enantioselective Doyle-Kirmse Reaction of α-Diazo Pyrazoleamides. Journal of the American Chemical Society, 2018, 140, 3299-3305
4131891	CIF	C8 H12 Br6 Cd N2	P n m a	12.783; 9.491; 17.67 90; 90; 90	2144	Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980
4131892	CIF	C4 H11 Br3 Cd Cl N	P 63/m m c	9.59; 9.59; 7.0146 90; 90; 120	558.69	Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980
4131893	CIF	C4 H11 Br3 Cd Cl N	P 63 m c	9.514; 9.514; 7.0191 90; 90; 120	550.22	Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980
4131894	CIF	C4 H11 Br3 Cd Cl N	P 63 m c	9.402; 9.402; 6.977 90; 90; 120	534.1	Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980
4131895	CIF	C16 H44 Br12 Cd2 N4	P 1 21/c 1	9.539; 17.604; 12.628 90; 92.695; 90	2118	Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980
4131896	CIF	C17 H9 N2 S2	P 1 21 1	7.3514; 8.0601; 21.3723 90; 94.7647; 90	1262	Beldjoudi, Yassine; Nascimento, Mitchell A.; Cho, Yong Joo; Yu, Hyeonghwa; Aziz, Hany; Tonouchi, Daiki; Eguchi, Keitaro; Matsushita, Michio M.; Awaga, Kunio; Osorio-Roman, Igor; Constantinides, Christos P.; Rawson, Jeremy M. Multifunctional Dithiadiazolyl Radicals: Fluorescence, Electroluminescence, and Photoconducting Behavior in Pyren-1'-yl-dithiadiazolyl. Journal of the American Chemical Society, 2018, 140, 6260-6270
4131897	CIF	C25 H28 Cu F3 N5 O6 S	P 1 21/n 1	7.3589; 19.2305; 19.2279 90; 93.221; 90	2716.74	Nijs, Thomas; Klein, Y. Maximilian; Mousavi, S. Fatemeh; Ahsan, Aisha; Nowakowska, Sylwia; Constable, Edwin C.; Housecroft, Catherine E.; Jung, Thomas A. The Different Faces of 4'-Pyrimidinyl-Functionalized 4,2':6',4''-Terpyridines: Metal-Organic Assemblies from Solution and on Au(111) and Cu(111) Surface Platforms. Journal of the American Chemical Society, 2018, 140, 2933-2939
4131898	CIF	C29 H29 Cu2 N5 O8	C 1 2/c 1	26.0869; 14.8694; 8.1356 90; 108.012; 90	3001.1	Nijs, Thomas; Klein, Y. Maximilian; Mousavi, S. Fatemeh; Ahsan, Aisha; Nowakowska, Sylwia; Constable, Edwin C.; Housecroft, Catherine E.; Jung, Thomas A. The Different Faces of 4'-Pyrimidinyl-Functionalized 4,2':6',4''-Terpyridines: Metal-Organic Assemblies from Solution and on Au(111) and Cu(111) Surface Platforms. Journal of the American Chemical Society, 2018, 140, 2933-2939
4131899	CIF	C17 H24 N2 O2	P 1 21 1	12.1758; 10.373; 14.1803 90; 112.952; 90	1649.18	Song, Jin; Zhang, Zi-Jing; Chen, Shu-Sen; Fan, Tao; Gong, Liu-Zhu Lewis Base/Copper Cooperatively Catalyzed Asymmetric α-Amination of Esters with Diaziridinone. Journal of the American Chemical Society, 2018, 140, 3177-3180
4131900	CIF	C188 H142 Eu4 F36 N12 O35	C 1 2 1	25.7797; 34.9694; 12.4506 90; 101.77; 90	10988.2	Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate. Journal of the American Chemical Society, 2018, 140, 3683-3689
4131901	CIF	C184 H128 F36 N12 O36 Yb4	C 1 2 1	33.7188; 32.0387; 22.5439 90; 102.13; 90	23810.6	Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate. Journal of the American Chemical Society, 2018, 140, 3683-3689
4131902	CIF	C184 H132 F36 N12 O34 Sm4	C 1 2 1	25.759; 35.1455; 12.463 90; 102.001; 90	11036.3	Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate. Journal of the American Chemical Society, 2018, 140, 3683-3689
4131903	CIF	C184 H132 Eu4 F36 N12 O34	C 1 2 1	25.7603; 35.035; 12.4435 90; 101.626; 90	11000	Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate. Journal of the American Chemical Society, 2018, 140, 3683-3689
4131904	CIF	C184 H128 F36 N12 O36 Yb4	C 1 2 1	33.9451; 31.7821; 22.4739 90; 102.275; 90	23691.6	Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate. Journal of the American Chemical Society, 2018, 140, 3683-3689
4131905	CIF	C187 H112 F36 N12 O44 Y4	C 1 2 1	33.7309; 32.1542; 22.2394 90; 101.685; 90	23620.8	Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate. Journal of the American Chemical Society, 2018, 140, 3683-3689
4131906	CIF	C250.03 H329.15 Cl16.96 N32 O38.38 Tb2	P -1	17.3755; 19.9053; 22.8678 64.5031; 88.255; 75.2468	6875.1	Morita, Takaumi; Damjanović, Marko; Katoh, Keiichi; Kitagawa, Yasutaka; Yasuda, Nobuhiro; Lan, Yanhua; Wernsdorfer, Wolfgang; Breedlove, Brian K.; Enders, Markus; Yamashita, Masahiro Comparison of the Magnetic Anisotropy and Spin Relaxation Phenomenon of Dinuclear Terbium(III) Phthalocyaninato Single-Molecule Magnets Using the Geometric Spin Arrangement. Journal of the American Chemical Society, 2018, 140, 2995-3007
4131907	CIF	C38.52 H35.81 Cl Fe N4 O7.38	P -1	10.0679; 12.6568; 15.6766 98.834; 106.858; 104.372	1796.31	Pangia, Thomas M.; Davies, Casey G.; Prendergast, Joshua R.; Gordon, Jesse B.; Siegler, Maxime A.; Jameson, Guy N. L.; Goldberg, David P. Observation of Radical Rebound in a Mononuclear Nonheme Iron Model Complex. Journal of the American Chemical Society, 2018, 140, 4191-4194
4131908	CIF	C39.38 H35.62 Cl Fe N5.38 O5.62	P 1 21/n 1	10.112; 22.0629; 16.4935 90; 104.954; 90	3555.08	Pangia, Thomas M.; Davies, Casey G.; Prendergast, Joshua R.; Gordon, Jesse B.; Siegler, Maxime A.; Jameson, Guy N. L.; Goldberg, David P. Observation of Radical Rebound in a Mononuclear Nonheme Iron Model Complex. Journal of the American Chemical Society, 2018, 140, 4191-4194
4131909	CIF	C39 H46 B F2 N3 O4	P 1 21/c 1	15.6805; 10.4626; 21.9659 90; 101.322; 90	3533.6	Collot, Mayeul; Fam, Tkhe Kyong; Ashokkumar, Pichandi; Faklaris, Orestis; Galli, Thierry; Danglot, Lydia; Klymchenko, Andrey S. Ultrabright and Fluorogenic Probes for Multicolor Imaging and Tracking of Lipid Droplets in Cells and Tissues. Journal of the American Chemical Society, 2018, 140, 5401-5411
4131910	CIF	C44 H4.6 O44.5 Zr6	C 1 2 1	20.747; 20.747; 14.67 90; 135; 90	4465	Albalad, Jorge; Xu, Heng; Gándara, Felipe; Haouas, Mohamed; Martineau-Corcos, Charlotte; Mas-Ballesté, Rubén; Barnett, Sarah A.; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Single-Crystal-to-Single-Crystal Postsynthetic Modification of a Metal-Organic Framework via Ozonolysis. Journal of the American Chemical Society, 2018, 140, 2028-2031
4131911	CIF	C49 H63 F24 N10 O7 P4 S5	P -1	14.493; 14.921; 17.665 100.095; 107.797; 98.626	3495	Wu, Ren-Tsung; Chi, Xiaodong; Hirao, Takehiro; Lynch, Vincent M.; Sessler, Jonathan L. Supramolecular Properties of a Monocarboxylic Acid-Functionalized "Texas-Sized" Molecular Box. Journal of the American Chemical Society, 2018, 140, 6823-6831
4131912	CIF	C43 H33 F18 N10 O4 P3 S2	P n m a	27.323; 31.177; 11.9178 90; 90; 90	10152	Wu, Ren-Tsung; Chi, Xiaodong; Hirao, Takehiro; Lynch, Vincent M.; Sessler, Jonathan L. Supramolecular Properties of a Monocarboxylic Acid-Functionalized "Texas-Sized" Molecular Box. Journal of the American Chemical Society, 2018, 140, 6823-6831
4131913	CIF	C26 H54 Ca2 I2 O6	P n a 21	19.866; 7.7093; 22.122 90; 90; 90	3388	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131914	CIF	C29.92 H64.75 Ca3 I1.08 O5	P 1 21/n 1	12.223; 17.635; 18.194 90; 93.383; 90	3915	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131915	CIF	C55 H88 B2 Ca N12	P -1	11.864; 12.059; 20.598 96.07; 95.89; 99.03	2873	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131916	CIF	C62 H110 B2 Ca2 N12 O3	P -1	11.6278; 15.9075; 19.5703 79.691; 80.461; 80.899	3481.3	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131917	CIF	C30 H53 B Ca N6 O	P 1 21/n 1	22.2039; 12.3521; 27.028 90; 101.36; 90	7267.6	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131918	CIF	C55 H108 Ca2 O6	P 1 21 1	12.3787; 19.6198; 12.7078 90; 111.5; 90	2871.6	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131919	CIF	C52.5 H105.5 Ca2 O5	P 1 21/n 1	13.0501; 19.3522; 22.1731 90; 92.027; 90	5596.3	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131920	CIF	C8 H24 Ca Ga2	C m c 21	7.388; 19.802; 9.63 90; 90; 90	1408.8	Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383
4131921	CIF	C27 H19 N2 P	C 1 2 1	15.317; 8.924; 16.982 90; 111.376; 90	2161.6	Hashimoto, Naoki; Umano, Rika; Ochi, Yusuke; Shimahara, Kiyoka; Nakamura, Jun; Mori, Shigeki; Ohta, Hidetoshi; Watanabe, Yutaka; Hayashi, Minoru Synthesis and Photophysical Properties of λ<sup>5</sup>-Phosphinines as a Tunable Fluorophore. Journal of the American Chemical Society, 2018, 140, 2046-2049
4131922	CIF	C19 H13 N2 P	C 1 2 1	15.138; 9.219; 28.143 90; 100.742; 90	3859	Hashimoto, Naoki; Umano, Rika; Ochi, Yusuke; Shimahara, Kiyoka; Nakamura, Jun; Mori, Shigeki; Ohta, Hidetoshi; Watanabe, Yutaka; Hayashi, Minoru Synthesis and Photophysical Properties of λ<sup>5</sup>-Phosphinines as a Tunable Fluorophore. Journal of the American Chemical Society, 2018, 140, 2046-2049
4131923	CIF	C21 H21 N O5	P -1	6.4957; 9.6763; 14.8709 97.388; 95.474; 100.439	904.82	Wang, Gang-Wei; Bower, John F. Modular Access to Azepines by Directed Carbonylative C-C Bond Activation of Aminocyclopropanes. Journal of the American Chemical Society, 2018, 140, 2743-2747
4131924	CIF	C276 H288 Cl6 N6 Ni18 O36 S30	P -1	18.052; 23.231; 26.344 70.236; 77.675; 86.573	10156	Wang, Shentang; Gao, Xiaohui; Hang, Xinxin; Zhu, Xiaofei; Han, Haitao; Li, Xiaokun; Liao, Wuping; Chen, Wei Calixarene-Based {Ni<sub>18</sub>} Coordination Wheel: Highly Efficient Electrocatalyst for the Glucose Oxidation and Template for the Homogenous Cluster Fabrication. Journal of the American Chemical Society, 2018, 140, 6271-6277
4131925	CIF	C10 H20 Cl2 Cu N16 O8	C 1 2/c 1	15.0672; 9.0113; 17.5426 90; 97.696; 90	2360.39	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131926	CIF	C8 H20 Cl2 Cu N20 O6	P 1 21/n 1	13.1028; 10.7288; 16.2265 90; 95.036; 90	2272.3	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131927	CIF	C8 H16 Cl2 Cu N16 O6	P 1 21/n 1	7.6403; 10.0072; 13.623 90; 90.4; 90	1041.56	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131928	CIF	C10 H16 Cl2 Cu N16 O6	C 1 2/c 1	14.6638; 8.9883; 16.3538 90; 90.324; 90	2155.44	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131929	CIF	C10 H16 Cl2 Cu N16 O6	P -1	6.7837; 8.182; 10.1959 108.068; 101.188; 90.137	526.6	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131930	CIF	C6 H12 Cl2 Cu N12 O6	C 1 2/m 1	13.5622; 15.5713; 7.7338 90; 91.559; 90	1632.6	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131931	CIF	C12 H20 Cl2 Cu N16 O6	P 1 21/n 1	10.7286; 6.8178; 15.5263 90; 100.469; 90	1116.77	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131932	CIF	C4 H14 Cl2 Cu N10 O8	P -1	6.5617; 7.526; 9.0097 111.762; 98.711; 104.197	385.81	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131933	CIF	C8 H16 Cl2 Cu N16 O6	P -1	7.2932; 10.9456; 12.417 93.041; 96.845; 91.156	982.43	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131934	CIF	C15 H24 Cl2 Cu N24 O6	P -3 c 1	10.9642; 10.9642; 14.3772 90; 90; 120	1496.78	Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion. Journal of the American Chemical Society, 2018, 140, 3206-3209
4131935	CIF	C57 H72 Ce N9	R -3 c :H	18.626; 18.626; 55.983 90; 90; 120	16820	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131936	CIF	C36 H72 Ce N9	P -1	10.0315; 11.8803; 17.842 82.423; 85.788; 89.638	2102.09	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131937	CIF	C39 H84 Ce N9	P 1 21/c 1	13.2861; 19.9413; 18.6655 90; 109.946; 90	4648.6	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131938	CIF	C48 H96 Ce N9	C 1 2/c 1	24.249; 13.9439; 18.4167 90; 115.072; 90	5640.4	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131939	CIF	C42 H96 Ce N9 Si3	P 1 21/c 1	12.8493; 10.7028; 39.41 90; 93.013; 90	5412.3	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131940	CIF	C67 H116 Ce I2 Li N6 O2	P 1 21/n 1	20.8203; 15.8035; 20.8531 90; 90.547; 90	6861.1	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131941	CIF	C81 H132 Ce N9	R 3 c :H	44.203; 44.203; 26.08 90; 90; 120	44131	Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J. Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores. Journal of the American Chemical Society, 2018, 140, 4588-4595
4131942	CIF	C20 H22 Cl F3 N2 O	P 21 21 21	8.998; 11.5663; 17.6674 90; 90; 90	1838.71	Ye, Ke-Yin; Pombar, Gisselle; Fu, Niankai; Sauer, Gregory S.; Keresztes, Ivan; Lin, Song Anodically Coupled Electrolysis for the Heterodifunctionalization of Alkenes. Journal of the American Chemical Society, 2018, 140, 2438-2441
4131943	CIF	C20 H20 N2 O4	P 21 21 21	9.64769; 11.43518; 15.03401 90; 90; 90	1658.6	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131944	CIF	C23 H26 N2 O7	P -1	8.161; 10.276; 13.734 102.45; 97.861; 112.29	1009.7	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131945	CIF	C24 H26 N2 O7	P -1	6.8694; 10.0331; 15.3665 81.1902; 88.6152; 89.8076	1046.28	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131946	CIF	C20 H16 Br3 N4 Ru	P -1	7.2777; 8.2938; 9.0157 77.686; 83.158; 69.733	498.14	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131947	CIF	C22 H24 N2 O5	P 1 21/n 1	8.7314; 18.821; 11.6512 90; 102.367; 90	1870.26	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131948	CIF	C49.5 H55 N4 O12.5 S2	C 1 2 1	45.773; 7.9396; 13.4558 90; 97.262; 90	4850.87	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131949	CIF	C23 H26 N2 O6	P 1 21/n 1	12.0865; 13.2673; 13.6282 90; 115.234; 90	1976.81	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131950	CIF	C24 H30 N2 O6	P 1 21/n 1	10.9813; 8.0063; 24.4059 90; 98.934; 90	2119.72	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131951	CIF	C21 H20 N2 O5	P -1	7.2219; 9.354; 13.497 84.894; 85.225; 68.613	844.3	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131952	CIF	C24 H28 N2 O6	P -1	7.9625; 10.842; 12.972 74.54; 74.559; 87.974	1039.6	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131953	CIF	C24 H26 N2 O7	A e a 2	13.6713; 37.374; 8.2094 90; 90; 90	4194.6	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131954	CIF	C21 H20.18 N2 O5.09	P 21 21 21	7.84898; 14.47011; 15.52093 90; 90; 90	1762.8	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131955	CIF	C22 H24 Cl2 N2 O4	P -1	7.3663; 11.4058; 12.1822 85.2854; 81.2598; 85.079	1005.43	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131956	CIF	C23 H27 Cl3 N2 O6	P 1 21/n 1	11.221; 7.2383; 29.137 90; 96.855; 90	2349.6	Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M. Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship. Journal of the American Chemical Society, 2018, 140, 5393-5400
4131957	CIF	C170 H142 Cl4 N8 O18.66667	C 1 2 1	47.826; 21.1891; 27.0097 90; 94.628; 90	27282	Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772
4131958	CIF	C52 H40 O4	P 21 21 21	6.5343; 17.9861; 32.523 90; 90; 90	3822.3	Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772
4131959	CIF	C30 H16	P 21 21 21	5.146; 18.162; 20.254 90; 90; 90	1892.97	Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772
4131960	CIF	C171.33333 H144.66667 Cl6.66667 N8 O24	C 1 2 1	47.641; 21.1704; 27.0403 90; 94.904; 90	27172	Malik, Abaid Ullah; Gan, Fuwei; Shen, Chengshuo; Yu, Na; Wang, Ruibin; Crassous, Jeanne; Shu, Mouhai; Qiu, Huibin Chiral Organic Cages with a Triple-Stranded Helical Structure Derived from Helicene. Journal of the American Chemical Society, 2018, 140, 2769-2772
4131961	CIF	C12 H13 N3 O6 S	P 1 21/c 1	7.4332; 8.2644; 22.734 90; 96.542; 90	1387.5	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131962	CIF	C27 H30 N4 O11 S2	P -1	10.817; 11.154; 13.163 92.607; 112.415; 92.17	1464	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131963	CIF	C16 H15 N5 O5 S	P -1	7.0021; 9.7512; 13.0986 70.369; 88.781; 82.494	834.91	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131964	CIF	C12 H13 N3 O5 S	P 1 21/n 1	7.3537; 14.8454; 12.3215 90; 94.038; 90	1341.78	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131965	CIF	C18 H21 N5 O8 S2	P b c a	10.4132; 13.5716; 29.547 90; 90; 90	4175.69	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131966	CIF	C12 H14 N4 O8 S	P 1 21/c 1	7.017; 17.287; 12.578 90; 94.34; 90	1521.4	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131967	CIF	C18 H23 N5 O6 S2	I 1 2/a 1	11.6451; 8.0014; 22.6883 90; 91.37; 90	2113.4	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131968	CIF	C16 H26 N5 O8 S2	P -1	9.9888; 10.2796; 12.3288 68.939; 79.698; 69.115	1101.9	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131969	CIF	C16 H17 N7 O10 S2	P -1	7.7154; 11.5739; 12.5866 68.866; 83.563; 82.184	1036.19	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131970	CIF	C58 H64 N4 O13 S4	C 1 2/c 1	26.738; 7.081; 30.146 90; 90.53; 90	5707.4	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131971	CIF	C26 H26 N4 O12 S2	P -1	6.0303; 9.721; 12.4638 98.012; 94.549; 97.848	713.12	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131972	CIF	C20 H23 N3 O5 S	P 1 21/n 1	14.5751; 7.3814; 18.0511 90; 92.517; 90	1940.15	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131973	CIF	C26 H28 N2 O8 S2	P 1 21/n 1	5.7205; 20.45; 11.7153 90; 102.871; 90	1336.1	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131974	CIF	C24 H22 N4 O12 S2	P 1 21/n 1	12.9855; 7.3929; 13.8095 90; 100.742; 90	1302.49	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131975	CIF	C24 H26 N2 O9 S2	P -1	7.7042; 12.1758; 13.3268 84.238; 89.648; 83.067	1234.68	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131976	CIF	C24 H26 N2 O11 S2	P 1 21/c 1	12.9248; 7.3758; 26.709 90; 91.338; 90	2545.49	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131977	CIF	C28 H32 N2 O8 S2	C 1 2/c 1	21.8681; 5.6881; 23.3203 90; 101.161; 90	2845.9	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131978	CIF	C10 H12 N O4 S	P 1 21/c 1	8.124; 5.7011; 23.0661 90; 93.074; 90	1066.79	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131979	CIF	C10 H12 N O3 S	P 1 21/n 1	8.8901; 7.0512; 16.8721 90; 95.229; 90	1053.24	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131980	CIF	C10 H11 N2 O5 S	I 1 2/a 1	17.884; 6.712; 19.8456 90; 112.723; 90	2197.3	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131981	CIF	C28 H32 N2 O8 S2	C 1 2/c 1	27.044; 6.9584; 15.834 90; 118.16; 90	2627	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131982	CIF	C28 H32 N2 O6 S2	C 1 2/c 1	15.3959; 7.2509; 23.9608 90; 92.573; 90	2672.1	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131983	CIF	C30 H36 N2 O6 S2	P 1 21/n 1	19.9706; 7.039; 21.9707 90; 113.547; 90	2831.3	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131984	CIF	C28 H32 N4 O11 S2	P -1	10.6823; 11.4435; 13.2985 87.212; 70.525; 81.733	1516.7	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131985	CIF	C10 H11 Cl N O3 S	P 1 21/n 1	5.9637; 15.7025; 11.9733 90; 95.124; 90	1116.76	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131986	CIF	C9 H9 Cl N O4 S	P 1 21/c 1	8.1551; 5.7169; 22.5197 90; 94.011; 90	1047.34	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131987	CIF	C21 H21 Cl3 N3 O6 S2	P -1	10.1766; 10.7552; 12.5205 95.045; 109.245; 102.571	1243.69	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131988	CIF	C12 H11 Cl2 N3 O5 S	C 1 2/c 1	22.1231; 7.2432; 19.3126 90; 100.197; 90	3045.81	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131989	CIF	C13 H14 Cl N3 O5 S	P 1 21/c 1	7.2666; 14.9473; 15.224 90; 99.744; 90	1629.7	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131990	CIF	C12 H12 Cl N3 O6 S	P -1	7.4388; 8.519; 12.2969 90.408; 107.029; 94.769	742.12	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131991	CIF	C12 H12 Cl N3 O5 S	P c c n	21.7735; 14.1989; 9.4343 90; 90; 90	2916.71	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131992	CIF	C12 H11 Cl N4 O7 S	P -1	7.3874; 9.6593; 11.6166 74.226; 82.828; 72.285	759.08	Karak, Suvendu; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul Porosity Prediction through Hydrogen Bonding in Covalent Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 5138-5145
4131993	CIF	C54 H45 B F15 Fe N4 O	P -1	13.052; 15.755; 24.071 90.625; 91.925; 91.633	4944.7	Abucayon, Erwin G.; Khade, Rahul L.; Powell, Douglas R.; Zhang, Yong; Richter-Addo, George B Lewis Acid Activation of the Ferrous Heme-NO Fragment toward the N-N Coupling Reaction with NO To Generate N<sub>2</sub>O. Journal of the American Chemical Society, 2018, 140, 4204-4207
4131994	CIF	C12 H7 F3 N2	P 1 21/n 1	8.722; 14.03; 8.981 90; 111.139; 90	1025	Kobayashi, Kensuke; Horiuchi, Sachio; Ishibashi, Shoji; Murakami, Youichi; Kumai, Reiji Field-Induced Antipolar-Polar Structural Transformation and Giant Electrostriction in Organic Crystal. Journal of the American Chemical Society, 2018, 140, 3842-3845
4131995	CIF	C12 H7 F3 N2	A e a 2	14.047; 14.609; 10.026 90; 90; 90	2057.5	Kobayashi, Kensuke; Horiuchi, Sachio; Ishibashi, Shoji; Murakami, Youichi; Kumai, Reiji Field-Induced Antipolar-Polar Structural Transformation and Giant Electrostriction in Organic Crystal. Journal of the American Chemical Society, 2018, 140, 3842-3845
4131996	CIF	C10 H6 N S2	P -1	9.431; 9.479; 10.55 77.104; 86.491; 75.335	889.4	Bates, Demetris; Robertson, Craig M.; Leitch, Alicea A.; Dube, Paul A.; Oakley, Richard T. Magnetic Bistability in Naphtho-1,3,2-dithiazolyl: Solid State Interconversion of a Thiazyl π-Radical and Its N-N σ-Bonded Dimer. Journal of the American Chemical Society, 2018, 140, 3846-3849
4131997	CIF	C10 H12 Cu F6 N10 O Si	C 1 2/c 1	16.3598; 11.2335; 21.3117 90; 91.676; 90	3914.9	Bao, Zongbi; Xie, Danyan; Chang, Ganggang; Wu, Hui; Li, Liangying; Zhou, Wei; Wang, Hailong; Zhang, Zhiguo; Xing, Huabin; Yang, Qiwei; Zaworotko, Michael J.; Ren, Qilong; Chen, Banglin Fine Tuning and Specific Binding Sites with a Porous Hydrogen-Bonded Metal-Complex Framework for Gas Selective Separations. Journal of the American Chemical Society, 2018, 140, 4596-4603
4131998	CIF	C20 H24 Cu2 F12 N20 O2 Si2	C m c m	16.9982; 11.0287; 21.318 90; 90; 90	3996.4	Bao, Zongbi; Xie, Danyan; Chang, Ganggang; Wu, Hui; Li, Liangying; Zhou, Wei; Wang, Hailong; Zhang, Zhiguo; Xing, Huabin; Yang, Qiwei; Zaworotko, Michael J.; Ren, Qilong; Chen, Banglin Fine Tuning and Specific Binding Sites with a Porous Hydrogen-Bonded Metal-Complex Framework for Gas Selective Separations. Journal of the American Chemical Society, 2018, 140, 4596-4603
4131999	CIF	C32 H38 O2	P 1 21 1	13.24067; 7.76255; 24.8383 90; 91.3423; 90	2552.21	Hao, Wei; Harenberg, Johannes H.; Wu, Xiangyu; MacMillan, Samantha N.; Lin, Song Diastereo- and Enantioselective Formal [3 + 2] Cycloaddition of Cyclopropyl Ketones and Alkenes via Ti-Catalyzed Radical Redox Relay. Journal of the American Chemical Society, 2018, 140, 3514-3517
4132000	CIF	C20 H22 O	P 1 21 1	5.8408; 16.7324; 7.8935 90; 92.485; 90	770.71	Hao, Wei; Harenberg, Johannes H.; Wu, Xiangyu; MacMillan, Samantha N.; Lin, Song Diastereo- and Enantioselective Formal [3 + 2] Cycloaddition of Cyclopropyl Ketones and Alkenes via Ti-Catalyzed Radical Redox Relay. Journal of the American Chemical Society, 2018, 140, 3514-3517
4132001	CIF	C244 H256 N16 O8 Si4 Ti4	P -1	12.843; 20.558; 23.39 72.79; 77.72; 72.76	5580.91	Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L. Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons. Journal of the American Chemical Society, 2018, 140, 4973-4976
4132002	CIF	C52 H71 N4 O2 Si Ti	P 1 21/n 1	12.8621; 21.1899; 18.839 90; 104.842; 90	4963.2	Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L. Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons. Journal of the American Chemical Society, 2018, 140, 4973-4976
4132003	CIF	C46 H66 N4 O2 Si Ti	P 1 21/n 1	12.4428; 27.623; 13.2015 90; 92.073; 90	4534.5	Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L. Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons. Journal of the American Chemical Society, 2018, 140, 4973-4976
4132004	CIF	C19 H22 O6	P 1 n 1	4.7391; 12.8346; 14.2014 90; 96.2262; 90	858.7	Tao, Daniel J.; Slutskyy, Yuriy; Muuronen, Mikko; Le, Alexander; Kohler, Philipp; Overman, Larry E. Total Synthesis of (-)-Chromodorolide B By a Computationally-Guided Radical Addition/Cyclization/Fragmentation Cascade. Journal of the American Chemical Society, 2018, 140, 3091-3102
4132005	CIF	C32 H25 Cl2 F N O3 P Pd S	P 1 21/c 1	12.7112; 14.8397; 15.9385 90; 98.6077; 90	2972.6	Chen, Xiao-Yang; Sorensen, Erik J. Pd-Catalyzed, ortho C-H Methylation and Fluorination of Benzaldehydes Using Orthanilic Acids as Transient Directing Groups. Journal of the American Chemical Society, 2018, 140, 2789-2792
4132006	CIF	C70 H81.6 Cl4 Fe N10 O15.8	P 1 21/c 1	20.3631; 28.602; 12.6388 90; 94.0855; 90	7342.5	Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433
4132007	CIF	C70 H81.6 Cl4 Fe N10 O15.8	P 1 21/c 1	20.1522; 28.5668; 12.54945 90; 94.1381; 90	7205.68	Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433
4132008	CIF	C70.78 H83.12 Cl4 N10 O15.78 Zn	P 1 21/c 1	20.4333; 28.681; 12.643 90; 94.243; 90	7389.1	Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433
4132009	CIF	C70 H81.6 Cl4 Fe N10 O15.8	P 1 21/c 1	20.566; 28.5805; 12.7724 90; 94.822; 90	7480.9	Yuan, Juan; Wu, Shu-Qi; Liu, Mei-Jiao; Sato, Osamu; Kou, Hui-Zhong Rhodamine 6G-Labeled Pyridyl Aroylhydrazone Fe(II) Complex Exhibiting Synergetic Spin Crossover and Fluorescence. Journal of the American Chemical Society, 2018, 140, 9426-9433
4132010	CIF	C13 H19 Br F6 O2	P 1 21/n 1	7.071; 21.45; 10.258 90; 95.885; 90	1547.7	Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353
4132011	CIF	C17 H21 I N2 O7	P 1 21/c 1	18.1478; 6.6216; 17.9704 90; 114.684; 90	1962.14	Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353
4132012	CIF	C10 H13 F12 N O3	P -1	9.5076; 9.6913; 9.753 103.771; 91.642; 113.628	791.84	Arnold, Andreas M.; Pöthig, Alexander; Drees, Markus; Gulder, Tanja NXS, Morpholine, and HFIP: The Ideal Combination for Biomimetic Haliranium-Induced Polyene Cyclizations. Journal of the American Chemical Society, 2018, 140, 4344-4353
4132013	CIF	C32 H34 N6 O5	P 1 21/n 1	11.8321; 13.4953; 19.2839 90; 105.58; 90	2966.1	An, Peng; Lewandowski, Tracey M.; Erbay, Tuğçe G; Liu, Peng; Lin, Qing Sterically Shielded, Stabilized Nitrile Imine for Rapid Bioorthogonal Protein Labeling in Live Cells. Journal of the American Chemical Society, 2018, 140, 4860-4868
4132014	CIF	C22 H18 N6 O	P 1 21/n 1	18.7948; 5.1334; 21.0251 90; 116.317; 90	1818.28	An, Peng; Lewandowski, Tracey M.; Erbay, Tuğçe G; Liu, Peng; Lin, Qing Sterically Shielded, Stabilized Nitrile Imine for Rapid Bioorthogonal Protein Labeling in Live Cells. Journal of the American Chemical Society, 2018, 140, 4860-4868
4132015	CIF	C2 H11 I4 N5 Pb	C 1 2/m 1	26.948; 12.8189; 14.408 90; 109.941; 90	4678.8	Nazarenko, Olga; Kotyrba, Martin R.; Yakunin, Sergii; Aebli, Marcel; Rainò, Gabriele; Benin, Bogdan M.; Wörle, Michael; Kovalenko, Maksym V. Guanidinium-Formamidinium Lead Iodide: A Layered Perovskite-Related Compound with Red Luminescence at Room Temperature. Journal of the American Chemical Society, 2018, 140, 3850-3853
4132016	CIF	C44 H60 Fe N2	P 42	13.4351; 13.4351; 10.3042 90; 90; 90	1859.93	Schmidt, Valerie A.; Kennedy, C. Rose; Bezdek, Máté J; Chirik, Paul J. Selective [1,4]-Hydrovinylation of 1,3-Dienes with Unactivated Olefins Enabled by Iron Diimine Catalysts. Journal of the American Chemical Society, 2018, 140, 3443-3453
4132017	CIF	C33 H48 Fe N2	P 1 21/n 1	10.8062; 18.8852; 15.2388 90; 105.087; 90	3002.7	Schmidt, Valerie A.; Kennedy, C. Rose; Bezdek, Máté J; Chirik, Paul J. Selective [1,4]-Hydrovinylation of 1,3-Dienes with Unactivated Olefins Enabled by Iron Diimine Catalysts. Journal of the American Chemical Society, 2018, 140, 3443-3453
4132018	CIF	C13 H16 O3	P 21 21 2	28.7833; 7.6635; 5.2638 90; 90; 90	1161.09	Gheewala, Chirag D.; Hirschi, Jennifer S.; Lee, Wai-Hang; Paley, Daniel W.; Vetticatt, Mathew J.; Lambert, Tristan H. Asymmetric Induction via a Helically Chiral Anion: Enantioselective Pentacarboxycyclopentadiene Brønsted Acid-Catalyzed Inverse-Electron-Demand Diels-Alder Cycloaddition of Oxocarbenium Ions. Journal of the American Chemical Society, 2018, 140, 3523-3527
4132019	CIF	C79.21 H97.21 Cl0.63 N O15	P 1 21 1	15.7236; 33.2669; 27.9753 90; 90.4715; 90	14632.7	Gheewala, Chirag D.; Hirschi, Jennifer S.; Lee, Wai-Hang; Paley, Daniel W.; Vetticatt, Mathew J.; Lambert, Tristan H. Asymmetric Induction via a Helically Chiral Anion: Enantioselective Pentacarboxycyclopentadiene Brønsted Acid-Catalyzed Inverse-Electron-Demand Diels-Alder Cycloaddition of Oxocarbenium Ions. Journal of the American Chemical Society, 2018, 140, 3523-3527
4132020	CIF	C91 H60 Mn N4 O	P -1	14.2326; 15.8893; 21.2641 95.728; 105.042; 109.927	4271.09	Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P. A Reactive Manganese(IV)-Hydroxide Complex: A Missing Intermediate in Hydrogen Atom Transfer by High-Valent Metal-Oxo Porphyrinoid Compounds. Journal of the American Chemical Society, 2018, 140, 4380-4390
4132021	CIF	C91 H59 Mn N4 O	P -1	14.1236; 15.7359; 21.2624 94.8197; 105.143; 109.402	4226.02	Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P. A Reactive Manganese(IV)-Hydroxide Complex: A Missing Intermediate in Hydrogen Atom Transfer by High-Valent Metal-Oxo Porphyrinoid Compounds. Journal of the American Chemical Society, 2018, 140, 4380-4390
4132022	CIF	C97 H65 Mn N4 O	P -1	14.2994; 16.0576; 21.14 95.3261; 105.447; 110.607	4284.67	Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P. A Reactive Manganese(IV)-Hydroxide Complex: A Missing Intermediate in Hydrogen Atom Transfer by High-Valent Metal-Oxo Porphyrinoid Compounds. Journal of the American Chemical Society, 2018, 140, 4380-4390
4132023	CIF	C96.08 H64.66 F0.85 Mn0.71 N4 O0.71	P -1	14.1015; 15.8829; 21.2236 95.5849; 104.613; 109.579	4246.68	Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P. A Reactive Manganese(IV)-Hydroxide Complex: A Missing Intermediate in Hydrogen Atom Transfer by High-Valent Metal-Oxo Porphyrinoid Compounds. Journal of the American Chemical Society, 2018, 140, 4380-4390
4132024	CIF	C91 H59 Cl Mn N4	P -1	14.4058; 15.7896; 21.3052 95.599; 105.387; 109.867	4299.1	Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P. A Reactive Manganese(IV)-Hydroxide Complex: A Missing Intermediate in Hydrogen Atom Transfer by High-Valent Metal-Oxo Porphyrinoid Compounds. Journal of the American Chemical Society, 2018, 140, 4380-4390
4132025	CIF	C91 H59 Mn N4 O	P -1	14.1337; 15.8214; 21.3618 95.3238; 104.934; 109.415	4268.74	Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P. A Reactive Manganese(IV)-Hydroxide Complex: A Missing Intermediate in Hydrogen Atom Transfer by High-Valent Metal-Oxo Porphyrinoid Compounds. Journal of the American Chemical Society, 2018, 140, 4380-4390
4132026	CIF	C19 H14 F5 N O	P -1	7.923; 9.918; 10.534 84.008; 79.819; 79.127	797.9	Xiong, Peng; Xu, He-Huan; Song, Jinshuai; Xu, Hai-Chao Electrochemical Difluoromethylarylation of Alkynes. Journal of the American Chemical Society, 2018, 140, 2460-2464
4132027	CIF	C72 H160 Mo8 N4 O28	P 1 21/c 1	13.0401; 22.315; 16.9829 90; 94.276; 90	4928.1	Cai, Li-Xuan; Li, Shao-Chuan; Yan, Dan-Ni; Zhou, Li-Peng; Guo, Fang; Sun, Qing-Fu Water-Soluble Redox-Active Cage Hosting Polyoxometalates for Selective Desulfurization Catalysis. Journal of the American Chemical Society, 2018, 140, 4869-4876
4132028	CIF	C164 H120 B4 F16 N40 O24 Pd4 S3	P 1 21/m 1	16.7178; 34.1498; 18.9986 90; 96.009; 90	10786.9	Cai, Li-Xuan; Li, Shao-Chuan; Yan, Dan-Ni; Zhou, Li-Peng; Guo, Fang; Sun, Qing-Fu Water-Soluble Redox-Active Cage Hosting Polyoxometalates for Selective Desulfurization Catalysis. Journal of the American Chemical Society, 2018, 140, 4869-4876
4132029	CIF	C128 H96 B4 F16 N40 O24 Pd4	P 1 21/n 1	18.388; 36.235; 38.605 90; 90.18; 90	25722	Cai, Li-Xuan; Li, Shao-Chuan; Yan, Dan-Ni; Zhou, Li-Peng; Guo, Fang; Sun, Qing-Fu Water-Soluble Redox-Active Cage Hosting Polyoxometalates for Selective Desulfurization Catalysis. Journal of the American Chemical Society, 2018, 140, 4869-4876
4132030	CIF	C36 H38 F24 Mo2 O10	P 1 21/n 1	10.8549; 17.272; 25.326 90; 100.638; 90	4666.7	Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Alkylidene Complexes through Addition of Water to an Alkylidyne Complex. Journal of the American Chemical Society, 2018, 140, 2797-2800
4132031	CIF	C24 H25 F12 Mo O4 P	P -1	10.1656; 10.6334; 14.9661 89.0887; 71.4763; 66.749	1398.2	Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Alkylidene Complexes through Addition of Water to an Alkylidyne Complex. Journal of the American Chemical Society, 2018, 140, 2797-2800
4132032	CIF	C52 H78 Cl Mo O3 P	P 1 21/c 1	18.003; 24.0118; 23.9393 90; 90.302; 90	10348.4	Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter Syntheses of Molybdenum Oxo Alkylidene Complexes through Addition of Water to an Alkylidyne Complex. Journal of the American Chemical Society, 2018, 140, 2797-2800
4132033	CIF	C90.67 H44 B12 Ni0.67 O32.67 Zr6	P 6/m m m	38.555; 38.555; 17.0605 90; 90; 120	21963	Kung, Chung-Wei; Otake, Kenichi; Buru, Cassandra T.; Goswami, Subhadip; Cui, Yuexing; Hupp, Joseph T.; Spokoyny, Alexander M.; Farha, Omar K. Increased Electrical Conductivity in a Mesoporous Metal-Organic Framework Featuring Metallacarboranes Guests. Journal of the American Chemical Society, 2018, 140, 3871-3875
4132034	CIF	C13 H24 B N O4	P 1 21/c 1	8.1648; 16.1293; 11.1095 90; 98.45; 90	1447.16	Ng, Elvis Wang Hei; Low, Kam-Hung; Chiu, Pauline Synthesis and Applications of Unquaternized C-Bound Boron Enolates. Journal of the American Chemical Society, 2018, 140, 3537-3541
4132035	CIF	C30 H30 N4	P 1 21/c 1	10.3038; 16.368; 7.0296 90; 104.63; 90	1147.12	Zhang, Yu; Lee, Tia S.; Petersen, Jeffrey L.; Milsmann, Carsten A Zirconium Photosensitizer with a Long-Lived Excited State: Mechanistic Insight into Photoinduced Single-Electron Transfer. Journal of the American Chemical Society, 2018, 140, 5934-5947
4132036	CIF	C86 H106 N6 Na O11 Zr	P -1	15.0083; 16.9522; 17.9794 87.08; 65.452; 67.926	3825.8	Zhang, Yu; Lee, Tia S.; Petersen, Jeffrey L.; Milsmann, Carsten A Zirconium Photosensitizer with a Long-Lived Excited State: Mechanistic Insight into Photoinduced Single-Electron Transfer. Journal of the American Chemical Society, 2018, 140, 5934-5947
4132037	CIF	C38 H30 N4 O2	C 1 2/m 1	13.039; 14.398; 7.8109 90; 97.6; 90	1453.5	Sun, Yanqiu; Lei, Yilong; Dong, Huanli; Zhen, Yonggang; Hu, Wenping Solvatomechanical Bending of Organic Charge Transfer Cocrystal. Journal of the American Chemical Society, 2018, 140, 6186-6189
4132038	CIF	C51.83 H52.66 Cl9.72 N Sb0.98	P 1 21/c 1	11.5521; 24.1457; 19.7738 90; 106.01; 90	5301.6	Yokoi, Hiroki; Hiroto, Satoru; Shinokubo, Hiroshi Reversible σ-Bond Formation in Bowl-Shaped π-Radical Cations: The Effects of Curved and Planar Structures. Journal of the American Chemical Society, 2018, 140, 4649-4655
4132039	CIF	C106 H99 Cl13 N2 Sb2	P -1	17.484; 18.351; 18.671 110.418; 104.903; 108.597	4842	Yokoi, Hiroki; Hiroto, Satoru; Shinokubo, Hiroshi Reversible σ-Bond Formation in Bowl-Shaped π-Radical Cations: The Effects of Curved and Planar Structures. Journal of the American Chemical Society, 2018, 140, 4649-4655
4132040	CIF	C128.76 H137.19 Cl14.9 N2 O2.73 Sb2	C 1 2/c 1	32.3774; 12.2907; 29.9008 90; 90.309; 90	11898.6	Yokoi, Hiroki; Hiroto, Satoru; Shinokubo, Hiroshi Reversible σ-Bond Formation in Bowl-Shaped π-Radical Cations: The Effects of Curved and Planar Structures. Journal of the American Chemical Society, 2018, 140, 4649-4655
4132041	CIF	C199.77 H195.32 N4	P 1 21/n 1	21.4102; 30.3917; 25.3832 90; 108.985; 90	15618.2	Yokoi, Hiroki; Hiroto, Satoru; Shinokubo, Hiroshi Reversible σ-Bond Formation in Bowl-Shaped π-Radical Cations: The Effects of Curved and Planar Structures. Journal of the American Chemical Society, 2018, 140, 4649-4655
4132042	CIF	C128.45 H146.48 Br4.81 I12 N24 Zn6	C 1 2 1	35.1167; 14.8989; 30.9479 90; 101.33; 90	15876.4	Goh, Shermin S.; Champagne, Pier Alexandre; Guduguntla, Sureshbabu; Kikuchi, Takashi; Fujita, Makoto; Houk, K. N.; Feringa, Ben L. Stereospecific Ring Contraction of Bromocycloheptenes through Dyotropic Rearrangements via Nonclassical Carbocation-Anion Pairs. Journal of the American Chemical Society, 2018, 140, 4986-4990
4132043	CIF	C18 H19 N3 O4	P 1 21/c 1	17.388; 5.0944; 20.83 90; 106.664; 90	1767.7	Liu, Zhen; Ni, Hui-Qi; Zeng, Tian; Engle, Keary M. Catalytic Carbo- and Aminoboration of Alkenyl Carbonyl Compounds via Five- and Six-Membered Palladacycles. Journal of the American Chemical Society, 2018, 140, 3223-3227
4132044	CIF	C42 H57 F N O2 P Pd	P -1	10.566; 12.3759; 14.7842 107.368; 101.454; 94.717	1787.5	Peacock, D. Matthew; Jiang, Quan; Hanley, Patrick S.; Cundari, Thomas R.; Hartwig, John F. Reductive Elimination from Phosphine-Ligated Alkylpalladium(II) Amido Complexes To Form sp<sup>3</sup> Carbon-Nitrogen Bonds. Journal of the American Chemical Society, 2018, 140, 4893-4904
4132045	CIF	C30 H45 F N O2 P Pd	P 1 21/c 1	8.2454; 16.806; 21.3582 90; 99.868; 90	2915.9	Peacock, D. Matthew; Jiang, Quan; Hanley, Patrick S.; Cundari, Thomas R.; Hartwig, John F. Reductive Elimination from Phosphine-Ligated Alkylpalladium(II) Amido Complexes To Form sp<sup>3</sup> Carbon-Nitrogen Bonds. Journal of the American Chemical Society, 2018, 140, 4893-4904
4132046	CIF	C38 H57 F N O2 P Pd	P -1	11.1182; 11.9143; 14.2549 70.103; 73.8; 77.068	1687.6	Peacock, D. Matthew; Jiang, Quan; Hanley, Patrick S.; Cundari, Thomas R.; Hartwig, John F. Reductive Elimination from Phosphine-Ligated Alkylpalladium(II) Amido Complexes To Form sp<sup>3</sup> Carbon-Nitrogen Bonds. Journal of the American Chemical Society, 2018, 140, 4893-4904
4132047	CIF	C45 H33 B Cl2 F20 Ir P	P -1	10.1418; 14.6984; 15.9199 74.683; 80.155; 83.512	2249.4	Klet, Rachel C.; Kaphan, David M.; Liu, Cong; Yang, Ce; Kropf, A. Jeremy; Perras, Frédéric A; Pruski, Marek; Hock, Adam S.; Delferro, Massimiliano Evidence for Redox Mechanisms in Organometallic Chemisorption and Reactivity on Sulfated Metal Oxides. Journal of the American Chemical Society, 2018, 140, 6308-6316
4132048	CIF	C H5 I3 N2 Pb0.743	P 4 b m	9.0452; 9.0452; 6.4036 90; 90; 90	523.91	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132049	CIF	C H0 I3 N2 Pb0.755	P 4/m b m	9.0452; 9.0452; 6.4036 90; 90; 90	523.91	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132050	CIF	C2 H10 I2 N2	I 1 2/m 1	15.54; 5.0795; 5.0964 90; 96.032; 90	400.06	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132051	CIF	C H5 I3 N2 Pb0.96	A m m 2	6.3652; 9.002; 9.0065 90; 90; 90	516.1	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132052	CIF	C2 H12 I4 N2 O2 Pb	C 1 2/m 1	16.492; 4.7532; 10.4165 90; 113.907; 90	746.5	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132053	CIF	C H6 I3 N Pb0.815	P 4 m m	6.343; 6.343; 6.34 90; 90; 90	255.1	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132054	CIF	C H0 I3 N Pb0.818	P m -3 m	6.342; 6.342; 6.342 90; 90; 90	255.1	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132055	CIF	C H0 I3 N Pb0.854	P m -3 m	6.3338; 6.3338; 6.3338 90; 90; 90	254.09	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132056	CIF	C H0 I3 N2 Pb0.946	P m -3 m	6.3663; 6.3663; 6.3663 90; 90; 90	258.02	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132057	CIF	C H6 I3 N Pb0.847	P 4 m m	6.3361; 6.3361; 6.329 90; 90; 90	254.09	Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G. Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites. Journal of the American Chemical Society, 2018, 140, 5728-5742
4132058	CIF	C19 H17 N O	P 1 21 1	12.3598; 8.1021; 14.4042 90; 104.805; 90	1394.55	Diesel, Johannes; Finogenova, Anastasiia M.; Cramer, Nicolai Nickel-Catalyzed Enantioselective Pyridone C-H Functionalizations Enabled by a Bulky N-Heterocyclic Carbene Ligand. Journal of the American Chemical Society, 2018, 140, 4489-4493
4132059	CIF	C55 H55 Cl3 N2 Ni	P 1 21 1	13.46881; 23.5381; 14.6728 90; 96.9576; 90	4617.47	Diesel, Johannes; Finogenova, Anastasiia M.; Cramer, Nicolai Nickel-Catalyzed Enantioselective Pyridone C-H Functionalizations Enabled by a Bulky N-Heterocyclic Carbene Ligand. Journal of the American Chemical Society, 2018, 140, 4489-4493
4132060	CIF	C49 H48 N2	P 21 21 21	11.672; 18.1421; 18.3663 90; 90; 90	3889.1	Diesel, Johannes; Finogenova, Anastasiia M.; Cramer, Nicolai Nickel-Catalyzed Enantioselective Pyridone C-H Functionalizations Enabled by a Bulky N-Heterocyclic Carbene Ligand. Journal of the American Chemical Society, 2018, 140, 4489-4493
4132061	CIF	C59 H52 Au Cl N2	C 2 2 21	17.77519; 19.4896; 16.16113 90; 90; 90	5598.72	Diesel, Johannes; Finogenova, Anastasiia M.; Cramer, Nicolai Nickel-Catalyzed Enantioselective Pyridone C-H Functionalizations Enabled by a Bulky N-Heterocyclic Carbene Ligand. Journal of the American Chemical Society, 2018, 140, 4489-4493
4132062	CIF	C71 H65 Cl N2 Ni	P 1 21 1	12.34517; 21.7875; 22.0081 90; 98.0106; 90	5861.77	Diesel, Johannes; Finogenova, Anastasiia M.; Cramer, Nicolai Nickel-Catalyzed Enantioselective Pyridone C-H Functionalizations Enabled by a Bulky N-Heterocyclic Carbene Ligand. Journal of the American Chemical Society, 2018, 140, 4489-4493
4132063	CIF	C51 H52 Au Cl5 N2	C 1 2 1	15.8368; 11.3047; 14.2276 90; 114.29; 90	2321.68	Diesel, Johannes; Finogenova, Anastasiia M.; Cramer, Nicolai Nickel-Catalyzed Enantioselective Pyridone C-H Functionalizations Enabled by a Bulky N-Heterocyclic Carbene Ligand. Journal of the American Chemical Society, 2018, 140, 4489-4493
4132064	CIF	C26 H43 Fe P	P 1 21/n 1	8.6511; 22.3002; 12.8632 90; 95.8418; 90	2468.7	Smith, Patrick W.; Tilley, T. Don Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. Journal of the American Chemical Society, 2018, 140, 3880-3883
4132065	CIF	C32 H57 Fe N2 P Si	P 1 21/c 1	15.6114; 26.303; 16.3706 90; 90.023; 90	6722.2	Smith, Patrick W.; Tilley, T. Don Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. Journal of the American Chemical Society, 2018, 140, 3880-3883
4132066	CIF	C29 H43 Fe N2 P Si	P -1	10.3308; 10.7423; 13.3532 77.326; 83.547; 74.207	1389	Smith, Patrick W.; Tilley, T. Don Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. Journal of the American Chemical Society, 2018, 140, 3880-3883
4132067	CIF	C41.01 H60.01 Fe P Si	P n m a	27.887; 11.5982; 11.5654 90; 90; 90	3740.7	Smith, Patrick W.; Tilley, T. Don Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. Journal of the American Chemical Society, 2018, 140, 3880-3883
4132068	CIF	C32 H57 Fe P Si	P 1 21/c 1	12.1407; 10.2012; 26.3408 90; 90.418; 90	3262.2	Smith, Patrick W.; Tilley, T. Don Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. Journal of the American Chemical Society, 2018, 140, 3880-3883
4132069	CIF	C82 H118 Fe2 P2 Si2	P b c a	14.0318; 15.674; 33.3126 90; 90; 90	7326.6	Smith, Patrick W.; Tilley, T. Don Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. Journal of the American Chemical Society, 2018, 140, 3880-3883
4132070	CIF	C29 H34 N O3 P Pd	P 1 21/c 1	13.9333; 12.3236; 16.8031 90; 109.674; 90	2716.8	Zhu, Ru-Yi; Li, Zi-Qi; Park, Han Seul; Senanayake, Chris H.; Yu, Jin-Quan Ligand-Enabled γ-C(sp<sup>3</sup>)-H Activation of Ketones. Journal of the American Chemical Society, 2018, 140, 3564-3568
4132071	CIF	C18 H10 Au F9 I N3 O4 S2	P 1 21/n 1	8.1391; 18.5972; 16.2536 90; 101.985; 90	2406.59	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132072	CIF	C18 H10 Au F8 I2 N3 O4 S2	P 1 21/n 1	11.0172; 8.4253; 27.8416 90; 100.394; 90	2541.94	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132073	CIF	C31 H23 Au F8 I N3 O4 S2	P -1	9.7482; 18.0342; 20.0241 92.573; 102.927; 95.368	3408.1	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132074	CIF	C14 H10 Au F8 N3 O4 S2	P 1 21/c 1	8.1314; 14.0057; 17.569 90; 90.71; 90	2000.71	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132075	CIF	C16 H9 Au F8 I N3 O4 S3	P 1 21/c 1	14.6761; 10.1045; 16.7196 90; 108.482; 90	2351.54	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132076	CIF	C18 H10 Au Cl F8 I N3 O4 S2	P 1 21/c 1	8.2089; 16.0113; 19.2265 90; 97.1398; 90	2507.44	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132077	CIF	C19 H13 Au F8 I N3 O5 S2	P -1	8.1277; 12.1214; 12.9584 102.843; 96.108; 91.9896	1235.4	Harper, Matthew J.; Arthur, Christopher J.; Crosby, John; Emmett, Edward J.; Falconer, Rosalyn L.; Fensham-Smith, Andrew J; Gates, Paul J.; Leman, Thomas; McGrady, John E.; Bower, John F.; Russell, Christopher A. Oxidative Addition, Transmetalation, and Reductive Elimination at a 2,2'-Bipyridyl-Ligated Gold Center. Journal of the American Chemical Society, 2018, 140, 4440-4445
4132078	CIF	C87 H66 Cl13 Ir N2 O7 P2	P 1 21/c 1	28.2502; 12.9485; 28.5346 90; 117.361; 90	9270.2	Petrone, David A.; Isomura, Mayuko; Franzoni, Ivan; Rössler, Simon L; Carreira, Erick M. Allenylic Carbonates in Enantioselective Iridium-Catalyzed Alkylations. Journal of the American Chemical Society, 2018, 140, 4697-4704
4132079	CIF	C25 H24 Br N O2	P 21 21 21	5.1673; 8.8734; 46.1987 90; 90; 90	2118.28	Petrone, David A.; Isomura, Mayuko; Franzoni, Ivan; Rössler, Simon L; Carreira, Erick M. Allenylic Carbonates in Enantioselective Iridium-Catalyzed Alkylations. Journal of the American Chemical Society, 2018, 140, 4697-4704
4132080	CIF	C24 H24 Cl2 N2 O4	P 1 21/n 1	5.0689; 35.6007; 6.3931 90; 110.04; 90	1083.82	Purdum, Geoffrey E.; Telesz, Nicholas G.; Jarolimek, Karol; Ryno, Sean M.; Gessner, Thomas; Davy, Nicholas C.; Petty, 2nd, Anthony J; Zhen, Yonggang; Shu, Ying; Facchetti, Antonio; Collis, Gavin E.; Hu, Wenping; Wu, Chao; Anthony, John E.; Weitz, R. Thomas; Risko, Chad; Loo, Yueh-Lin Presence of Short Intermolecular Contacts Screens for Kinetic Stability in Packing Polymorphs. Journal of the American Chemical Society, 2018, 140, 7519-7525
4132081	CIF	C24 H24 Cl2 N2 O4	P -1	4.641; 8.2418; 14.425 79.39; 83.33; 88.51	538.6	Purdum, Geoffrey E.; Telesz, Nicholas G.; Jarolimek, Karol; Ryno, Sean M.; Gessner, Thomas; Davy, Nicholas C.; Petty, 2nd, Anthony J; Zhen, Yonggang; Shu, Ying; Facchetti, Antonio; Collis, Gavin E.; Hu, Wenping; Wu, Chao; Anthony, John E.; Weitz, R. Thomas; Risko, Chad; Loo, Yueh-Lin Presence of Short Intermolecular Contacts Screens for Kinetic Stability in Packing Polymorphs. Journal of the American Chemical Society, 2018, 140, 7519-7525
4132082	CIF	C22 H6 Br2 F14 N2 O4	P -1	5.1899; 6.6276; 18.7943 94.542; 95.57; 108.608	605.6	Purdum, Geoffrey E.; Telesz, Nicholas G.; Jarolimek, Karol; Ryno, Sean M.; Gessner, Thomas; Davy, Nicholas C.; Petty, 2nd, Anthony J; Zhen, Yonggang; Shu, Ying; Facchetti, Antonio; Collis, Gavin E.; Hu, Wenping; Wu, Chao; Anthony, John E.; Weitz, R. Thomas; Risko, Chad; Loo, Yueh-Lin Presence of Short Intermolecular Contacts Screens for Kinetic Stability in Packing Polymorphs. Journal of the American Chemical Society, 2018, 140, 7519-7525
4132083	CIF	C24 H6 Cl2 F18 N2 O4	P -1	5.2089; 6.3003; 20.6203 83.772; 86.99; 69.934	631.8	Purdum, Geoffrey E.; Telesz, Nicholas G.; Jarolimek, Karol; Ryno, Sean M.; Gessner, Thomas; Davy, Nicholas C.; Petty, 2nd, Anthony J; Zhen, Yonggang; Shu, Ying; Facchetti, Antonio; Collis, Gavin E.; Hu, Wenping; Wu, Chao; Anthony, John E.; Weitz, R. Thomas; Risko, Chad; Loo, Yueh-Lin Presence of Short Intermolecular Contacts Screens for Kinetic Stability in Packing Polymorphs. Journal of the American Chemical Society, 2018, 140, 7519-7525
4132084	CIF	C22 H6 Br2 F14 N2 O4	P 1 21/c 1	12.0361; 16.7027; 5.9578 90; 104.27; 90	1160.77	Purdum, Geoffrey E.; Telesz, Nicholas G.; Jarolimek, Karol; Ryno, Sean M.; Gessner, Thomas; Davy, Nicholas C.; Petty, 2nd, Anthony J; Zhen, Yonggang; Shu, Ying; Facchetti, Antonio; Collis, Gavin E.; Hu, Wenping; Wu, Chao; Anthony, John E.; Weitz, R. Thomas; Risko, Chad; Loo, Yueh-Lin Presence of Short Intermolecular Contacts Screens for Kinetic Stability in Packing Polymorphs. Journal of the American Chemical Society, 2018, 140, 7519-7525
4132085	CIF	C78 H107 K N12 Ni4 O3	P -1	11.1186; 15.8136; 23.5352 73.085; 86.315; 69.691	3709.8	Duan, Peng-Cheng; Manz, Dennis-Helmut; Dechert, Sebastian; Demeshko, Serhiy; Meyer, Franc Reductive O<sub>2</sub> Binding at a Dihydride Complex Leading to Redox Interconvertible μ-1,2-Peroxo and μ-1,2-Superoxo Dinickel(II) Intermediates. Journal of the American Chemical Society, 2018, 140, 4929-4939
4132086	CIF	C79 H117 K N6 Ni2 O13	P b c m	11.2912; 25.8683; 27.1074 90; 90; 90	7917.6	Duan, Peng-Cheng; Manz, Dennis-Helmut; Dechert, Sebastian; Demeshko, Serhiy; Meyer, Franc Reductive O<sub>2</sub> Binding at a Dihydride Complex Leading to Redox Interconvertible μ-1,2-Peroxo and μ-1,2-Superoxo Dinickel(II) Intermediates. Journal of the American Chemical Society, 2018, 140, 4929-4939
4132087	CIF	C41 H57 N6 Ni2 O2.5	P 1 21/c 1	17.3032; 14.2469; 17.1692 90; 113.291; 90	3887.6	Duan, Peng-Cheng; Manz, Dennis-Helmut; Dechert, Sebastian; Demeshko, Serhiy; Meyer, Franc Reductive O<sub>2</sub> Binding at a Dihydride Complex Leading to Redox Interconvertible μ-1,2-Peroxo and μ-1,2-Superoxo Dinickel(II) Intermediates. Journal of the American Chemical Society, 2018, 140, 4929-4939
4132088	CIF	C39 H54 N6 Ni2 O	C 1 2/c 1	18.5261; 16.442; 13.6294 90; 118.32; 90	3654.7	Duan, Peng-Cheng; Manz, Dennis-Helmut; Dechert, Sebastian; Demeshko, Serhiy; Meyer, Franc Reductive O<sub>2</sub> Binding at a Dihydride Complex Leading to Redox Interconvertible μ-1,2-Peroxo and μ-1,2-Superoxo Dinickel(II) Intermediates. Journal of the American Chemical Society, 2018, 140, 4929-4939
4132089	CIF	C700 H862 N173 O140 P8	C 1 2/c 1	64.922; 38.8988; 43.3302 90; 93.821; 90	109182	Zhang, Wenyao; Yang, Dong; Zhao, Jie; Hou, Lekai; Sessler, Jonathan L.; Yang, Xiao-Juan; Wu, Biao Controlling the Recognition and Reactivity of Alkyl Ammonium Guests Using an Anion Coordination-Based Tetrahedral Cage. Journal of the American Chemical Society, 2018, 140, 5248-5256
4132090	CIF	C177.96 H221.9 N43.99 O40 P2	F d d d :2	24.088; 60.3283; 67.581 90; 90; 90	98208	Zhang, Wenyao; Yang, Dong; Zhao, Jie; Hou, Lekai; Sessler, Jonathan L.; Yang, Xiao-Juan; Wu, Biao Controlling the Recognition and Reactivity of Alkyl Ammonium Guests Using an Anion Coordination-Based Tetrahedral Cage. Journal of the American Chemical Society, 2018, 140, 5248-5256
4132091	CIF	C676.5 H419.5 K7 N157.25 O164 P8	I 1 2/a 1	43.47; 39.035; 58.398 90; 98.34; 90	98045	Zhang, Wenyao; Yang, Dong; Zhao, Jie; Hou, Lekai; Sessler, Jonathan L.; Yang, Xiao-Juan; Wu, Biao Controlling the Recognition and Reactivity of Alkyl Ammonium Guests Using an Anion Coordination-Based Tetrahedral Cage. Journal of the American Chemical Society, 2018, 140, 5248-5256
4132092	CIF	C19 H19 Br F3 N O2 S2	P 1 21 1	10.193; 7.5099; 13.7839 90; 103.819; 90	1024.59	Liu, Xiang; Liang, Yaoyu; Ji, Jieying; Luo, Jie; Zhao, Xiaodan Chiral Selenide-Catalyzed Enantioselective Allylic Reaction and Intermolecular Difunctionalization of Alkenes: Efficient Construction of C-SCF<sub>3</sub> Stereogenic Molecules. Journal of the American Chemical Society, 2018, 140, 4782-4786
4132093	CIF	C18 H18 F4 S	P 21 21 21	5.6971; 7.5256; 37.5923 90; 90; 90	1611.74	Liu, Xiang; Liang, Yaoyu; Ji, Jieying; Luo, Jie; Zhao, Xiaodan Chiral Selenide-Catalyzed Enantioselective Allylic Reaction and Intermolecular Difunctionalization of Alkenes: Efficient Construction of C-SCF<sub>3</sub> Stereogenic Molecules. Journal of the American Chemical Society, 2018, 140, 4782-4786
4132094	CIF	C16 H48 Ag Bi Br8 N4	C 1 2/m 1	27.0451; 8.1328; 8.4296 90; 90.081; 90	1854.11	Connor, Bridget A.; Leppert, Linn; Smith, Matthew D.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Layered Halide Double Perovskites: Dimensional Reduction of Cs<sub>2</sub>AgBiBr<sub>6</sub>. Journal of the American Chemical Society, 2018, 140, 5235-5240
4132095	CIF	C8 H24 Ag Bi Br7 Cs N2	P 1 21 1	8.014; 7.8357; 19.6573 90; 101.737; 90	1208.58	Connor, Bridget A.; Leppert, Linn; Smith, Matthew D.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Layered Halide Double Perovskites: Dimensional Reduction of Cs<sub>2</sub>AgBiBr<sub>6</sub>. Journal of the American Chemical Society, 2018, 140, 5235-5240
4132096	CIF	C8 H24 Ag Bi Br7 Cs N2	P 1 21/m 1	8.0848; 7.9801; 19.8422 90; 101.755; 90	1253.32	Connor, Bridget A.; Leppert, Linn; Smith, Matthew D.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Layered Halide Double Perovskites: Dimensional Reduction of Cs<sub>2</sub>AgBiBr<sub>6</sub>. Journal of the American Chemical Society, 2018, 140, 5235-5240
4132097	CIF	C16 H48 Ag Bi Br8 N4	P 1 21/c 1	8.1896; 8.0524; 26.779 90; 90.049; 90	1765.97	Connor, Bridget A.; Leppert, Linn; Smith, Matthew D.; Neaton, Jeffrey B.; Karunadasa, Hemamala I. Layered Halide Double Perovskites: Dimensional Reduction of Cs<sub>2</sub>AgBiBr<sub>6</sub>. Journal of the American Chemical Society, 2018, 140, 5235-5240
4132098	CIF	C10 H11 N O4	P 1 21/c 1	10.9576; 20.9044; 8.4845 90; 100.185; 90	1912.9	Discekici, Emre H.; St Amant, Andre H.; Nguyen, Shay N.; Lee, In-Hwan; Hawker, Craig J.; Read de Alaniz, Javier Endo and Exo Diels-Alder Adducts: Temperature-Tunable Building Blocks for Selective Chemical Functionalization. Journal of the American Chemical Society, 2018, 140, 5009-5013
4132099	CIF	C26 H18 N2 O10	P -1	7.3408; 11.2168; 14.4712 102.926; 91.521; 98.753	1145.57	Hou, Jing; Ee, Aloysius; Feng, Wei; Xu, Jin-Hui; Zhao, Yu; Wu, Jie Visible-Light-Driven Alkyne Hydro-/Carbocarboxylation Using CO<sub>2</sub> via Iridium/Cobalt Dual Catalysis for Divergent Heterocycle Synthesis. Journal of the American Chemical Society, 2018, 140, 5257-5263
4132100	CIF	C26 H23 Br N2	C 1 2 1	22.7031; 5.8682; 16.6098 90; 107.064; 90	2115.4	Yin, Yanli; Dai, Yating; Jia, Hongshao; Li, Jiangtao; Bu, Liwei; Qiao, Baokun; Zhao, Xiaowei; Jiang, Zhiyong Conjugate Addition-Enantioselective Protonation of N-Aryl Glycines to α-Branched 2-Vinylazaarenes via Cooperative Photoredox and Asymmetric Catalysis. Journal of the American Chemical Society, 2018, 140, 6083-6087
4132101	CIF	C11 H19 Cl N O9 Ru2	P 1 21/n 1	8.1385; 11.9075; 18.1107 90; 95.295; 90	1747.6	Lan, Guangxu; Zhu, Yuan-Yuan; Veroneau, Samuel S.; Xu, Ziwan; Micheroni, Daniel; Lin, Wenbin Electron Injection from Photoexcited Metal-Organic Framework Ligands to Ru<sub>2</sub> Secondary Building Units for Visible-Light-Driven Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 5326-5329
4132102	CIF	C51 H31 N5 O11 Ru3	P -1	8.7321; 21.947; 22.807 90.743; 93.98; 92.211	4356.5	Lan, Guangxu; Zhu, Yuan-Yuan; Veroneau, Samuel S.; Xu, Ziwan; Micheroni, Daniel; Lin, Wenbin Electron Injection from Photoexcited Metal-Organic Framework Ligands to Ru<sub>2</sub> Secondary Building Units for Visible-Light-Driven Hydrogen Evolution. Journal of the American Chemical Society, 2018, 140, 5326-5329
4132103	CIF	C68 H79 N5 O6	P c c n	43.3239; 25.6455; 10.7279 90; 90; 90	11919.4	Lewis, James E. M.; Modicom, Florian; Goldup, Stephen M. Efficient Multicomponent Active Template Synthesis of Catenanes. Journal of the American Chemical Society, 2018, 140, 4787-4791
4132104	CIF	C63 H63 N11 O7	P 1 c 1	9.6022; 17.0018; 17.6771 90; 102.232; 90	2820.35	Lewis, James E. M.; Modicom, Florian; Goldup, Stephen M. Efficient Multicomponent Active Template Synthesis of Catenanes. Journal of the American Chemical Society, 2018, 140, 4787-4791
4132105	CIF	C64 H71 N5 O4	P -1	9.0601; 10.8306; 27.6685 100.369; 93.561; 99.092	2625.63	Lewis, James E. M.; Modicom, Florian; Goldup, Stephen M. Efficient Multicomponent Active Template Synthesis of Catenanes. Journal of the American Chemical Society, 2018, 140, 4787-4791
4132106	CIF	C62 H65 N9 O4	P -1	11.0999; 20.1467; 24.9074 84.847; 81.686; 74.103	5293.25	Lewis, James E. M.; Modicom, Florian; Goldup, Stephen M. Efficient Multicomponent Active Template Synthesis of Catenanes. Journal of the American Chemical Society, 2018, 140, 4787-4791
4132107	CIF	C67 H62 Cl6 N16 O4	P 1 21/c 1	16.0021; 20.8606; 20.1134 90; 100.792; 90	6595.4	Lewis, James E. M.; Modicom, Florian; Goldup, Stephen M. Efficient Multicomponent Active Template Synthesis of Catenanes. Journal of the American Chemical Society, 2018, 140, 4787-4791
4132108	CIF	C15 H18 O2 Si	C 1 2 1	19.379; 5.3296; 15.117 90; 111.02; 90	1457.4	Cheng, Biao; Liu, Wenbo; Lu, Zhan Iron-Catalyzed Highly Enantioselective Hydrosilylation of Unactivated Terminal Alkenes. Journal of the American Chemical Society, 2018, 140, 5014-5017
4132109	CIF	C46 H43 Cl2 Fe N3 O2	P 21 21 21	10.363; 19.5669; 20.1438 90; 90; 90	4084.6	Cheng, Biao; Liu, Wenbo; Lu, Zhan Iron-Catalyzed Highly Enantioselective Hydrosilylation of Unactivated Terminal Alkenes. Journal of the American Chemical Society, 2018, 140, 5014-5017
4132110	CIF	C37 H57 N6 O17.5 P2	P -1	13.6131; 18.1837; 19.2192 101.101; 110.003; 92.825	4352.48	Wu, Guangcheng; Wang, Cai-Yun; Jiao, Tianyu; Zhu, Huangtianzhi; Huang, Feihe; Li, Hao Controllable Self-Assembly of Macrocycles in Water for Isolating Aromatic Hydrocarbon Isomers. Journal of the American Chemical Society, 2018, 140, 5955-5961
4132111	CIF	C40 H44 F12 N8 O3 P2	P -1	8.8956; 11.9078; 21.3431 87.772; 84.389; 73.354	2155.55	Wu, Guangcheng; Wang, Cai-Yun; Jiao, Tianyu; Zhu, Huangtianzhi; Huang, Feihe; Li, Hao Controllable Self-Assembly of Macrocycles in Water for Isolating Aromatic Hydrocarbon Isomers. Journal of the American Chemical Society, 2018, 140, 5955-5961
4132112	CIF	C34 H32 Cl2 N6 O2	P n a 21	44.7259; 26.8344; 13.927 90; 90; 90	16715.1	Wu, Guangcheng; Wang, Cai-Yun; Jiao, Tianyu; Zhu, Huangtianzhi; Huang, Feihe; Li, Hao Controllable Self-Assembly of Macrocycles in Water for Isolating Aromatic Hydrocarbon Isomers. Journal of the American Chemical Society, 2018, 140, 5955-5961
4132113	CIF	C35 H34 N6 O6 S	P -1	12.3237; 13.4102; 13.7397 74.526; 85.761; 67.151	2015.52	Wu, Guangcheng; Wang, Cai-Yun; Jiao, Tianyu; Zhu, Huangtianzhi; Huang, Feihe; Li, Hao Controllable Self-Assembly of Macrocycles in Water for Isolating Aromatic Hydrocarbon Isomers. Journal of the American Chemical Society, 2018, 140, 5955-5961
4132114	CIF	C13 H17 Cl O3 S	P 1 21/n 1	19.6959; 6.9198; 21.5771 90; 114.912; 90	2667.16	Li, Zhen; Jangra, Harish; Chen, Quan; Mayer, Peter; Ofial, Armin R.; Zipse, Hendrik; Mayr, Herbert Kinetics and Mechanism of Oxirane Formation by Darzens Condensation of Ketones: Quantification of the Electrophilicities of Ketones. Journal of the American Chemical Society, 2018, 140, 5500-5515
4132115	CIF	C15 H20 Br N O2	P 1 21 1	8.3662; 11.0924; 8.7666 90; 111.045; 90	759.29	Wang, Yong; Wen, Xin; Cui, Xin; Zhang, X. Peter Enantioselective Radical Cyclization for Construction of 5-Membered Ring Structures by Metalloradical C-H Alkylation. Journal of the American Chemical Society, 2018, 140, 4792-4796
4132116	CIF	C16 H23 N O2	P 21 21 21	6.4315; 10.2343; 22.1045 90; 90; 90	1454.96	Wang, Yong; Wen, Xin; Cui, Xin; Zhang, X. Peter Enantioselective Radical Cyclization for Construction of 5-Membered Ring Structures by Metalloradical C-H Alkylation. Journal of the American Chemical Society, 2018, 140, 4792-4796
4132117	CIF	C192 H196 As5 Au6 Cl F30 P12	C 1 2/c 1	35.454; 33.3; 15.96 90; 92.846; 90	18819	Walters, Daniel T.; Aghakhanpour, Reza Babadi; Powers, Xian B.; Ghiassi, Kamran B.; Olmstead, Marilyn M.; Balch, Alan L. Utilization of a Nonemissive Triphosphine Ligand to Construct a Luminescent Gold(I)-Box That Undergoes Mechanochromic Collapse into a Helical Complex. Journal of the American Chemical Society, 2018, 140, 7533-7542
4132118	CIF	C150 H148 Au6 Cl F30 P17	C 1 2/m 1	15.7952; 33.133; 19.067 90; 111.302; 90	9296.8	Walters, Daniel T.; Aghakhanpour, Reza Babadi; Powers, Xian B.; Ghiassi, Kamran B.; Olmstead, Marilyn M.; Balch, Alan L. Utilization of a Nonemissive Triphosphine Ligand to Construct a Luminescent Gold(I)-Box That Undergoes Mechanochromic Collapse into a Helical Complex. Journal of the American Chemical Society, 2018, 140, 7533-7542
4132119	CIF	C185 H188 Au6 Cl F30 P12 Sb5	C 1 2/c 1	35.3414; 33.4913; 16.0576 90; 92.322; 90	18990.6	Walters, Daniel T.; Aghakhanpour, Reza Babadi; Powers, Xian B.; Ghiassi, Kamran B.; Olmstead, Marilyn M.; Balch, Alan L. Utilization of a Nonemissive Triphosphine Ligand to Construct a Luminescent Gold(I)-Box That Undergoes Mechanochromic Collapse into a Helical Complex. Journal of the American Chemical Society, 2018, 140, 7533-7542
4132120	CIF	C99 H100 Au3 F9 O10 P6 S3	P -1	13.9411; 16.4211; 21.984 101.193; 98.197; 96.808	4830.9	Walters, Daniel T.; Aghakhanpour, Reza Babadi; Powers, Xian B.; Ghiassi, Kamran B.; Olmstead, Marilyn M.; Balch, Alan L. Utilization of a Nonemissive Triphosphine Ligand to Construct a Luminescent Gold(I)-Box That Undergoes Mechanochromic Collapse into a Helical Complex. Journal of the American Chemical Society, 2018, 140, 7533-7542
4132121	CIF	C139 H132 Au6 Cl F30 O3 P17	C 1 c 1	25.058; 13.8613; 42.523 90; 91.158; 90	14767	Walters, Daniel T.; Aghakhanpour, Reza Babadi; Powers, Xian B.; Ghiassi, Kamran B.; Olmstead, Marilyn M.; Balch, Alan L. Utilization of a Nonemissive Triphosphine Ligand to Construct a Luminescent Gold(I)-Box That Undergoes Mechanochromic Collapse into a Helical Complex. Journal of the American Chemical Society, 2018, 140, 7533-7542
4132122	CIF	C63 H83 F7 N O4 P Pd S	P b c a	19.4006; 25.4448; 25.5338 90; 90; 90	12604.6	Dennis, Joseph M.; White, Nicholas A.; Liu, Richard Y.; Buchwald, Stephen L. Breaking the Base Barrier: An Electron-Deficient Palladium Catalyst Enables the Use of a Common Soluble Base in C-N Coupling. Journal of the American Chemical Society, 2018, 140, 4721-4725
4132123	CIF	C18 H23 N3 O2 Si	P 1 21/c 1	11.5544; 6.1514; 25.784 90; 93.021; 90	1830.1	Hernandez, Lucas W.; Klöckner, Ulrich; Pospech, Jola; Hauss, Lilian; Sarlah, David Nickel-Catalyzed Dearomative trans-1,2-Carboamination. Journal of the American Chemical Society, 2018, 140, 4503-4507
4132124	CIF	C19 H17 N3 O2	P 21 21 21	5.9911; 14.3103; 18.8938 90; 90; 90	1619.8	Hernandez, Lucas W.; Klöckner, Ulrich; Pospech, Jola; Hauss, Lilian; Sarlah, David Nickel-Catalyzed Dearomative trans-1,2-Carboamination. Journal of the American Chemical Society, 2018, 140, 4503-4507
4132125	CIF	C9 H14 B10 O	P 1 21 1	10.7015; 22.7815; 11.3703 90; 102.692; 90	2704.3	Cheng, Ruofei; Li, Bowen; Wu, Jie; Zhang, Jie; Qiu, Zaozao; Tang, Wenjun; You, Shu-Li; Tang, Yong; Xie, Zuowei Enantioselective Synthesis of Chiral-at-Cage o-Carboranes via Pd-Catalyzed Asymmetric B-H Substitution. Journal of the American Chemical Society, 2018, 140, 4508-4511
4132126	CIF	C9 H13 B10 I O	P 1 21 1	9.104; 7.3271; 11.901 90; 106.709; 90	760.3	Cheng, Ruofei; Li, Bowen; Wu, Jie; Zhang, Jie; Qiu, Zaozao; Tang, Wenjun; You, Shu-Li; Tang, Yong; Xie, Zuowei Enantioselective Synthesis of Chiral-at-Cage o-Carboranes via Pd-Catalyzed Asymmetric B-H Substitution. Journal of the American Chemical Society, 2018, 140, 4508-4511
4132127	CIF	C9 H13 B10 I O	P 1 21 1	9.1291; 7.3414; 11.9192 90; 106.522; 90	765.85	Cheng, Ruofei; Li, Bowen; Wu, Jie; Zhang, Jie; Qiu, Zaozao; Tang, Wenjun; You, Shu-Li; Tang, Yong; Xie, Zuowei Enantioselective Synthesis of Chiral-at-Cage o-Carboranes via Pd-Catalyzed Asymmetric B-H Substitution. Journal of the American Chemical Society, 2018, 140, 4508-4511
4132128	CIF	C42 H32 Cl2 N4 O2	P 1 21/n 1	18.838; 7.8317; 23.075 90; 93; 90	3399.7	Chu, Qianli; Duncan, Andrew J. E.; Papaefstathiou, Giannis S.; Hamilton, Tamara D.; Atkinson, Manza B. J.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Putting Cocrystal Stoichiometry to Work: A Reactive Hydrogen-Bonded "Superassembly" Enables Nanoscale Enlargement of a Metal-Organic Rhomboid via a Solid-State Photocycloaddition. Journal of the American Chemical Society, 2018, 140, 4940-4944
4132129	CIF	C54 H40 Cl6 N4 O6	P -1	11.06; 11.18; 21.621 85.64; 80.41; 65.33	2395.4	Chu, Qianli; Duncan, Andrew J. E.; Papaefstathiou, Giannis S.; Hamilton, Tamara D.; Atkinson, Manza B. J.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Putting Cocrystal Stoichiometry to Work: A Reactive Hydrogen-Bonded "Superassembly" Enables Nanoscale Enlargement of a Metal-Organic Rhomboid via a Solid-State Photocycloaddition. Journal of the American Chemical Society, 2018, 140, 4940-4944
4132130	CIF	C60 H36 Cl12 Cu2 F24 N4 O8	P -1	14.24; 16.4; 17.079 74.866; 84.001; 78.978	3772.9	Chu, Qianli; Duncan, Andrew J. E.; Papaefstathiou, Giannis S.; Hamilton, Tamara D.; Atkinson, Manza B. J.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Putting Cocrystal Stoichiometry to Work: A Reactive Hydrogen-Bonded "Superassembly" Enables Nanoscale Enlargement of a Metal-Organic Rhomboid via a Solid-State Photocycloaddition. Journal of the American Chemical Society, 2018, 140, 4940-4944
4132131	CIF	C40 H72 B11 N4 Na O2 Si2	P -1	10.542; 15.037; 17.602 80.603; 77.248; 79.736	2655	Wang, Hao; Zhang, Jiji; Lee, Hung Kay; Xie, Zuowei Borylene Insertion into Cage B-H Bond: A Route to Electron-Precise B-B Single Bond. Journal of the American Chemical Society, 2018, 140, 3888-3891
4132132	CIF	C49 H84 B11 Br N4 Na O2.5 Si2	P 1 21/n 1	13.0602; 33.657; 15.015 90; 113.3; 90	6061.8	Wang, Hao; Zhang, Jiji; Lee, Hung Kay; Xie, Zuowei Borylene Insertion into Cage B-H Bond: A Route to Electron-Precise B-B Single Bond. Journal of the American Chemical Society, 2018, 140, 3888-3891
4132133	CIF	C70 H72 Cl6 N12 O4	P -1	11.1142; 13.003; 13.8223 66.511; 88.482; 67.769	1677.58	Kim, Soobin; Castillo, Henry D.; Lee, Milim; Mortensen, Riley D.; Tait, Steven L.; Lee, Dongwhan From Foldable Open Chains to Shape-Persistent Macrocycles: Synthesis, Impact on 2D Ordering, and Stimulated Self-Assembly. Journal of the American Chemical Society, 2018, 140, 4726-4735
4132134	CIF	C22 H22	P 1 21/n 1	5.1746; 8.6038; 35.456 90; 90.339; 90	1578.5	Bai, Yu-Bin; Luo, Zaigang; Wang, Yuguang; Gao, Jin-Ming; Zhang, Liming Au-Catalyzed Intermolecular [2+2] Cycloadditions between Chloroalkynes and Unactivated Alkenes. Journal of the American Chemical Society, 2018, 140, 5860-5865
4132135	CIF	C17.5 H32 Cl3 Co N2 P	P -1	7.8212; 15.7879; 19.7391 109.275; 100.01; 91.118	2257.98	Liu, Xufang; Zhang, Wei; Wang, Yujie; Zhang, Ze-Xin; Jiao, Lei; Liu, Qiang Cobalt-Catalyzed Regioselective Olefin Isomerization Under Kinetic Control. Journal of the American Chemical Society, 2018, 140, 6873-6882
4132136	CIF	C16 H29 Co I2 N2 P	P 1 21/n 1	7.6131; 18.608; 14.78 90; 98.42; 90	2071.2	Liu, Xufang; Zhang, Wei; Wang, Yujie; Zhang, Ze-Xin; Jiao, Lei; Liu, Qiang Cobalt-Catalyzed Regioselective Olefin Isomerization Under Kinetic Control. Journal of the American Chemical Society, 2018, 140, 6873-6882
4132137	CIF	C15 H27 Cl2 Co N2 P	P n a 21	16.6705; 8.1102; 27.7803 90; 90; 90	3755.93	Liu, Xufang; Zhang, Wei; Wang, Yujie; Zhang, Ze-Xin; Jiao, Lei; Liu, Qiang Cobalt-Catalyzed Regioselective Olefin Isomerization Under Kinetic Control. Journal of the American Chemical Society, 2018, 140, 6873-6882
4132138	CIF	C28 H50 Cl4 Co2 N4 P2	P 1 21/c 1	13.9796; 14.563; 17.6977 90; 91.037; 90	3602.4	Liu, Xufang; Zhang, Wei; Wang, Yujie; Zhang, Ze-Xin; Jiao, Lei; Liu, Qiang Cobalt-Catalyzed Regioselective Olefin Isomerization Under Kinetic Control. Journal of the American Chemical Society, 2018, 140, 6873-6882
4132139	CIF	C60.51 H40.06 Cl1.01 F9 Fe3 N6 O12 S3	P -1	12.5224; 12.8854; 21.9843 93.576; 103.138; 118.4	2977.9	Arnett, Charles H.; Chalkley, Matthew J.; Agapie, Theodor A Thermodynamic Model for Redox-Dependent Binding of Carbon Monoxide at Site-Differentiated, High Spin Iron Clusters. Journal of the American Chemical Society, 2018, 140, 5569-5578
4132140	CIF	C87.5 H64 Cl F9 Fe3 N12 O13 S3	P -3	23.4333; 23.4333; 9.796 90; 90; 120	4658.5	Arnett, Charles H.; Chalkley, Matthew J.; Agapie, Theodor A Thermodynamic Model for Redox-Dependent Binding of Carbon Monoxide at Site-Differentiated, High Spin Iron Clusters. Journal of the American Chemical Society, 2018, 140, 5569-5578
4132141	CIF	C90.6 H68.17 Cl4.26 F6 Fe4 N12 O10.62 S2	P -1	15.486; 15.4964; 19.448 100.128; 93.878; 93.078	4573.6	Arnett, Charles H.; Chalkley, Matthew J.; Agapie, Theodor A Thermodynamic Model for Redox-Dependent Binding of Carbon Monoxide at Site-Differentiated, High Spin Iron Clusters. Journal of the American Chemical Society, 2018, 140, 5569-5578
4132142	CIF	C91.07 H66.15 Cl6.15 F6 Fe4 N12 O12 S2	P 1 21/c 1	14.4988; 45.032; 14.6559 90; 106.58; 90	9171.1	Arnett, Charles H.; Chalkley, Matthew J.; Agapie, Theodor A Thermodynamic Model for Redox-Dependent Binding of Carbon Monoxide at Site-Differentiated, High Spin Iron Clusters. Journal of the American Chemical Society, 2018, 140, 5569-5578
4132143	CIF	C90.34 H60 F3 Fe4 N14.67 O7 S	C 1 2/c 1	40.403; 17.5931; 25.468 90; 115.389; 90	16355	Arnett, Charles H.; Chalkley, Matthew J.; Agapie, Theodor A Thermodynamic Model for Redox-Dependent Binding of Carbon Monoxide at Site-Differentiated, High Spin Iron Clusters. Journal of the American Chemical Society, 2018, 140, 5569-5578
4132144	CIF	C92 H65 F3 Fe4 N15 O8 S	P -1	12.349; 15.527; 21.471 78.351; 79.352; 88.53	3962	Arnett, Charles H.; Chalkley, Matthew J.; Agapie, Theodor A Thermodynamic Model for Redox-Dependent Binding of Carbon Monoxide at Site-Differentiated, High Spin Iron Clusters. Journal of the American Chemical Society, 2018, 140, 5569-5578
4132145	CIF	C13 H10 N4 O7	P 21 21 21	7.5143; 12.9125; 13.961 90; 90; 90	1354.61	Gu, Ruirui; Flidrova, Karolina; Lehn, Jean-Marie Dynamic Covalent Metathesis in the C═C/C═N Exchange between Knoevenagel Compounds and Imines. Journal of the American Chemical Society, 2018, 140, 5560-5568
4132146	CIF	C15 H27 N3	P 1 21/c 1	9.2706; 17.6938; 9.5355 90; 115.51; 90	1411.64	Gu, Ruirui; Flidrova, Karolina; Lehn, Jean-Marie Dynamic Covalent Metathesis in the C═C/C═N Exchange between Knoevenagel Compounds and Imines. Journal of the American Chemical Society, 2018, 140, 5560-5568
4132147	CIF	C39 H12 Cl4 Cu F15 N4	P 21 21 21	7.241; 16.788; 30.202 90; 90; 90	3671	Maurya, Yogesh Kumar; Noda, Katsuya; Yamasumi, Kazuhisa; Mori, Shigeki; Uchiyama, Tomoki; Kamitani, Kazutaka; Hirai, Tomoyasu; Ninomiya, Kakeru; Nishibori, Maiko; Hori, Yuta; Shiota, Yoshihito; Yoshizawa, Kazunari; Ishida, Masatoshi; Furuta, Hiroyuki Ground-State Copper(III) Stabilized by N-Confused/N-Linked Corroles: Synthesis, Characterization, and Redox Reactivity. Journal of the American Chemical Society, 2018, 140, 6883-6892
4132148	CIF	C41 H14 Cu F15 N6	P n a 21	30.8426; 15.9684; 7.0861 90; 90; 90	3490	Maurya, Yogesh Kumar; Noda, Katsuya; Yamasumi, Kazuhisa; Mori, Shigeki; Uchiyama, Tomoki; Kamitani, Kazutaka; Hirai, Tomoyasu; Ninomiya, Kakeru; Nishibori, Maiko; Hori, Yuta; Shiota, Yoshihito; Yoshizawa, Kazunari; Ishida, Masatoshi; Furuta, Hiroyuki Ground-State Copper(III) Stabilized by N-Confused/N-Linked Corroles: Synthesis, Characterization, and Redox Reactivity. Journal of the American Chemical Society, 2018, 140, 6883-6892
4132149	CIF	C82 H36 Cu2 F30 N8 O2	P -1	15.3803; 16.8229; 16.9418 66.502; 77.999; 76.171	3872.2	Maurya, Yogesh Kumar; Noda, Katsuya; Yamasumi, Kazuhisa; Mori, Shigeki; Uchiyama, Tomoki; Kamitani, Kazutaka; Hirai, Tomoyasu; Ninomiya, Kakeru; Nishibori, Maiko; Hori, Yuta; Shiota, Yoshihito; Yoshizawa, Kazunari; Ishida, Masatoshi; Furuta, Hiroyuki Ground-State Copper(III) Stabilized by N-Confused/N-Linked Corroles: Synthesis, Characterization, and Redox Reactivity. Journal of the American Chemical Society, 2018, 140, 6883-6892
4132150	CIF	C76 H92 Sn2	P 1 21/n 1	16.0453; 11.7131; 19.0503 90; 93.4712; 90	3573.7	Lai, Ting Yi; Fettinger, James C.; Power, Philip P. Facile C-H Bond Metathesis Mediated by a Stannylene. Journal of the American Chemical Society, 2018, 140, 5674-5677
4132151	CIF	C88 H104 Sn2	P -1	11.7763; 12.8319; 13.7749 110.615; 101.716; 96.648	1867.42	Lai, Ting Yi; Fettinger, James C.; Power, Philip P. Facile C-H Bond Metathesis Mediated by a Stannylene. Journal of the American Chemical Society, 2018, 140, 5674-5677
4132152	CIF	C21 H28 O3	P 1 21 1	6.4708; 20.0417; 7.2325 90; 107.489; 90	894.6	Zhang, Hai-Jun; Schuppe, Alexander W.; Pan, Shi-Tao; Chen, Jin-Xiang; Wang, Bo-Ran; Newhouse, Timothy R.; Yin, Liang Copper-Catalyzed Vinylogous Aerobic Oxidation of Unsaturated Compounds with Air. Journal of the American Chemical Society, 2018, 140, 5300-5310
4132153	CIF	C14 H15 N O3	P 1 21/c 1	7.235; 11.4719; 14.8725 90; 95.298; 90	1229.13	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132154	CIF	C19 H21 N O5	P -1	7.6302; 8.8519; 12.7508 87.503; 87.653; 87.251	858.75	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132155	CIF	C17 H19 N O3	P 21 21 21	7.6671; 8.3382; 23.4368 90; 90; 90	1498.3	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132156	CIF	C19 H22 O6	P 1 21/c 1	8.9536; 13.8303; 13.3248 90; 94.6825; 90	1644.52	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132157	CIF	C20 H25 N O5	P b c a	11.5962; 14.1871; 21.2925 90; 90; 90	3503	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132158	CIF	C19 H23 N O5	P 1 21/c 1	7.6612; 20.3093; 10.7852 90; 90.6667; 90	1677.99	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132159	CIF	C19 H23 N O5	P 1 21/c 1	16.1951; 8.3508; 13.1442 90; 102.437; 90	1735.93	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132160	CIF	C19 H23 N O5	C 1 2 1	25.0443; 6.8179; 10.1504 90; 96.3846; 90	1722.43	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132161	CIF	C12 H14 O3	C 1 c 1	4.2298; 19.7579; 12.2515 90; 97.8156; 90	1014.37	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132162	CIF	C17 H19 N O3	P 21 21 21	7.6599; 8.342; 23.4353 90; 90; 90	1497.49	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132163	CIF	C17 H19 N O3	P 21 21 21	7.661; 8.3423; 23.444 90; 90; 90	1498.31	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132164	CIF	C20 H23 N O5	P -1	7.9677; 9.2454; 11.7448 83.4692; 88.5722; 80.9664	848.88	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132165	CIF	C27 H30 N2 O6	P 1 21/c 1	13.4422; 11.6532; 15.2777 90; 99.794; 90	2358.29	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132166	CIF	C20 H22 N2 O5	P b c a	8.2294; 18.282; 22.361 90; 90; 90	3364.2	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132167	CIF	C21 H27 Cl2 N O5	P -1	8.3263; 11.362; 12.3017 69.648; 83.394; 70.16	1026.36	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132168	CIF	C24 H32 N2 O8	P 1 21/c 1	10.0419; 18.4401; 12.5503 90; 93.409; 90	2319.9	Hartrampf, Nina; Winter, Nils; Pupo, Gabriele; Stoltz, Brian M.; Trauner, Dirk Total Synthesis of the Norhasubanan Alkaloid Stephadiamine. Journal of the American Chemical Society, 2018, 140, 8675-8680
4132169	CIF	C28 H37 N3 O3 S	P 1 21/c 1	9.706; 25.862; 11.622 90; 114.351; 90	2657.8	Han, Ting; Deng, Haiqin; Qiu, Zijie; Zhao, Zheng; Zhang, Haoke; Zou, Hang; Leung, Nelson L. C.; Shan, Guogang; Elsegood, Mark R. J.; Lam, Jacky W. Y.; Tang, Ben Zhong Facile Multicomponent Polymerizations toward Unconventional Luminescent Polymers with Readily Openable Small Heterocycles. Journal of the American Chemical Society, 2018, 140, 5588-5598
4132170	CIF	C56 H103 Cl4 Co6 F6 N O2 P7 Se8	P 1 21/c 1	13.6351; 23.0852; 25.6213 90; 90.584; 90	8064.4	Voevodin, Anastasia; Campos, Luis M.; Roy, Xavier Multifunctional Vesicles from a Self-assembled Cluster-Containing Diblock Copolymer. Journal of the American Chemical Society, 2018, 140, 5607-5611
4132171	CIF	C25 H26 N2 O3 S	P 1 21/c 1	8.9529; 24.098; 20.991 90; 93.228; 90	4521.6	Liu, Mingyu; Yang, Pusu; Karunananda, Malkanthi K.; Wang, Yanyan; Liu, Peng; Engle, Keary M. C(alkenyl)-H Activation via Six-Membered Palladacycles: Catalytic 1,3-Diene Synthesis. Journal of the American Chemical Society, 2018, 140, 5805-5813
4132172	CIF	C27 H24 Cl N2 O3 Pd	P -1	10.0696; 10.1472; 11.9906 110.579; 96.643; 90.227	1137.98	Liu, Mingyu; Yang, Pusu; Karunananda, Malkanthi K.; Wang, Yanyan; Liu, Peng; Engle, Keary M. C(alkenyl)-H Activation via Six-Membered Palladacycles: Catalytic 1,3-Diene Synthesis. Journal of the American Chemical Society, 2018, 140, 5805-5813
4132173	CIF	C21 H18 Cl N2 O Pd	C 1 2/c 1	15.5251; 13.7858; 17.6487 90; 112.346; 90	3493.62	Liu, Mingyu; Yang, Pusu; Karunananda, Malkanthi K.; Wang, Yanyan; Liu, Peng; Engle, Keary M. C(alkenyl)-H Activation via Six-Membered Palladacycles: Catalytic 1,3-Diene Synthesis. Journal of the American Chemical Society, 2018, 140, 5805-5813
4132174	CIF	C33 H33 F7 N2 O3	P 1 21/n 1	13.48259; 14.45393; 16.01156 90; 104.013; 90	3027.42	Cabrera, Pablo J.; Lee, Melissa; Sanford, Melanie S. Second-Generation Palladium Catalyst System for Transannular C-H Functionalization of Azabicycloalkanes. Journal of the American Chemical Society, 2018, 140, 5599-5606
4132175	CIF	C31 H33 F7 N2 O4	P -1	8.7749; 11.2077; 15.1378 101.086; 91.8988; 98.755	1440.95	Cabrera, Pablo J.; Lee, Melissa; Sanford, Melanie S. Second-Generation Palladium Catalyst System for Transannular C-H Functionalization of Azabicycloalkanes. Journal of the American Chemical Society, 2018, 140, 5599-5606
4132176	CIF	C18 H19 F N2 O4 S	P 21 21 21	7.4092; 10.2119; 22.525 90; 90; 90	1704.3	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132177	CIF	C24 H21 F O6 S	P 21 21 21	5.2733; 10.7709; 37.817 90; 90; 90	2147.9	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132178	CIF	C11 H12.5 F N O4.25 S	P 62	17.8047; 17.8047; 6.9972 90; 90; 120	1920.99	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132179	CIF	C17 H18 F N O4 S2	P 21 21 21	5.527; 8.6617; 36.032 90; 90; 90	1725	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132180	CIF	C17 H18 F2 N2 O4 S	P 21 21 21	7.5617; 9.7752; 23.9131 90; 90; 90	1767.59	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132181	CIF	C16 H16 F2 N2 O4 S	P 1 21 1	13.7281; 7.7633; 15.1716 90; 96.176; 90	1607.53	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132182	CIF	C17 H18 F2 N2 O4 S	P 1 21 1	7.8163; 9.2956; 12.4965 90; 98.9206; 90	896.98	Mennie, Katrina M.; Banik, Steven M.; Reichert, Elaine C.; Jacobsen, Eric N. Catalytic Diastereo- and Enantioselective Fluoroamination of Alkenes. Journal of the American Chemical Society, 2018, 140, 4797-4802
4132183	CIF	C39 H36 S3	P 1 21/n 1	13.9615; 14.7481; 16.6133 90; 103.869; 90	3321	Moneypenny, 2nd, Timothy P; Yang, Anna; Walter, Nathan P.; Woods, Toby J.; Gray, Danielle L.; Zhang, Yang; Moore, Jeffrey S. Product Distribution from Precursor Bite Angle Variation in Multitopic Alkyne Metathesis: Evidence for a Putative Kinetic Bottleneck. Journal of the American Chemical Society, 2018, 140, 5825-5833
4132184	CIF	C44 H46 O	P 1 21/n 1	16.549; 9.9129; 22.008 90; 104.799; 90	3490.6	Moneypenny, 2nd, Timothy P; Yang, Anna; Walter, Nathan P.; Woods, Toby J.; Gray, Danielle L.; Zhang, Yang; Moore, Jeffrey S. Product Distribution from Precursor Bite Angle Variation in Multitopic Alkyne Metathesis: Evidence for a Putative Kinetic Bottleneck. Journal of the American Chemical Society, 2018, 140, 5825-5833
4132185	CIF	C66 H66 O3	P -3 c 1	15.2838; 15.2838; 27.213 90; 90; 120	5505.2	Moneypenny, 2nd, Timothy P; Yang, Anna; Walter, Nathan P.; Woods, Toby J.; Gray, Danielle L.; Zhang, Yang; Moore, Jeffrey S. Product Distribution from Precursor Bite Angle Variation in Multitopic Alkyne Metathesis: Evidence for a Putative Kinetic Bottleneck. Journal of the American Chemical Society, 2018, 140, 5825-5833
4132186	CIF	C72 Cu3 N12 O36 Zr6	I 4/m	15.7186; 15.7186; 29.22 90; 90; 90	7219.5	Muldoon, Patrick F.; Liu, Chong; Miller, Carson C.; Koby, S. Benjamin; Gamble Jarvi, Austin; Luo, Tian-Yi; Saxena, Sunil; O'Keeffe, Michael; Rosi, Nathaniel L. Programmable Topology in New Families of Heterobimetallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 6194-6198
4132187	CIF	C7 H8 Cl0.81 Cu0.5 Hf0.5 N O2.67	F m -3 m	30.259; 30.259; 30.259 90; 90; 90	27705.4	Muldoon, Patrick F.; Liu, Chong; Miller, Carson C.; Koby, S. Benjamin; Gamble Jarvi, Austin; Luo, Tian-Yi; Saxena, Sunil; O'Keeffe, Michael; Rosi, Nathaniel L. Programmable Topology in New Families of Heterobimetallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 6194-6198
4132188	CIF	C5 Cd0.12 Cl0.25 Dy0.25 F0.5 N0.5 O1.33	P m -3 m	16.0403; 16.0403; 16.0403 90; 90; 90	4127	Muldoon, Patrick F.; Liu, Chong; Miller, Carson C.; Koby, S. Benjamin; Gamble Jarvi, Austin; Luo, Tian-Yi; Saxena, Sunil; O'Keeffe, Michael; Rosi, Nathaniel L. Programmable Topology in New Families of Heterobimetallic Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 6194-6198
4132189	CIF	C36 H40 N2 O11	P 21 21 21	7.1329; 17.6817; 35.8965 90; 90; 90	4527.33	Mandler, Michael D.; Baidin, Vadim; Lee, James; Pahil, Karanbir S.; Owens, Tristan W.; Kahne, Daniel Novobiocin Enhances Polymyxin Activity by Stimulating Lipopolysaccharide Transport. Journal of the American Chemical Society, 2018, 140, 6749-6753
4132190	CIF	C43 H62 Cl2 N5 P Ru	P 1 21/c 1	12.685; 14.502; 22.983 90; 99.043; 90	4175	Chu, Crystal K.; Lin, Tzu-Pin; Shao, Huiling; Liberman-Martin, Allegra L; Liu, Peng; Grubbs, Robert H. Disentangling Ligand Effects on Metathesis Catalyst Activity: Experimental and Computational Studies of Ruthenium-Aminophosphine Complexes. Journal of the American Chemical Society, 2018, 140, 5634-5643
4132191	CIF	C50 H76 Cl2 N4 O1.5 P Ru	P 1 21/n 1	12.582; 14.694; 26.929 90; 102.711; 90	4857	Chu, Crystal K.; Lin, Tzu-Pin; Shao, Huiling; Liberman-Martin, Allegra L; Liu, Peng; Grubbs, Robert H. Disentangling Ligand Effects on Metathesis Catalyst Activity: Experimental and Computational Studies of Ruthenium-Aminophosphine Complexes. Journal of the American Chemical Society, 2018, 140, 5634-5643
4132192	CIF	C50 H72 Cl2 N3 O0.5 P Ru	P 1 21/c 1	12.5478; 14.1495; 26.7547 90; 92.828; 90	4744.4	Chu, Crystal K.; Lin, Tzu-Pin; Shao, Huiling; Liberman-Martin, Allegra L; Liu, Peng; Grubbs, Robert H. Disentangling Ligand Effects on Metathesis Catalyst Activity: Experimental and Computational Studies of Ruthenium-Aminophosphine Complexes. Journal of the American Chemical Society, 2018, 140, 5634-5643
4132193	CIF	C44 H58 Cl2 N3 P Ru	P 1 21/c 1	12.1351; 14.8021; 22.944 90; 98.642; 90	4074.5	Chu, Crystal K.; Lin, Tzu-Pin; Shao, Huiling; Liberman-Martin, Allegra L; Liu, Peng; Grubbs, Robert H. Disentangling Ligand Effects on Metathesis Catalyst Activity: Experimental and Computational Studies of Ruthenium-Aminophosphine Complexes. Journal of the American Chemical Society, 2018, 140, 5634-5643
4132194	CIF	C174 H100 Cl0 N2 O0	P -1	15.9701; 19.026; 25.333 75.796; 78.814; 72.466	7055.1	Takeda, Motoki; Hiroto, Satoru; Yokoi, Hiroki; Lee, Sangsu; Kim, Dongho; Shinokubo, Hiroshi Azabuckybowl-Based Molecular Tweezers as C<sub>60</sub> and C<sub>70</sub> Receptors. Journal of the American Chemical Society, 2018, 140, 6336-6342
4132195	CIF	C205 H124 N2	P 1 21/n 1	13.0834; 38.2825; 26.7591 90; 102.678; 90	13075.9	Takeda, Motoki; Hiroto, Satoru; Yokoi, Hiroki; Lee, Sangsu; Kim, Dongho; Shinokubo, Hiroshi Azabuckybowl-Based Molecular Tweezers as C<sub>60</sub> and C<sub>70</sub> Receptors. Journal of the American Chemical Society, 2018, 140, 6336-6342
4132196	CIF	C31 H25 N O3 S	P 21 21 21	9.62577; 14.4848; 18.2568 90; 90; 90	2545.5	Jin, Jianwen; Zhao, Yichao; Gouranourimi, Ali; Ariafard, Alireza; Hong Chan, Philip Wai Chiral Brønsted Acid Catalyzed Enantioselective Dehydrative Nazarov-Type Electrocyclization of Aryl and 2-Thienyl Vinyl Alcohols. Journal of the American Chemical Society, 2018, 140, 5834-5841
4132197	CIF	C28 H29 N O4	P 1 21 1	5.264; 20.199; 11.328 90; 99.87; 90	1186.7	Jin, Jianwen; Zhao, Yichao; Gouranourimi, Ali; Ariafard, Alireza; Hong Chan, Philip Wai Chiral Brønsted Acid Catalyzed Enantioselective Dehydrative Nazarov-Type Electrocyclization of Aryl and 2-Thienyl Vinyl Alcohols. Journal of the American Chemical Society, 2018, 140, 5834-5841
4132198	CIF	C36 H24 N2 O2	P -1	9.454; 10.1497; 15.3519 75.573; 86.417; 89.725	1423.77	He, Xuewen; Zhao, Zheng; Xiong, Ling-Hong; Gao, Peng Fei; Peng, Chen; Li, Rong Sheng; Xiong, Yu; Li, Zhi; Sung, Herman H.-Y.; Williams, Ian D.; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Huang, Cheng Zhi; Ma, Nan; Tang, Ben Zhong Redox-Active AIEgen-Derived Plasmonic and Fluorescent Core@Shell Nanoparticles for Multimodality Bioimaging. Journal of the American Chemical Society, 2018, 140, 6904-6911
4132199	CIF	C84 H68 Al2 F48 N4 O8	P -1	14.0173; 15.6044; 21.793 81.23; 83.509; 81.202	4636	Wang, Wenqing; Chen, Chao; Shu, Chan; Rajca, Suchada; Wang, Xinping; Rajca, Andrzej S = 1 Tetraazacyclophane Diradical Dication with Robust Stability: A Case of Low-Temperature One-Dimensional Antiferromagnetic Chain. Journal of the American Chemical Society, 2018, 140, 7820-7826
4132200	CIF	C84 H68 Al2 F48 N4 O8	P -1	14.1081; 15.6055; 21.8291 81.4403; 83.4804; 81.0841	4674.8	Wang, Wenqing; Chen, Chao; Shu, Chan; Rajca, Suchada; Wang, Xinping; Rajca, Andrzej S = 1 Tetraazacyclophane Diradical Dication with Robust Stability: A Case of Low-Temperature One-Dimensional Antiferromagnetic Chain. Journal of the American Chemical Society, 2018, 140, 7820-7826
4132201	CIF	C33 H24 F7 Ir N4	P 1 21/c 1	10.6293; 19.9421; 13.7025 90; 99.2721; 90	2866.6	Na, Hanah; Teets, Thomas S. Highly Luminescent Cyclometalated Iridium Complexes Generated by Nucleophilic Addition to Coordinated Isocyanides. Journal of the American Chemical Society, 2018, 140, 6353-6360
4132202	CIF	C33 H26 F4 Ir N5 O2	P 1 21/n 1	11.392; 21.133; 13.834 90; 94.876; 90	3318	Na, Hanah; Teets, Thomas S. Highly Luminescent Cyclometalated Iridium Complexes Generated by Nucleophilic Addition to Coordinated Isocyanides. Journal of the American Chemical Society, 2018, 140, 6353-6360
4132203	CIF	C35 H30 F4 Ir N5 O2	P 1 21/c 1	16.7013; 11.2843; 18.1118 90; 113.543; 90	3129.3	Na, Hanah; Teets, Thomas S. Highly Luminescent Cyclometalated Iridium Complexes Generated by Nucleophilic Addition to Coordinated Isocyanides. Journal of the American Chemical Society, 2018, 140, 6353-6360
4132204	CIF	C36 H27.5 Cl2.5 Ir N5 O2 S2	C 1 c 1	23.9379; 11.9202; 15.6551 90; 130.05; 90	3419.5	Na, Hanah; Teets, Thomas S. Highly Luminescent Cyclometalated Iridium Complexes Generated by Nucleophilic Addition to Coordinated Isocyanides. Journal of the American Chemical Society, 2018, 140, 6353-6360
4132205	CIF	C74 H32 Cl32 N4 O16 Ru4	P -1	10.98; 14.58; 15.9 94.5; 99.7; 102.6	2431	Zhang, Jun; Kosaka, Wataru; Sugimoto, Kunihisa; Miyasaka, Hitoshi Magnetic Sponge Behavior via Electronic State Modulations. Journal of the American Chemical Society, 2018, 140, 5644-5652
4132206	CIF	C70 H24 Cl24 N4 O16 Ru4	P -1	11.044; 14.043; 16.207 95.936; 99.486; 109.482	2303.1	Zhang, Jun; Kosaka, Wataru; Sugimoto, Kunihisa; Miyasaka, Hitoshi Magnetic Sponge Behavior via Electronic State Modulations. Journal of the American Chemical Society, 2018, 140, 5644-5652
4132207	CIF	C72 H28 Cl28 N4 O16 Ru4	P -1	11.002; 14.584; 15.965 95.065; 99.399; 103.745	2433.2	Zhang, Jun; Kosaka, Wataru; Sugimoto, Kunihisa; Miyasaka, Hitoshi Magnetic Sponge Behavior via Electronic State Modulations. Journal of the American Chemical Society, 2018, 140, 5644-5652
4132208	CIF	C70 H24 Cl24 N4 O16 Ru4	P -1	11.008; 13.982; 16.198 96.129; 99.372; 109.695	2280.6	Zhang, Jun; Kosaka, Wataru; Sugimoto, Kunihisa; Miyasaka, Hitoshi Magnetic Sponge Behavior via Electronic State Modulations. Journal of the American Chemical Society, 2018, 140, 5644-5652
4132209	CIF	C15 H13 N3 O8	P -1	7.467; 9.997; 11.538 80.37; 85.46; 71.51	805	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132210	CIF	C14 H11 N3 O8	P 1 21/c 1	8.209; 11.582; 15.675 90; 100.525; 90	1465.3	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132211	CIF	C15 H13 N3 O7	P 1 21/c 1	6.471; 17.119; 13.9 90; 98.322; 90	1523.6	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132212	CIF	C15 H14 N2 O6	P -1	7.806; 10.767; 17.948 80.47; 86.02; 78.432	1456	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132213	CIF	C14 H12 N2 O6	P 1 21/n 1	7.3427; 16.733; 11.153 90; 97.192; 90	1359.5	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132214	CIF	C15 H14 N2 O5	P 1 21/c 1	3.821; 33.53; 11.226 90; 98.496; 90	1422	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132215	CIF	C15 H14 N2 O5	P 1 21/n 1	7.55; 16.276; 11.939 90; 98.124; 90	1452	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132216	CIF	C15 H12 N2 O4	P 1 21/c 1	5.341; 31.98; 8.406 90; 93.563; 90	1433	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132217	CIF	C14 H12 N4 O10	P 1 21/n 1	7.033; 8.877; 27.155 90; 91.544; 90	1694.7	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132218	CIF	C15 H11 Cl N2 O3	P 1 21/c 1	3.832; 30.51; 11.789 90; 90.809; 90	1378	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132219	CIF	C23 H24 N2 O7	P 1 21/c 1	23.138; 9.93; 9.613 90; 95.908; 90	2197	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132220	CIF	C15 H18 N O4	P -1	6.315; 7.061; 15.048 85.167; 83.67; 81.671	658.3	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132221	CIF	C14 H14 N2 O4	P 1 21/c 1	3.936; 15.88; 20.64 90; 90.518; 90	1290	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132222	CIF	C14 H12 Cl N O4	P -1	3.909; 13.08; 13.52 105.33; 90.581; 92.2	666	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132223	CIF	C14 H12 N2 O6	P 1 21/c 1	7.35; 20.77; 9.208 90; 106.107; 90	1351	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132224	CIF	C14 H11 N3 O8	P 1 21/c 1	7.125; 8.363; 25.54 90; 97.922; 90	1507	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132225	CIF	C14 H12 Cl N O4	P -1	6.358; 6.932; 14.993 87.16; 83.62; 81.62	649.3	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132226	CIF	C14 H12 N2 O6	P -1	6.451; 6.728; 15.3 88.57; 84.457; 82.348	655	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132227	CIF	C14 H11 N3 O8	P 1 21/c 1	13.7006; 14.0075; 16.8978 90; 115.615; 90	2924.2	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132228	CIF	C14 H14 N4 O8	P 1 21/c 1	7.075; 16.73; 27.134 90; 95.336; 90	3198	Saha, Subhankar; Desiraju, Gautam R. Acid···Amide Supramolecular Synthon in Cocrystals: From Spectroscopic Detection to Property Engineering. Journal of the American Chemical Society, 2018, 140, 6361-6373
4132229	CIF	C80 H125 As3 Ga2 N4	P -1	12.5436; 12.6964; 23.2297 101.867; 90.763; 100.14	3559.2	Helling, Christoph; Wölper, Christoph; Schulz, Stephan Synthesis of a Gallaarsene {HC[C(Me)N-2,6- i-Pr<sub>2</sub>-C<sub>6</sub>H<sub>3</sub>]<sub>2</sub>}GaAsCp* Containing a Ga═As Double Bond. Journal of the American Chemical Society, 2018, 140, 5053-5056
4132230	CIF	C39 H56 As Ga N2	P -1	11.8364; 18.1069; 18.3359 87.481; 81.731; 73.919	3736.7	Helling, Christoph; Wölper, Christoph; Schulz, Stephan Synthesis of a Gallaarsene {HC[C(Me)N-2,6- i-Pr<sub>2</sub>-C<sub>6</sub>H<sub>3</sub>]<sub>2</sub>}GaAsCp* Containing a Ga═As Double Bond. Journal of the American Chemical Society, 2018, 140, 5053-5056
4132231	CIF	C20 H19 F3 N2 O3	C 1 2/c 1	11.47072; 9.95859; 33.1143 90; 96.5187; 90	3758.26	Zhang, Linmeng; Zhang, Xiaocui; Yao, Zhuojun; Jiang, Shichao; Deng, Jiajie; Li, Bo; Yu, Zhipeng Discovery of Fluorogenic Diarylsydnone-Alkene Photoligation: Conversion of ortho-Dual-Twisted Diarylsydnones into Planar Pyrazolines. Journal of the American Chemical Society, 2018, 140, 7390-7394
4132232	CIF	C17 H14 F3 N3 O2	P 1 21/c 1	8.6341; 15.3202; 12.6571 90; 104.38; 90	1621.78	Zhang, Linmeng; Zhang, Xiaocui; Yao, Zhuojun; Jiang, Shichao; Deng, Jiajie; Li, Bo; Yu, Zhipeng Discovery of Fluorogenic Diarylsydnone-Alkene Photoligation: Conversion of ortho-Dual-Twisted Diarylsydnones into Planar Pyrazolines. Journal of the American Chemical Society, 2018, 140, 7390-7394
4132233	CIF	C30 H22 N2 O9	P 1 21/c 1	10.0804; 20.9776; 12.4916 90; 98.816; 90	2610.3	Zhang, Linmeng; Zhang, Xiaocui; Yao, Zhuojun; Jiang, Shichao; Deng, Jiajie; Li, Bo; Yu, Zhipeng Discovery of Fluorogenic Diarylsydnone-Alkene Photoligation: Conversion of ortho-Dual-Twisted Diarylsydnones into Planar Pyrazolines. Journal of the American Chemical Society, 2018, 140, 7390-7394
4132234	CIF	C16 H11 F3 N2 O3	P -1	7.4972; 10.1381; 11.0921 71.133; 70.386; 78.79	748	Zhang, Linmeng; Zhang, Xiaocui; Yao, Zhuojun; Jiang, Shichao; Deng, Jiajie; Li, Bo; Yu, Zhipeng Discovery of Fluorogenic Diarylsydnone-Alkene Photoligation: Conversion of ortho-Dual-Twisted Diarylsydnones into Planar Pyrazolines. Journal of the American Chemical Society, 2018, 140, 7390-7394
4132235	CIF	C59 H91 Cu3 K N6 O3.5 Se	P n a 21	23.631; 13.8788; 18.5349 90; 90; 90	6078.9	Cook, Brian J.; Di Francesco, Gianna N.; Abboud, Khalil A.; Murray, Leslie J. Countercations and Solvent Influence CO<sub>2</sub> Reduction to Oxalate by Chalcogen-Bridged Tricopper Cyclophanates. Journal of the American Chemical Society, 2018, 140, 5696-5700
4132236	CIF	C61 H95 Cu3 K N6 O4 S	P n a 21	23.4096; 13.726; 18.4332 90; 90; 90	5923	Cook, Brian J.; Di Francesco, Gianna N.; Abboud, Khalil A.; Murray, Leslie J. Countercations and Solvent Influence CO<sub>2</sub> Reduction to Oxalate by Chalcogen-Bridged Tricopper Cyclophanates. Journal of the American Chemical Society, 2018, 140, 5696-5700
4132237	CIF	C16 H15 Br O7	P 21 21 21	5.6776; 14.2324; 19.406 90; 90; 90	1568.12	Wu, Xiaowei; Iwata, Takayuki; Scharf, Adam; Qin, Tian; Reichl, Kyle D.; Porco, Jr, John A Asymmetric Synthesis of Gonytolide A: Strategic Use of an Aryl Halide Blocking Group for Oxidative Coupling. Journal of the American Chemical Society, 2018, 140, 5969-5975
4132238	CIF	C32 H30 O14.05	P 1 21/c 1	12.8266; 13.9034; 16.8142 90; 101.097; 90	2942.5	Wu, Xiaowei; Iwata, Takayuki; Scharf, Adam; Qin, Tian; Reichl, Kyle D.; Porco, Jr, John A Asymmetric Synthesis of Gonytolide A: Strategic Use of an Aryl Halide Blocking Group for Oxidative Coupling. Journal of the American Chemical Society, 2018, 140, 5969-5975
4132239	CIF	C32 H44 Si6	P b c a	19.3814; 16.8448; 21.1946 90; 90; 90	6919.52	Marro, Eric A.; Press, Eric M.; Siegler, Maxime A.; Klausen, Rebekka S. Directional Building Blocks Determine Linear and Cyclic Silicon Architectures. Journal of the American Chemical Society, 2018, 140, 5976-5986
4132240	CIF	C22 H29 N O2	P 21 21 21	7.7684; 10.9017; 21.8627 90; 90; 90	1851.53	Zhang, Xingjie; Xie, Xin; Liu, Yuanhong Nickel-Catalyzed Highly Regioselective Hydrocyanation of Terminal Alkynes with Zn(CN)<sub>2</sub> Using Water as the Hydrogen Source. Journal of the American Chemical Society, 2018, 140, 7385-7389
4132241	CIF	C18 H18 N2	P 1 21 1	8.57436; 6.43605; 13.5714 90; 97.6815; 90	742.22	Wang, Yin-Xia; Qi, Shao-Long; Luan, Yu-Xin; Han, Xing-Wang; Wang, Shan; Chen, Hao; Ye, Mengchun Enantioselective Ni-Al Bimetallic Catalyzed exo-Selective C-H Cyclization of Imidazoles with Alkenes. Journal of the American Chemical Society, 2018, 140, 5360-5364
4132242	CIF	C19 H24 Cl N	P 1 21 1	10.8999; 5.6054; 13.3076 90; 91.6866; 90	812.72	Gribble, Jr, Michael W; Guo, Sheng; Buchwald, Stephen L. Asymmetric Cu-Catalyzed 1,4-Dearomatization of Pyridines and Pyridazines without Preactivation of the Heterocycle or Nucleophile. Journal of the American Chemical Society, 2018, 140, 5057-5060
4132243	CIF	C76 H98 Fe2 N2 O P4 S2 Si2	P 1 21/c 1	20.071; 17.5234; 21.7136 90; 106.65; 90	7316.7	Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. An S = <sup>1</sup>/<sub>2</sub> Iron Complex Featuring N<sub>2</sub>, Thiolate, and Hydride Ligands: Reductive Elimination of H<sub>2</sub> and Relevant Thermochemical Fe-H Parameters. Journal of the American Chemical Society, 2018, 140, 6374-6382
4132244	CIF	C43.83 H62.62 Fe Li N2 O2 P2 S Si	P c a 21	19.3145; 13.0291; 35.412 90; 90; 90	8911.4	Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. An S = <sup>1</sup>/<sub>2</sub> Iron Complex Featuring N<sub>2</sub>, Thiolate, and Hydride Ligands: Reductive Elimination of H<sub>2</sub> and Relevant Thermochemical Fe-H Parameters. Journal of the American Chemical Society, 2018, 140, 6374-6382
4132245	CIF	C51.96 H75.25 Fe Li N2 O6 P2 S Si	P 1 21/c 1	12.739; 19.956; 21.496 90; 105.629; 90	5262.7	Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. An S = <sup>1</sup>/<sub>2</sub> Iron Complex Featuring N<sub>2</sub>, Thiolate, and Hydride Ligands: Reductive Elimination of H<sub>2</sub> and Relevant Thermochemical Fe-H Parameters. Journal of the American Chemical Society, 2018, 140, 6374-6382
4132246	CIF	C36 H45 Fe N2 P2 S Si	P 1 21/c 1	15.8933; 12.1269; 17.6931 90; 91.91; 90	3408.2	Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. An S = <sup>1</sup>/<sub>2</sub> Iron Complex Featuring N<sub>2</sub>, Thiolate, and Hydride Ligands: Reductive Elimination of H<sub>2</sub> and Relevant Thermochemical Fe-H Parameters. Journal of the American Chemical Society, 2018, 140, 6374-6382
4132247	CIF	C56.55 H86.19 Fe N2 Na O8.45 P2 S Si	P 1 21/c 1	14.404; 20.067; 21.317 90; 109.234; 90	5817.6	Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. An S = <sup>1</sup>/<sub>2</sub> Iron Complex Featuring N<sub>2</sub>, Thiolate, and Hydride Ligands: Reductive Elimination of H<sub>2</sub> and Relevant Thermochemical Fe-H Parameters. Journal of the American Chemical Society, 2018, 140, 6374-6382
4132248	CIF	C38 H47 Fe N P2 S Si	P 1 21/n 1	10.1224; 16.4372; 21.1981 90; 99.32; 90	3480.5	Gu, Nina X.; Oyala, Paul H.; Peters, Jonas C. An S = <sup>1</sup>/<sub>2</sub> Iron Complex Featuring N<sub>2</sub>, Thiolate, and Hydride Ligands: Reductive Elimination of H<sub>2</sub> and Relevant Thermochemical Fe-H Parameters. Journal of the American Chemical Society, 2018, 140, 6374-6382
4132249	CIF	C11 H12 Cl I O	P 21 21 21	6.1297; 12.781; 14.79 90; 90; 90	1158.7	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132250	CIF	C64 H50 I2 N O3 P Si2	P 21 21 21	11.5142; 13.629; 33.558 90; 90; 90	5266.2	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132251	CIF	C18 H15 Br I P S	P 1 21/n 1	12.371; 9.374; 15.26 90; 95.279; 90	1762.1	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132252	CIF	C64 H50 N O3 P Si2	P 1 21 1	10.815; 9.2369; 25.431 90; 101.749; 90	2487.3	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132253	CIF	C74 H64 N O3 P Si2	P 1	9.079; 12.14; 14.018 78.003; 77.069; 81.756	1465.4	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132254	CIF	C18 H15 I3 P S	P -1	8.848; 9.559; 12.435 84.477; 74.428; 81.055	999.2	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132255	CIF	C21 H25 I O2	P 1 21 1	9.059; 9.733; 10.77 90; 102.591; 90	926.8	Lu, Yanhui; Nakatsuji, Hidefumi; Okumura, Yukimasa; Yao, Lu; Ishihara, Kazuaki Enantioselective Halo-oxy- and Halo-azacyclizations Induced by Chiral Amidophosphate Catalysts and Halo-Lewis Acids. Journal of the American Chemical Society, 2018, 140, 6039-6043
4132256	CIF	C82 H104 O12	P -1	12.867; 13.018; 13.291 95.741; 116.713; 104.68	1863.8	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132257	CIF	C74 H94 O12	P -1	11.1; 12.196; 14.06 93.34; 94.55; 102.22	1849	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132258	CIF	C74 H94 O12	I 1 2/a 1	24.6748; 12.5778; 26.133 90; 116.649; 90	7248.9	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132259	CIF	C74 H94 O12	P 1 21/n 1	11.5241; 12.903; 22.5069 90; 91.752; 90	3345.1	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132260	CIF	C55 H70 O10	P -1	12.6553; 14.9068; 15.8129 102.503; 108.766; 108.108	2513.2	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132261	CIF	C66 H84 O12	P -1	11.0743; 12.6665; 23.3275 86.472; 82.616; 71.064	3068.77	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132262	CIF	C63 H80 O10	P -1	12.6961; 20.7685; 21.3724 82.538; 89.865; 89.331	5587.3	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132263	CIF	C137.88 H174.85 O20	P -1	14.0646; 21.414; 21.8397 76.973; 84.468; 84.137	6356.6	Jie, Kecheng; Liu, Ming; Zhou, Yujuan; Little, Marc A.; Pulido, Angeles; Chong, Samantha Y.; Stephenson, Andrew; Hughes, Ashlea R.; Sakakibara, Fumiyasu; Ogoshi, Tomoki; Blanc, Frédéric; Day, Graeme M.; Huang, Feihe; Cooper, Andrew I. Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[ n]arene Crystals. Journal of the American Chemical Society, 2018, 140, 6921-6930
4132264	CIF	C27 H40 O7	P 61	11.3308; 11.3308; 34.3551 90; 90; 120	3819.82	Liu, Junyang; Wu, Jianlei; Fan, Jian-Hong; Yan, Xin; Mei, Guangjian; Li, Chuang-Chuang Asymmetric Total Synthesis of Cyclocitrinol. Journal of the American Chemical Society, 2018, 140, 5365-5369
4132265	CIF	C24 H38 O5	P 1 21 1	6.4359; 25.5852; 7.0724 90; 107.905; 90	1108.17	Liu, Junyang; Wu, Jianlei; Fan, Jian-Hong; Yan, Xin; Mei, Guangjian; Li, Chuang-Chuang Asymmetric Total Synthesis of Cyclocitrinol. Journal of the American Chemical Society, 2018, 140, 5365-5369
4132266	CIF	C42 H28 N4 O8 S4 Zn2	P -1	14.5894; 14.6248; 29.1828 100.657; 101.01; 90.253	6001.52	Hua, Carol; Doheny, Patrick W.; Ding, Bowen; Chan, Bun; Yu, Michelle; Kepert, Cameron J.; D'Alessandro, Deanna M Through-Space Intervalence Charge Transfer as a Mechanism for Charge Delocalization in Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 6622-6630
4132267	CIF	C33 H31 N5 O S2	P -1	10.469; 11.9902; 12.8629 111.386; 96.819; 98.464	1460.78	Hua, Carol; Doheny, Patrick W.; Ding, Bowen; Chan, Bun; Yu, Michelle; Kepert, Cameron J.; D'Alessandro, Deanna M Through-Space Intervalence Charge Transfer as a Mechanism for Charge Delocalization in Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 6622-6630
4132268	CIF	C64 H32 N8 O8 S6 Zn2	P c c 2	25.7763; 18.3697; 15.7324 90; 90; 90	7449.34	Hua, Carol; Doheny, Patrick W.; Ding, Bowen; Chan, Bun; Yu, Michelle; Kepert, Cameron J.; D'Alessandro, Deanna M Through-Space Intervalence Charge Transfer as a Mechanism for Charge Delocalization in Metal-Organic Frameworks. Journal of the American Chemical Society, 2018, 140, 6622-6630
4132269	CIF	C98 H88 N8	F d d 2	33.435; 18.32; 24.428 90; 90; 90	14963	Inoue, Yuki; Sakamaki, Daisuke; Tsutsui, Yusuke; Gon, Masayuki; Chujo, Yoshiki; Seki, Shu Hash-Mark-Shaped Azaacene Tetramers with Axial Chirality. Journal of the American Chemical Society, 2018, 140, 7152-7158
4132270	CIF	C94 H80 Cl4 N8	C 1 2/c 1	31.014; 15.951; 15.969 90; 103.327; 90	7687	Inoue, Yuki; Sakamaki, Daisuke; Tsutsui, Yusuke; Gon, Masayuki; Chujo, Yoshiki; Seki, Shu Hash-Mark-Shaped Azaacene Tetramers with Axial Chirality. Journal of the American Chemical Society, 2018, 140, 7152-7158
4132271	CIF	C26 H26 N2	C 1 2/c 1	24.051; 5.6437; 16.91 90; 122.885; 90	1927.5	Inoue, Yuki; Sakamaki, Daisuke; Tsutsui, Yusuke; Gon, Masayuki; Chujo, Yoshiki; Seki, Shu Hash-Mark-Shaped Azaacene Tetramers with Axial Chirality. Journal of the American Chemical Society, 2018, 140, 7152-7158
4132272	CIF	C87 H56 Cl2 N4 O4	P -1	11.5847; 15.8101; 19.4838 68.749; 75.104; 78.43	3191.21	Inoue, Yuki; Sakamaki, Daisuke; Tsutsui, Yusuke; Gon, Masayuki; Chujo, Yoshiki; Seki, Shu Hash-Mark-Shaped Azaacene Tetramers with Axial Chirality. Journal of the American Chemical Society, 2018, 140, 7152-7158
4132273	CIF	C104 H106 Cl12 N8 O3 Sb2	P 21 21 2	19.4101; 24.8072; 10.7401 90; 90; 90	5171.47	Inoue, Yuki; Sakamaki, Daisuke; Tsutsui, Yusuke; Gon, Masayuki; Chujo, Yoshiki; Seki, Shu Hash-Mark-Shaped Azaacene Tetramers with Axial Chirality. Journal of the American Chemical Society, 2018, 140, 7152-7158
4132274	CIF	C24 H30 F3 Ir O	P 1 21/c 1	11.5111; 23.1376; 8.0997 90; 90.967; 90	2156.96	Romanov-Michailidis, Fedor; Ravetz, Benjamin D.; Paley, Daniel W.; Rovis, Tomislav Ir(III)-Catalyzed Carbocarbation of Alkynes through Undirected Double C-H Bond Activation of Anisoles. Journal of the American Chemical Society, 2018, 140, 5370-5374
4132275	CIF	C20 H29 Ir O2 S	P -1	8.252; 9.1752; 26.1498 80.224; 89.855; 87.327	1949	Romanov-Michailidis, Fedor; Ravetz, Benjamin D.; Paley, Daniel W.; Rovis, Tomislav Ir(III)-Catalyzed Carbocarbation of Alkynes through Undirected Double C-H Bond Activation of Anisoles. Journal of the American Chemical Society, 2018, 140, 5370-5374
4132276	CIF	C44 H34 Cl4 F12 Ir2	P -1	13.5428; 18.8283; 18.9337 91.405; 108.247; 107.063	4347.1	Romanov-Michailidis, Fedor; Ravetz, Benjamin D.; Paley, Daniel W.; Rovis, Tomislav Ir(III)-Catalyzed Carbocarbation of Alkynes through Undirected Double C-H Bond Activation of Anisoles. Journal of the American Chemical Society, 2018, 140, 5370-5374
4132277	CIF	C100 H68 Cl8 F10 N4 Pd2	C 1 2/c 1	44.899; 12.1059; 16.7796 90; 100.249; 90	8974.9	Ke, Xian-Sheng; Hong, Yongseok; Lynch, Vincent M.; Kim, Dongho; Sessler, Jonathan L. Metal-Stabilized Quinoidal Dibenzo[ g, p]chrysene-Fused Bis-dicarbacorrole System. Journal of the American Chemical Society, 2018, 140, 7579-7586
4132278	CIF	C33 H35 Br2 N O5	P 1 21 1	9.3385; 9.8454; 17.075 90; 98.278; 90	1553.5	Mori, Keiji; Isogai, Ryo; Kamei, Yuto; Yamanaka, Masahiro; Akiyama, Takahiko Chiral Magnesium Bisphosphate-Catalyzed Asymmetric Double C(sp<sup>3</sup>)-H Bond Functionalization Based on Sequential Hydride Shift/Cyclization Process. Journal of the American Chemical Society, 2018, 140, 6203-6207
4132279	CIF	C24 H26 N3 O	I -4	17.4658; 17.4658; 15.8447 90; 90; 90	4833.5	Cao, Wei; Wang, Wei David; Xu, Hai-Sen; Sergeyev, Ivan V.; Struppe, Jochem; Wang, Xiaoling; Mentink-Vigier, Frederic; Gan, Zhehong; Xiao, Ming-Xing; Wang, Lu-Yao; Chen, Guo-Peng; Ding, San-Yuan; Bai, Shi; Wang, Wei Exploring Applications of Covalent Organic Frameworks: Homogeneous Reticulation of Radicals for Dynamic Nuclear Polarization. Journal of the American Chemical Society, 2018, 140, 6969-6977
4132280	CIF	C42 H84 Cl2 P2 Pt	P 1 21/c 1	15.8988; 13.9099; 20.4188 90; 93.141; 90	4508.8	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132281	CIF	C24 H48 Cl2 O6 P2 Pt	P -1	10.5573; 16.0058; 17.6476 94.62; 91.338; 97.183	2947.36	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132282	CIF	C30 H60 Cl2 O6 P2 Pt	R -3 c :H	27.366; 27.366; 26.318 90; 90; 120	17068.9	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132283	CIF	C66 H126 Cl2 P2 Pt	P 1 21/c 1	24.469; 13.88; 20.2636 90; 95.492; 90	6850.5	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132284	CIF	C54 H94 P2 Pt	P -1	13.1005; 13.3774; 15.5372 77.946; 79.853; 82.14	2607.05	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132285	CIF	C48 H96 Cl2 P2 Pt	P -1	14.0147; 18.709; 20.052 80.503; 87.995; 85.644	5169.3	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132286	CIF	C60 H120 Cl2 P2 Pt	P -1	13.8635; 18.4284; 25.106 83.861; 88.11; 86.673	6364.3	Joshi, Hemant; Kharel, Sugam; Ehnbom, Andreas; Skopek, Katrin; Hess, Gisela D.; Fiedler, Tobias; Hampel, Frank; Bhuvanesh, Nattamai; Gladysz, John A. Three-Fold Intramolecular Ring Closing Alkene Metatheses of Square Planar Complexes with cis Phosphorus Donor Ligands P(X(CH<sub>2</sub>) <sub>m</sub>CH═CH<sub>2</sub>)<sub>3</sub> (X = -, m = 5-10; X = O, m = 3-5): Syntheses, Structures, and Thermal Properties of Macrocyclic Dibridgehead Diphosphorus Complexes. Journal of the American Chemical Society, 2018, 140, 8463-8478
4132287	CIF	C30 H32 N2 O3 S	P 1 21/c 1	23.4195; 6.1479; 21.5093 90; 114.733; 90	2812.8	Kou, Xuezhen; Shao, Qihang; Ye, Chenghao; Yang, Guoqiang; Zhang, Wanbin Asymmetric Aza-Wacker-Type Cyclization of N-Ts Hydrazine-Tethered Tetrasubstituted Olefins: Synthesis of Pyrazolines Bearing One Quaternary or Two Vicinal Stereocenters. Journal of the American Chemical Society, 2018, 140, 7587-7597
4132288	CIF	C24 H26 N2 O2 S	P -1	7.826; 10.51; 14.886 73.77; 78.172; 69.098	1090.6	Kou, Xuezhen; Shao, Qihang; Ye, Chenghao; Yang, Guoqiang; Zhang, Wanbin Asymmetric Aza-Wacker-Type Cyclization of N-Ts Hydrazine-Tethered Tetrasubstituted Olefins: Synthesis of Pyrazolines Bearing One Quaternary or Two Vicinal Stereocenters. Journal of the American Chemical Society, 2018, 140, 7587-7597
4132289	CIF	C23 H28 N2 O2 S	C 1 2 1	34.1594; 8.4566; 15.1869 90; 91.752; 90	4385.03	Kou, Xuezhen; Shao, Qihang; Ye, Chenghao; Yang, Guoqiang; Zhang, Wanbin Asymmetric Aza-Wacker-Type Cyclization of N-Ts Hydrazine-Tethered Tetrasubstituted Olefins: Synthesis of Pyrazolines Bearing One Quaternary or Two Vicinal Stereocenters. Journal of the American Chemical Society, 2018, 140, 7587-7597
4132290	CIF	C24 H24 N2 O3 S	P 1 21 1	11.6237; 13.4549; 13.8736 90; 104.221; 90	2103.28	Kou, Xuezhen; Shao, Qihang; Ye, Chenghao; Yang, Guoqiang; Zhang, Wanbin Asymmetric Aza-Wacker-Type Cyclization of N-Ts Hydrazine-Tethered Tetrasubstituted Olefins: Synthesis of Pyrazolines Bearing One Quaternary or Two Vicinal Stereocenters. Journal of the American Chemical Society, 2018, 140, 7587-7597
4132291	CIF	C24 H24 N2 O2 S	P 21 21 21	11.557; 12.498; 14.777 90; 90; 90	2134.4	Kou, Xuezhen; Shao, Qihang; Ye, Chenghao; Yang, Guoqiang; Zhang, Wanbin Asymmetric Aza-Wacker-Type Cyclization of N-Ts Hydrazine-Tethered Tetrasubstituted Olefins: Synthesis of Pyrazolines Bearing One Quaternary or Two Vicinal Stereocenters. Journal of the American Chemical Society, 2018, 140, 7587-7597
4132292	CIF	C84.97 H52.97 Cl2.91 N12 S16	P -1	10.427; 18.683; 25.279 108.28; 97.96; 91.64	4617.4	Park, Jung Su; Park, Jihye; Yang, Yun Jae; Tran, Trang Thu; Kim, In Su; Sessler, Jonathan L. Disparate Downstream Reactions Mediated by an Ionically Controlled Supramolecular Tristate Switch. Journal of the American Chemical Society, 2018, 140, 7598-7604
4132293	CIF	C36 H56 N5	P -1	11.342; 11.983; 15.853 103.65; 104.69; 93.17	2010.1	Park, Jung Su; Park, Jihye; Yang, Yun Jae; Tran, Trang Thu; Kim, In Su; Sessler, Jonathan L. Disparate Downstream Reactions Mediated by an Ionically Controlled Supramolecular Tristate Switch. Journal of the American Chemical Society, 2018, 140, 7598-7604
4132294	CIF	C61 H46 Cl3 N4 S16	P 1 21/c 1	13.319; 38.199; 14.505 90; 112.908; 90	6798	Park, Jung Su; Park, Jihye; Yang, Yun Jae; Tran, Trang Thu; Kim, In Su; Sessler, Jonathan L. Disparate Downstream Reactions Mediated by an Ionically Controlled Supramolecular Tristate Switch. Journal of the American Chemical Society, 2018, 140, 7598-7604
4132295	CIF	C42 H18 F12	P b c n	13.1526; 19.5199; 12.3721 90; 90; 90	3176.38	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132296	CIF	C30 H26 F8 N4 O2	P -1	8.671; 8.9923; 9.2524 93.693; 100.002; 106.443	676.46	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132297	CIF	C12 H6 F4 N4	P 1 21/n 1	5.3834; 5.7482; 16.8992 90; 97.711; 90	518.21	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132298	CIF	C51 H12 F24 N6	C c c m	15.3843; 93.285; 53.37 90; 90; 90	76593	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132299	CIF	C32.42 H16.73 F12 N9.39 O1.64	C 1 2/c 1	19.161; 34.1885; 7.1304 90; 110.374; 90	4378.8	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132300	CIF	C51 H27 F16 N9 O	I b a m	7.5844; 15.3613; 37.013 90; 90; 90	4312.25	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132301	CIF	C21 H12 N6	P 1 21 1	9.57; 9.4056; 10.632 90; 106.84; 90	915.96	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132302	CIF	C14 H6 Cl2 F4 N6	P 1 21/n 1	7.2212; 12.973; 8.0959 90; 90.812; 90	758.35	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132303	CIF	C27.36 H7.44 F12 N12 O0.36	P -3	19.4179; 19.4179; 4.9668 90; 90; 120	1621.9	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132304	CIF	C18 H6 F8 N4	P 1 21/c 1	16.393; 14.535; 6.4865 90; 94.108; 90	1541.58	Hashim, Mohamed I.; Le, Ha T. M.; Chen, Teng-Hao; Chen, Yu-Sheng; Daugulis, Olafs; Hsu, Chia-Wei; Jacobson, Allan J.; Kaveevivitchai, Watchareeya; Liang, Xiao; Makarenko, Tatyana; Miljanić, Ognjen Š; Popovs, Ilja; Tran, Hung Vu; Wang, Xiqu; Wu, Chia-Hua; Wu, Judy I. Dissecting Porosity in Molecular Crystals: Influence of Geometry, Hydrogen Bonding, and [π···π] Stacking on the Solid-State Packing of Fluorinated Aromatics. Journal of the American Chemical Society, 2018, 140, 6014-6026
4132305	CIF	C21 H25 N O S	P 21 21 21	9.1114; 9.3977; 21.5596 90; 90; 90	1846.07	Picazo, Elias; Anthony, Sarah M.; Giroud, Maude; Simon, Adam; Miller, Margeaux A.; Houk, K. N.; Garg, Neil K. Arynes and Cyclic Alkynes as Synthetic Building Blocks for Stereodefined Quaternary Centers. Journal of the American Chemical Society, 2018, 140, 7605-7610
4132306	CIF	C14 H16 Br Mn N4 O3	P n m a	10.1113; 14.6016; 11.3834 90; 90; 90	1680.7	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132307	CIF	C27 H30 Mn N7 O7	P -1	9.2015; 10.7157; 15.6589 76.778; 74.207; 84.676	1445.5	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132308	CIF	C53 H49.5 Mn2 N7.5 O10.5	P 1 21/m 1	12.403; 33.488; 12.991 90; 96.43; 90	5362	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132309	CIF	C52 H48 Mn2 N7.5 O8.5	P 1 21/m 1	12.422; 33.152; 13.004 90; 95.44; 90	5331	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132310	CIF	C45 H52 Br0.5 Mn2 N6 O11	P 1 21/m 1	12.3848; 33.886; 12.8929 90; 99.101; 90	5342.7	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132311	CIF	C51.5 H45.5 Mn2 N7.5 O8.5	P 1 21/m 1	12.461; 33.626; 13.016 90; 96.09; 90	5423	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132312	CIF	C49.5 H45 Mn2 N7.5 O7.5	P 1 21/m 1	12.418; 32.716; 12.989 90; 94.42; 90	5261	Huxley, Michael T.; Burgun, Alexandre; Ghodrati, Hanieh; Coghlan, Campbell J.; Lemieux, Anthony; Champness, Neil R.; Huang, David M.; Doonan, Christian J.; Sumby, Christopher J. Protecting-Group-Free Site-Selective Reactions in a Metal-Organic Framework Reaction Vessel. Journal of the American Chemical Society, 2018, 140, 6416-6425
4132313	CIF	C28.04 H47 B Cl1.02 Mo N6 O4.04 P	P 1 21/c 1	13.9014; 11.8934; 20.261 90; 91.068; 90	3349.3	Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198
4132314	CIF	C30 H56 B Mo N6 Na O7 P	P 1 21/c 1	17.2762; 14.4377; 16.8995 90; 114.912; 90	3823	Ghana, Priyabrata; Arz, Marius I.; Chakraborty, Uttam; Schnakenburg, Gregor; Filippou, Alexander C. Linearly Two-Coordinated Silicon: Transition Metal Complexes with the Functional Groups M≡Si-M and M═Si═M. Journal of the American Chemical Society, 2018, 140, 7187-7198