Crystallography Open Database
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Searching volume of publication is 9
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4511176 | CIF | C162 H96 O12 | P -1 | 18.262; 18.663; 19.717 84.807; 74.192; 69.421 | 6053.2 | Makha, Mohamed; Scott, Janet L.; Strauss, Christopher R.; Sobolev, Alexandre N.; Raston, Colin L. Fullerene Inclusion Based on Horning-Crown Macrocycles Crystal Growth & Design, 2009, 9, 483 |
| 4511177 | CIF | C13 H16 Cl2 N5 O3 S | P 1 21/c 1 | 11.189; 10.705; 15.981 90; 109.35; 90 | 1806 | Galcera, Judit; Molins, Elies Effect of the Counterion on the Solubility of Isostructural Pharmaceutical Lamotrigine Salts Crystal Growth & Design, 2009, 9, 327 |
| 4511178 | CIF | C14 H16 Cl2 N5 O4 | P 1 21/c 1 | 11.319; 10.574; 15.836 90; 109.864; 90 | 1782.6 | Galcera, Judit; Molins, Elies Effect of the Counterion on the Solubility of Isostructural Pharmaceutical Lamotrigine Salts Crystal Growth & Design, 2009, 9, 327 |
| 4511179 | CIF | C13 H15 Cl2 N5 O3 S | P 1 21/n 1 | 10.847; 10.923; 15.877 90; 109.062; 90 | 1778 | Galcera, Judit; Molins, Elies Effect of the Counterion on the Solubility of Isostructural Pharmaceutical Lamotrigine Salts Crystal Growth & Design, 2009, 9, 327 |
| 4511180 | CIF | C13 H16 Cl2 N5 O4 S | P 1 21/c 1 | 11.249; 11.033; 15.8 90; 108.4; 90 | 1860.69 | Galcera, Judit; Molins, Elies Effect of the Counterion on the Solubility of Isostructural Pharmaceutical Lamotrigine Salts Crystal Growth & Design, 2009, 9, 327 |
| 4511181 | CIF | C18 H23 N3 Ni O5 | P 1 21/c 1 | 8.646; 15.702; 14.241 90; 106.772; 90 | 1851.1 | Krishnan, Subhashree Mallika; Supkowski, Ronald M.; LaDuca, Robert L. Generation of Three-Dimensional Networks through Aliphatic Chain Disorder in a Divalent Metal Dicarboxylate/Organodiimine Coordination Polymer System Crystal Growth & Design, 2009, 9, 358 |
| 4511182 | CIF | C52 H44 Mn3 N4 O12 | P 43 | 18.7991; 18.7991; 13.8136 90; 90; 90 | 4881.81 | Mukherjee, Sudarshana; Lan, Yanhua; Kostakis, George E.; Clérac, Rodolphe; Anson, Christopher E.; Powell, Annie K. Influence of Water Ligands on Structural Diversity: From a One-Dimensional Linear Coordination Polymer to Three-Dimensional Ferrimagnetic Diamondoid Metal−Organic Frameworks Crystal Growth & Design, 2009, 9, 577 |
| 4511183 | CIF | C53 H51 Mn3 N4 O14 | I 41 | 18.966; 18.966; 13.9262 90; 90; 90 | 5009.4 | Mukherjee, Sudarshana; Lan, Yanhua; Kostakis, George E.; Clérac, Rodolphe; Anson, Christopher E.; Powell, Annie K. Influence of Water Ligands on Structural Diversity: From a One-Dimensional Linear Coordination Polymer to Three-Dimensional Ferrimagnetic Diamondoid Metal−Organic Frameworks Crystal Growth & Design, 2009, 9, 577 |
| 4511184 | CIF | C53 H52 Mn3 N4 O15 | P 1 21/c 1 | 18.888; 13.7658; 20.054 90; 93.78; 90 | 5202.9 | Mukherjee, Sudarshana; Lan, Yanhua; Kostakis, George E.; Clérac, Rodolphe; Anson, Christopher E.; Powell, Annie K. Influence of Water Ligands on Structural Diversity: From a One-Dimensional Linear Coordination Polymer to Three-Dimensional Ferrimagnetic Diamondoid Metal−Organic Frameworks Crystal Growth & Design, 2009, 9, 577 |
| 4511185 | CIF | C58 H64 Mn3 N4 O16 | P -1 | 11.8534; 12.5635; 19.53 82.457; 83.345; 85.861 | 2859 | Mukherjee, Sudarshana; Lan, Yanhua; Kostakis, George E.; Clérac, Rodolphe; Anson, Christopher E.; Powell, Annie K. Influence of Water Ligands on Structural Diversity: From a One-Dimensional Linear Coordination Polymer to Three-Dimensional Ferrimagnetic Diamondoid Metal−Organic Frameworks Crystal Growth & Design, 2009, 9, 577 |
| 4511186 | CIF | C20 H18 N2 O5 | P -1 | 10.032; 12.661; 14.354 80.165; 79.963; 89.973 | 1768.1 | Seaton, Colin C.; Parkin, Andrew; Wilson, Chick C.; Blagden, Nicholas Controlling the Formation of Benzoic Acid: Isonicotinamide Molecular Complexes Crystal Growth & Design, 2009, 9, 47 |
| 4511187 | CIF | C6 H8 N2 O2 | P 1 21/n 1 | 7.421; 10.817; 16.663 90; 93.097; 90 | 1335.6 | Seaton, Colin C.; Parkin, Andrew; Wilson, Chick C.; Blagden, Nicholas Controlling the Formation of Benzoic Acid: Isonicotinamide Molecular Complexes Crystal Growth & Design, 2009, 9, 47 |
| 4511188 | CIF | C8 H14 N4 O5 | C 1 2/c 1 | 25.9; 5.4215; 18.4291 90; 124.027; 90 | 2144.7 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511189 | CIF | C16 H32 N4 O6 | P 1 21/c 1 | 7.9086; 30.211; 17.531 90; 98.182; 90 | 4146 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511190 | CIF | C17 H32 N10 O10 S | P -1 | 10.4299; 11.3508; 12.0925 108.958; 93.422; 96.179 | 1339.2 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511191 | CIF | C22 H51 N9 O6 S2 | P n n a | 14.713; 29.325; 14.9917 90; 90; 90 | 6468.3 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511192 | CIF | C17 H38 N6 O7 S | C 1 c 1 | 8.5791; 17.024; 17.691 90; 91.549; 90 | 2582.8 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511193 | CIF | C41 H82 N10 O11 S | P -1 | 8.2667; 17.553; 20.357 65.06; 81.386; 78.292 | 2615.9 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511194 | CIF | C14 H34 N8 O9 | P 1 21/c 1 | 10.13; 14.666; 15.268 90; 95.243; 90 | 2258.8 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511195 | CIF | C18 H38 N8 O7 | P 1 21/n 1 | 16.363; 8.8426; 18.128 90; 103.901; 90 | 2546.1 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511196 | CIF | C21 H46 N6 O8 | C 1 c 1 | 13.2716; 13.3676; 15.7087 90; 91.337; 90 | 2786.1 | Han, Jie; Zhao, Liang; Yau, Chung-Wah; Mak, Thomas C. W. Hydrogen-Bonded Networks Constructed with 5-Nitrobarbiturate Crystal Growth & Design, 2009, 9, 308 |
| 4511197 | CIF | C41 H30 N4 | C 1 2/c 1 | 28.9524; 9.6748; 23.3609 90; 110.835; 90 | 6115.7 | Gao, Yuan-Hao; Zhou, Wen; Li, Lin; Wu, Jie-Ying; Zhou, Hong-Ping; Yang, Jia-Xiang; Tian, Yu-Peng Polymorphism in a Highly Conjugated Organic Compound: Strong Photoelectric Response Crystal Growth & Design, 2009, 9, 253-257 |
| 4511198 | CIF | C41 H30 N4 | P 1 21/c 1 | 17.181; 10.101; 18.512 90; 103.659; 90 | 3122 | Gao, Yuan-Hao; Zhou, Wen; Li, Lin; Wu, Jie-Ying; Zhou, Hong-Ping; Yang, Jia-Xiang; Tian, Yu-Peng Polymorphism in a Highly Conjugated Organic Compound: Strong Photoelectric Response Crystal Growth & Design, 2009, 9, 253-257 |
| 4512593 | CIF | C84.65 H64.98 F24 N8.33 P4 | P 4/n | 34.0574; 34.0574; 6.9475 90; 90; 90 | 8058.5 | Hartlieb, Karel J.; Witus, Leah S.; Ferris, Daniel P.; Basuray, Ashish N.; Algaradah, Mohammed M.; Sarjeant, Amy A.; Stern, Charlotte L.; Nassar, Majed S.; Botros, Youssry Y.; Stoddart, J. Fraser Anticancer activity expressed by a library of 2,9-diazaperopyrenium dications. ACS nano, 2015, 9, 1461-1470 |
| 4512594 | CIF | C98 H96 F36 N8 O16 P6 | C 1 c 1 | 35.4484; 10.5194; 29.0669 90; 109.864; 90 | 10194 | Hartlieb, Karel J.; Witus, Leah S.; Ferris, Daniel P.; Basuray, Ashish N.; Algaradah, Mohammed M.; Sarjeant, Amy A.; Stern, Charlotte L.; Nassar, Majed S.; Botros, Youssry Y.; Stoddart, J. Fraser Anticancer activity expressed by a library of 2,9-diazaperopyrenium dications. ACS nano, 2015, 9, 1461-1470 |
| 4512595 | CIF | C86 H67 F24 N9 P4 | P 1 21/c 1 | 7.3021; 13.6827; 39.2653 90; 95.246; 90 | 3906.7 | Hartlieb, Karel J.; Witus, Leah S.; Ferris, Daniel P.; Basuray, Ashish N.; Algaradah, Mohammed M.; Sarjeant, Amy A.; Stern, Charlotte L.; Nassar, Majed S.; Botros, Youssry Y.; Stoddart, J. Fraser Anticancer activity expressed by a library of 2,9-diazaperopyrenium dications. ACS nano, 2015, 9, 1461-1470 |
| 4512596 | CIF | C52 H52 F12 N4 P2 | P 1 21/n 1 | 11.4221; 13.2531; 15.8643 90; 99.1783; 90 | 2370.76 | Hartlieb, Karel J.; Witus, Leah S.; Ferris, Daniel P.; Basuray, Ashish N.; Algaradah, Mohammed M.; Sarjeant, Amy A.; Stern, Charlotte L.; Nassar, Majed S.; Botros, Youssry Y.; Stoddart, J. Fraser Anticancer activity expressed by a library of 2,9-diazaperopyrenium dications. ACS nano, 2015, 9, 1461-1470 |
| 4512894 | CIF | C15 H14 N2 S | P 21 21 21 | 5.8364; 11.1486; 19.6062 90; 90; 90 | 1275.73 | Mandal, Amal Kumar; Sreejith, Sivaramapanicker; He, Tingchao; Maji, Swarup Kumar; Wang, Xiao-Jun; Ong, Shi Li; Joseph, James; Sun, Handong; Zhao, Yanli Three-photon-excited luminescence from unsymmetrical cyanostilbene aggregates: morphology tuning and targeted bioimaging. ACS nano, 2015, 9, 4796-4805 |
| 4514022 | CIF | C28 H18 Co3 N14 O8 | P -1 | 9.2232; 9.4833; 9.9839 62.92; 86.045; 83.467 | 772.33 | Gong, Teng; Yang, Xiao; Fang, Jia-Jia; Sui, Qi; Xi, Fu-Gui; Gao, En-Qing Distinct Chromic and Magnetic Properties of Metal-Organic Frameworks with a Redox Ligand. ACS applied materials & interfaces, 2017, 9, 5503-5512 |
| 4514042 | CIF | C19 H17 Ag N8 O4 | P 1 21/n 1 | 10.45578; 14.5262; 14.2658 90; 105.018; 90 | 2092.72 | Li, Cheng-Peng; Liu, Bo-Lan; Wang, Lei; Liu, Yue; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao Tracking the Superefficient Anion Exchange of a Dynamic Porous Material Constructed by Ag(I) Nitrate and Tripyridyltriazole via Multistep Single-Crystal to Single-Crystal Transformations. ACS applied materials & interfaces, 2017, 9, 7202-7208 |
| 4514043 | CIF | C17 H12 Ag N7 O3 | P 1 21/n 1 | 9.7608; 18.2332; 10.4565 90; 110.843; 90 | 1739.2 | Li, Cheng-Peng; Liu, Bo-Lan; Wang, Lei; Liu, Yue; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao Tracking the Superefficient Anion Exchange of a Dynamic Porous Material Constructed by Ag(I) Nitrate and Tripyridyltriazole via Multistep Single-Crystal to Single-Crystal Transformations. ACS applied materials & interfaces, 2017, 9, 7202-7208 |
| 4514044 | CIF | C18 H13.5 Ag Mn0.84 N6.66 O3.84 | P 1 21/n 1 | 10.2824; 14.8893; 14.3004 90; 103.428; 90 | 2129.5 | Li, Cheng-Peng; Liu, Bo-Lan; Wang, Lei; Liu, Yue; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao Tracking the Superefficient Anion Exchange of a Dynamic Porous Material Constructed by Ag(I) Nitrate and Tripyridyltriazole via Multistep Single-Crystal to Single-Crystal Transformations. ACS applied materials & interfaces, 2017, 9, 7202-7208 |
| 4514045 | CIF | C18 H13.5 Ag Mn N6.5 O4 | P 1 21/n 1 | 10.263; 14.9415; 14.3242 90; 103.092; 90 | 2139.45 | Li, Cheng-Peng; Liu, Bo-Lan; Wang, Lei; Liu, Yue; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao Tracking the Superefficient Anion Exchange of a Dynamic Porous Material Constructed by Ag(I) Nitrate and Tripyridyltriazole via Multistep Single-Crystal to Single-Crystal Transformations. ACS applied materials & interfaces, 2017, 9, 7202-7208 |
| 4514046 | CIF | C17 H12 Ag Mn N6 O4 | P 1 21/n 1 | 9.3008; 18.1909; 11.4385 90; 108.077; 90 | 1839.75 | Li, Cheng-Peng; Liu, Bo-Lan; Wang, Lei; Liu, Yue; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao Tracking the Superefficient Anion Exchange of a Dynamic Porous Material Constructed by Ag(I) Nitrate and Tripyridyltriazole via Multistep Single-Crystal to Single-Crystal Transformations. ACS applied materials & interfaces, 2017, 9, 7202-7208 |
| 4514049 | CIF | C37 H32 Cd2 N5 O11 | P 1 21/c 1 | 16.704; 19.21; 18.532 90; 107.071; 90 | 5685 | Hong, Xu-Jia; Wei, Qin; Cai, Yue-Peng; Zheng, Sheng-Run; Yu, Ying; Fan, Yan-Zhong; Xu, Xian-Yan; Si, Li-Ping 2-Fold Interpenetrating Bifunctional Cd-Metal-Organic Frameworks: Highly Selective Adsorption for CO2 and Sensitive Luminescent Sensing of Nitro Aromatic 2,4,6-Trinitrophenol. ACS applied materials & interfaces, 2017, 9, 4701-4708 |
| 4514050 | CIF | C28 H28 Mn2 N8 O13 | C 1 2/c 1 | 19.453; 11.3613; 15.2963 90; 115.636; 90 | 3047.9 | Gong, Teng; Yang, Xiao; Fang, Jia-Jia; Sui, Qi; Xi, Fu-Gui; Gao, En-Qing Distinct Chromic and Magnetic Properties of Metal-Organic Frameworks with a Redox Ligand. ACS applied materials & interfaces, 2017, 9, 5503-5512 |
| 4514065 | CIF | C18 H10 O3 S2 | P -1 | 5.4841; 12.2105; 12.4889 63.407; 84.94; 89.691 | 744.37 | Ogawa, Yuta; Yamamoto, Kazuhiro; Miura, Chiyo; Tamura, Shigeki; Saito, Mitsuki; Mamada, Masashi; Kumaki, Daisuke; Tokito, Shizuo; Katagiri, Hiroshi Asymmetric Alkylthienyl Thienoacenes Derived from Anthra[2,3-b]thieno[2,3-d]thiophene for Solution-Processable Organic Semiconductors. ACS applied materials & interfaces, 2017, 9, 9902-9909 |
| 4514075 | CIF | C43 H37 F2 Ir N4 | P -1 | 9.7913; 13.4826; 14.3591 103.936; 97.168; 101.758 | 1770.77 | Li, Guomeng; Li, Ping; Zhuang, Xuming; Ye, Kaiqi; Liu, Yu; Wang, Yue Rational Design and Characterization of Heteroleptic Phosphorescent Complexes for Highly Efficient Deep-Red Organic Light-Emitting Devices. ACS applied materials & interfaces, 2017, 9, 11749-11758 |
| 4514076 | CIF | C46 H26 O16 Zr3 | I 41/a m d :2 | 20.707; 20.707; 66.9823 90; 90; 90 | 28720.7 | Wang, Bin; Yang, Qi; Guo, Chao; Sun, Yuxiu; Xie, Lin-Hua; Li, Jian-Rong Stable Zr(IV)-Based Metal-Organic Frameworks with Predesigned Functionalized Ligands for Highly Selective Detection of Fe(III) Ions in Water. ACS applied materials & interfaces, 2017, 9, 10286-10295 |
| 4514077 | CIF | C44 H24 N2 O16 Zr3 | I 41/a m d :2 | 20.6568; 20.6568; 66.6868 90; 90; 90 | 28455.5 | Wang, Bin; Yang, Qi; Guo, Chao; Sun, Yuxiu; Xie, Lin-Hua; Li, Jian-Rong Stable Zr(IV)-Based Metal-Organic Frameworks with Predesigned Functionalized Ligands for Highly Selective Detection of Fe(III) Ions in Water. ACS applied materials & interfaces, 2017, 9, 10286-10295 |
| 4514081 | CIF | C30 H26 F6 Ir N6 P | P b c a | 10.7476; 15.4502; 35.31 90; 90; 90 | 5863.32 | Chen, Mu-He; Wang, Fang-Xin; Cao, Jian-Jun; Tan, Cai-Ping; Ji, Liang-Nian; Mao, Zong-Wan Light-Up Mitophagy in Live Cells with Dual-Functional Theranostic Phosphorescent Iridium(III) Complexes. ACS applied materials & interfaces, 2017, 9, 13304-13314 |
| 4514082 | CIF | C26 H22 F6 Ir N6 P S2 | P b c a | 10.9606; 15.2789; 34.871 90; 90; 90 | 5839.7 | Chen, Mu-He; Wang, Fang-Xin; Cao, Jian-Jun; Tan, Cai-Ping; Ji, Liang-Nian; Mao, Zong-Wan Light-Up Mitophagy in Live Cells with Dual-Functional Theranostic Phosphorescent Iridium(III) Complexes. ACS applied materials & interfaces, 2017, 9, 13304-13314 |
| 4514092 | CIF | C22 H22 N4 O6 S2 Zn | C 1 2/m 1 | 24.404; 14.181; 9.304 90; 99.608; 90 | 3175 | Zhao, Yang; Xu, Xiaoyue; Qiu, Ling; Kang, Xiaojing; Wen, Lili; Zhang, Bingguang Metal-Organic Frameworks Constructed from a New Thiophene-Functionalized Dicarboxylate: Luminescence Sensing and Pesticide Removal. ACS applied materials & interfaces, 2017, 9, 15164 |
| 4514093 | CIF | C30.75 H22 Cd N3 O7 S2 | P 42 21 2 | 28.6987; 28.6987; 23.8 90; 90; 90 | 19602 | Zhao, Yang; Xu, Xiaoyue; Qiu, Ling; Kang, Xiaojing; Wen, Lili; Zhang, Bingguang Metal-Organic Frameworks Constructed from a New Thiophene-Functionalized Dicarboxylate: Luminescence Sensing and Pesticide Removal. ACS applied materials & interfaces, 2017, 9, 15164 |
| 4514097 | CIF | C43 H35 F4 Ir N4 | P -1 | 11.569; 12.3348; 13.6093 97.305; 94.433; 112.681 | 1760.32 | Li, Guomeng; Li, Ping; Zhuang, Xuming; Ye, Kaiqi; Liu, Yu; Wang, Yue Rational Design and Characterization of Heteroleptic Phosphorescent Complexes for Highly Efficient Deep-Red Organic Light-Emitting Devices. ACS applied materials & interfaces, 2017, 9, 11749-11758 |
| 4514098 | CIF | C10 H10 Cl2 N4 Pd | P 1 21/n 1 | 10.0173; 8.6586; 13.7906 90; 99.382; 90 | 1180.14 | Bhadra, Mohitosh; Sasmal, Himadri Sekhar; Basu, Arghya; Midya, Siba P.; Kandambeth, Sharath; Pachfule, Pradip; Balaraman, Ekambaram; Banerjee, Rahul Predesigned Metal-Anchored Building Block for In Situ Generation of Pd Nanoparticles in Porous Covalent Organic Framework: Application in Heterogeneous Tandem Catalysis. ACS applied materials & interfaces, 2017, 9, 13785-13792 |
| 4514099 | CIF | C15 H10 O2 | P 1 21/n 1 | 8.3515; 5.6087; 23.3147 90; 98.894; 90 | 1078.95 | Bhadra, Mohitosh; Sasmal, Himadri Sekhar; Basu, Arghya; Midya, Siba P.; Kandambeth, Sharath; Pachfule, Pradip; Balaraman, Ekambaram; Banerjee, Rahul Predesigned Metal-Anchored Building Block for In Situ Generation of Pd Nanoparticles in Porous Covalent Organic Framework: Application in Heterogeneous Tandem Catalysis. ACS applied materials & interfaces, 2017, 9, 13785-13792 |
| 4514134 | CIF | C19 H20 O6 | P b c a | 17.784; 7.5472; 25.281 90; 90; 90 | 3393.2 | Butler, Tristan; Mathew, Alexander S.; Sabat, Michal; Fraser, Cassandra L. Camera Method for Monitoring a Mechanochromic Luminescent β-Diketone Dye with Rapid Recovery. ACS applied materials & interfaces, 2017, 9, 17603-17612 |
| 4514135 | CIF | C85 H55 Cd2 N12 O10 | P -1 | 10.5207; 19.5694; 19.8195 85.567; 76.231; 85.878 | 3945.4 | Yang, Lirong; Lian, Chen; Li, Xuefei; Han, Yuyang; Yang, Lele; Cai, Ting; Shao, Caiyun Highly Selective Bifunctional Luminescent Sensor toward Nitrobenzene and Cu(2+) Ion Based on Microporous Metal-Organic Frameworks: Synthesis, Structures, and Properties. ACS applied materials & interfaces, 2017, 9, 17208-17217 |
| 4514174 | CIF | C42 H25 N18 O7 Zn3 | P 63/m m c | 16.7486; 16.7486; 19.0019 90; 90; 120 | 4616.2 | Chen, Di-Ming; Zhang, Nan-Nan; Liu, Chun-Sen; Du, Miao Dual-Emitting Dye@MOF Composite as a Self-Calibrating Sensor for 2,4,6-Trinitrophenol. ACS applied materials & interfaces, 2017, 9, 24671-24677 |
| 4514175 | CIF | C25 H15 Cu2 O8 | P 4/n m m | 18.906; 18.906; 13.6216 90; 90; 90 | 4868.9 | Chen, Ya; Wang, Bin; Wang, Xiaoqing; Xie, Lin-Hua; Li, Jinping; Xie, Yabo; Li, Jian-Rong A Copper(II)-Paddlewheel Metal-Organic Framework with Exceptional Hydrolytic Stability and Selective Adsorption and Detection Ability of Aniline in Water. ACS applied materials & interfaces, 2017, 9, 27027-27035 |
| 4514176 | CIF | C25 H19 Cu2 O10 | P 4/n m m | 18.8441; 18.8441; 13.4252 90; 90; 90 | 4767.3 | Chen, Ya; Wang, Bin; Wang, Xiaoqing; Xie, Lin-Hua; Li, Jinping; Xie, Yabo; Li, Jian-Rong A Copper(II)-Paddlewheel Metal-Organic Framework with Exceptional Hydrolytic Stability and Selective Adsorption and Detection Ability of Aniline in Water. ACS applied materials & interfaces, 2017, 9, 27027-27035 |
| 4514177 | CIF | C100 H168.96 Cu8 O86.48 | P 4/n m m | 18.9911; 18.9911; 13.4276 90; 90; 90 | 4842.8 | Chen, Ya; Wang, Bin; Wang, Xiaoqing; Xie, Lin-Hua; Li, Jinping; Xie, Yabo; Li, Jian-Rong A Copper(II)-Paddlewheel Metal-Organic Framework with Exceptional Hydrolytic Stability and Selective Adsorption and Detection Ability of Aniline in Water. ACS applied materials & interfaces, 2017, 9, 27027-27035 |
| 4514178 | CIF | C25 H26.2 Cu2 O13.6 | P 4/n m m | 18.917; 18.917; 13.5692 90; 90; 90 | 4855.8 | Chen, Ya; Wang, Bin; Wang, Xiaoqing; Xie, Lin-Hua; Li, Jinping; Xie, Yabo; Li, Jian-Rong A Copper(II)-Paddlewheel Metal-Organic Framework with Exceptional Hydrolytic Stability and Selective Adsorption and Detection Ability of Aniline in Water. ACS applied materials & interfaces, 2017, 9, 27027-27035 |
| 4514179 | CIF | C40 H27 Cu2 N2.5 O8 | P 4/n m m | 18.8487; 18.8487; 13.8659 90; 90; 90 | 4926.19 | Chen, Ya; Wang, Bin; Wang, Xiaoqing; Xie, Lin-Hua; Li, Jinping; Xie, Yabo; Li, Jian-Rong A Copper(II)-Paddlewheel Metal-Organic Framework with Exceptional Hydrolytic Stability and Selective Adsorption and Detection Ability of Aniline in Water. ACS applied materials & interfaces, 2017, 9, 27027-27035 |
| 4514180 | CIF | C456 H576 Cr24 O120 Si24 | I 4/m | 34.23; 34.23; 48.409 90; 90; 90 | 56720 | Park, Jinhee; Perry, Zachary; Chen, Ying-Pin; Bae, Jaeyeon; Zhou, Hong-Cai Chromium(II) Metal-Organic Polyhedra as Highly Porous Materials. ACS applied materials & interfaces, 2017, 9, 28064-28068 |
| 4514181 | CIF | C1.74 H2.33 Cl0.1 N0.46 O0.36 | P -1 | 11.5039; 13.4991; 13.6851 106.885; 108.723; 94.03 | 1894.35 | Piechowicz, Marek; Abney, Carter W.; Thacker, Nathan C.; Gilhula, James C.; Wang, Youfu; Veroneau, Samuel S.; Hu, Aiguo; Lin, Wenbin Successful Coupling of a Bis-Amidoxime Uranophile with a Hydrophilic Backbone for Selective Uranium Sequestration. ACS applied materials & interfaces, 2017, 9, 27894-27904 |
| 4514182 | CIF | C58 H70 N2 O2 S4 | P 1 21/n 1 | 19.841; 10.611; 24.928 90; 101.79; 90 | 5137.44 | Cole, Jacqueline M.; Blood-Forsythe, Martin A; Lin, Tze-Chia; Pattison, Philip; Gong, Yun; Vázquez-Mayagoitia, Álvaro; Waddell, Paul G.; Zhang, Lei; Koumura, Nagatoshi; Mori, Shogo Discovery of S···C≡N Intramolecular Bonding in a Thiophenylcyanoacrylate-Based Dye: Realizing Charge Transfer Pathways and Dye···TiO2 Anchoring Characteristics for Dye-Sensitized Solar Cells. ACS applied materials & interfaces, 2017, 9, 25952-25961 |
| 4514203 | CIF | C72 H91 Cu6 N13 O42 | P 4/m n c | 27.199; 27.199; 39.14 90; 90; 90 | 28955 | Liu, Bing; Yao, Shuo; Liu, Xinyao; Li, Xu; Krishna, Rajamani; Li, Guanghua; Huo, Qisheng; Liu, Yunling Two Analogous Polyhedron-Based MOFs with High Density of Lewis Basic Sites and Open Metal Sites: Significant CO2 Capture and Gas Selectivity Performance. ACS applied materials & interfaces, 2017, 9, 32820-32828 |
| 4514204 | CIF | C70 H83 Cu6 N13 O42 | P 4/m n c | 27.397; 27.397; 38.876 90; 90; 90 | 29180 | Liu, Bing; Yao, Shuo; Liu, Xinyao; Li, Xu; Krishna, Rajamani; Li, Guanghua; Huo, Qisheng; Liu, Yunling Two Analogous Polyhedron-Based MOFs with High Density of Lewis Basic Sites and Open Metal Sites: Significant CO2 Capture and Gas Selectivity Performance. ACS applied materials & interfaces, 2017, 9, 32820-32828 |
| 4514210 | CIF | C68 H48 O34 Zr6 | P 42/m m c | 23.874; 23.874; 15.894 90; 90; 90 | 9059 | Qin, Jun-Sheng; Yuan, Shuai; Alsalme, Ali; Zhou, Hong-Cai Flexible Zirconium MOF as the Crystalline Sponge for Coordinative Alignment of Dicarboxylates. ACS applied materials & interfaces, 2017, 9, 33408-33412 |
| 4514211 | CIF | C160 H104 O80 Zr12 | P 42/m m c | 23.637; 23.637; 16.995 90; 90; 90 | 9495 | Qin, Jun-Sheng; Yuan, Shuai; Alsalme, Ali; Zhou, Hong-Cai Flexible Zirconium MOF as the Crystalline Sponge for Coordinative Alignment of Dicarboxylates. ACS applied materials & interfaces, 2017, 9, 33408-33412 |
| 4514212 | CIF | C70 H52 O32 Zr6 | P 42/n c m :2 | 34.3258; 34.3258; 14.7063 90; 90; 90 | 17327.9 | Qin, Jun-Sheng; Yuan, Shuai; Alsalme, Ali; Zhou, Hong-Cai Flexible Zirconium MOF as the Crystalline Sponge for Coordinative Alignment of Dicarboxylates. ACS applied materials & interfaces, 2017, 9, 33408-33412 |
| 4514213 | CIF | C92 H48 O38 Zr6 | P 42/m m c | 23.6077; 23.608; 17.1351 90; 90; 90 | 9549.9 | Qin, Jun-Sheng; Yuan, Shuai; Alsalme, Ali; Zhou, Hong-Cai Flexible Zirconium MOF as the Crystalline Sponge for Coordinative Alignment of Dicarboxylates. ACS applied materials & interfaces, 2017, 9, 33408-33412 |
| 4514214 | CIF | C78 H56 N2 O34 Zr6 | P 42/n c m | 34.15; 34.153; 14.656 90; 90; 90 | 17094 | Qin, Jun-Sheng; Yuan, Shuai; Alsalme, Ali; Zhou, Hong-Cai Flexible Zirconium MOF as the Crystalline Sponge for Coordinative Alignment of Dicarboxylates. ACS applied materials & interfaces, 2017, 9, 33408-33412 |
| 4514215 | CIF | C72 H48 O36 Zr6 | P 42/m m c | 23.797; 23.797; 16.355 90; 90; 90 | 9262 | Qin, Jun-Sheng; Yuan, Shuai; Alsalme, Ali; Zhou, Hong-Cai Flexible Zirconium MOF as the Crystalline Sponge for Coordinative Alignment of Dicarboxylates. ACS applied materials & interfaces, 2017, 9, 33408-33412 |
| 4514228 | CIF | C20 H14 S3 | P -1 | 6.0134; 7.8064; 35.177 92.753; 93.386; 90.013 | 1646.5 | He, Keqiang; Li, Weili; Tian, Hongkun; Zhang, Jidong; Yan, Donghang; Geng, Yanhou; Wang, Fosong Asymmetric Conjugated Molecules Based on [1]Benzothieno[3,2-b][1]benzothiophene for High-Mobility Organic Thin-Film Transistors: Influence of Alkyl Chain Length. ACS applied materials & interfaces, 2017, 9, 35427-35436 |
| 4514229 | CIF | C25 H24 S3 | P -1 | 5.9301; 7.8096; 46.53 87.064; 88.436; 89.964 | 2151.25 | He, Keqiang; Li, Weili; Tian, Hongkun; Zhang, Jidong; Yan, Donghang; Geng, Yanhou; Wang, Fosong Asymmetric Conjugated Molecules Based on [1]Benzothieno[3,2-b][1]benzothiophene for High-Mobility Organic Thin-Film Transistors: Influence of Alkyl Chain Length. ACS applied materials & interfaces, 2017, 9, 35427-35436 |
| 4514230 | CIF | C22 H18 S3 | P -1 | 5.9656; 7.8049; 39.9337 91.6519; 90.1201; 90.0104 | 1858.57 | He, Keqiang; Li, Weili; Tian, Hongkun; Zhang, Jidong; Yan, Donghang; Geng, Yanhou; Wang, Fosong Asymmetric Conjugated Molecules Based on [1]Benzothieno[3,2-b][1]benzothiophene for High-Mobility Organic Thin-Film Transistors: Influence of Alkyl Chain Length. ACS applied materials & interfaces, 2017, 9, 35427-35436 |
| 4514254 | CIF | C32 H204 Cu6 N26 Na2 Ni7 O128 P6 W18 | P 1 21/n 1 | 18.0594; 18.7382; 19.9513 90; 97.174; 90 | 6698.7 | Zhang, Shuangshuang; Oms, Olivier; Hao, Long; Liu, Rongji; Wang, Meng; Zhang, Yaqin; He, Hong-Yan; Dolbecq, Anne; Marrot, Jérôme; Keita, Bineta; Zhi, Linjie; Mialane, Pierre; Li, Bin; Zhang, Guangjin High Oxygen Reduction Reaction Performances of Cathode Materials Combining Polyoxometalates, Coordination Complexes, and Carboneous Supports. ACS applied materials & interfaces, 2017, 9, 38486-38498 |
| 4514255 | CIF | C31 H27 N3 O5 | P -1 | 10.558; 11.152; 11.868 89.94; 86.75; 72.15 | 1327.8 | Xi, Guan; Sheng, Lan; Zhang, Ivan; Du, Jiahui; Zhang, Ting; Chen, Qiaonan; Li, Guiying; Zhang, Ying; Song, Yue; Li, Jianhua; Zhang, Yu-Mo; Zhang, Sean Xiao-An Endowing Hydrochromism to Fluorans via Bioinspired Alteration of Molecular Structures and Microenvironments and Expanding Their Potential for Rewritable Paper. ACS applied materials & interfaces, 2017, 9, 38032-38041 |
| 4514256 | CIF | C44 H38 Cd N8 O9 | P -1 | 9.4613; 10.6889; 20.2009 84.88; 80.566; 82.782 | 1994.4 | Maity, Kartik; Bhunia, Kousik; Pradhan, Debabrata; Biradha, Kumar Co(II)-Doped Cd-MOF as an Efficient Water Oxidation Catalyst: Doubly Interpenetrated Boron Nitride Network with the Encapsulation of Free Ligand Containing Pyridine Moieties. ACS applied materials & interfaces, 2017, 9, 37548-37553 |
| 4514257 | CIF | C90 H42 N12 O32 Zn8 | R -3 c :H | 24.4635; 24.4635; 112.996 90; 90; 120 | 58564 | Glomb, Sebastian; Woschko, Dennis; Makhloufi, Gamall; Janiak, Christoph Metal-Organic Frameworks with Internal Urea-Functionalized Dicarboxylate Linkers for SO2 and NH3 Adsorption. ACS applied materials & interfaces, 2017, 9, 37419-37434 |
| 4514258 | CIF | C102 H123 N17 O29 Zn4 | P 1 21 1 | 15.1669; 15.1542; 32.47 90; 99.162; 90 | 7367.8 | Glomb, Sebastian; Woschko, Dennis; Makhloufi, Gamall; Janiak, Christoph Metal-Organic Frameworks with Internal Urea-Functionalized Dicarboxylate Linkers for SO2 and NH3 Adsorption. ACS applied materials & interfaces, 2017, 9, 37419-37434 |
| 4514259 | CIF | C20 H12 N3 O5 Zn | C 1 2/m 1 | 24.2031; 18.0034; 13.998 90; 100.52; 90 | 5996.9 | Glomb, Sebastian; Woschko, Dennis; Makhloufi, Gamall; Janiak, Christoph Metal-Organic Frameworks with Internal Urea-Functionalized Dicarboxylate Linkers for SO2 and NH3 Adsorption. ACS applied materials & interfaces, 2017, 9, 37419-37434 |
| 4514260 | CIF | C42 H28 N6 O10 Zn2 | P -1 | 15.173; 15.232; 16.006 77.869; 80.918; 84.57 | 3564 | Glomb, Sebastian; Woschko, Dennis; Makhloufi, Gamall; Janiak, Christoph Metal-Organic Frameworks with Internal Urea-Functionalized Dicarboxylate Linkers for SO2 and NH3 Adsorption. ACS applied materials & interfaces, 2017, 9, 37419-37434 |
| 4514261 | CIF | C32 H100 Co4 N16 O44 | I 41/a m d :2 | 19.368; 19.368; 20.907 90; 90; 90 | 7843 | Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces, 2017, 9, 33521-33527 |
| 4514262 | CIF | C36 H102 Co4 N16 O41 | I 41/a m d :2 | 18.631; 18.631; 21.582 90; 90; 90 | 7491 | Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces, 2017, 9, 33521-33527 |
| 4514263 | CIF | C40 H106 Co4 N16 O39 | I 41/a m d :2 | 19.802; 19.802; 20.696 90; 90; 90 | 8115 | Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces, 2017, 9, 33521-33527 |
| 4514264 | CIF | C36 H102 Co4 N16 O41 | I 41/a m d :2 | 19.959; 19.959; 20.408 90; 90; 90 | 8130 | Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces, 2017, 9, 33521-33527 |
| 4514265 | CIF | C66 H30 Cu6 N0 O36 S3 | C m c m | 26.2639; 33.4313; 18.7507 90; 90; 90 | 16463.8 | Wang, Fei; Kusaka, Shinpei; Hijikata, Yuh; Hosono, Nobuhiko; Kitagawa, Susumu Development of a Porous Coordination Polymer with a High Gas Capacity Using a Thiophene-Based Bent Tetracarboxylate Ligand. ACS applied materials & interfaces, 2017, 9, 33455-33460 |
| 4514266 | CIF | C32 H24 Cr2 N4 Ni O7 | C 1 2/c 1 | 21.7531; 22.563; 8.8918 90; 112.228; 90 | 4039.9 | Scott, Hayley S.; Shivanna, Mohana; Bajpai, Alankriti; Madden, David G.; Chen, Kai-Jie; Pham, Tony; Forrest, Katherine A.; Hogan, Adam; Space, Brian; Perry Iv, John J.; Zaworotko, Michael J. Highly Selective Separation of C2H2 from CO2 by a New Dichromate-Based Hybrid Ultramicroporous Material. ACS applied materials & interfaces, 2017, 9, 33395-33400 |
| 4514267 | CIF | C74 H48 Co3 N13 O12 S2 | C 1 2/c 1 | 22.024; 27.633; 14.31 90; 104.42; 90 | 8435 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514268 | CIF | C86 H80 Co3 N16 O18 S2 | C 1 2/c 1 | 21.554; 27.53; 14.267 90; 102.58; 90 | 8263 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514269 | CIF | C78 H48 Co3 N12 O12 S2 | C 1 2/c 1 | 22.0413; 27.5063; 14.3847 90; 105.334; 90 | 8410.6 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514270 | CIF | C88 H70 Co3 N14 O14 S2 | C 1 2/c 1 | 21.839; 27.394; 14.628 90; 103.78; 90 | 8499 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514271 | CIF | C66 H48 Co3 N12 O15.25 S2 | C 1 2/c 1 | 22.904; 27.653; 24.028 90; 149.19; 90 | 7795 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514272 | CIF | C75.5 H53 Co3 N12 O17 S2 | P -1 | 12.585; 17.882; 18 100.378; 98.456; 97.805 | 3886 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514273 | CIF | C84 H48 Co3 N14 O14 S2 | C 1 2/c 1 | 21.8639; 27.4335; 14.4179 90; 104.099; 90 | 8387.4 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514274 | CIF | C88 H48 Co3 N16 O16 S2 | C 1 2/c 1 | 21.9027; 27.4875; 14.4136 90; 104.617; 90 | 8396.9 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514275 | CIF | C86 H52 Co3 N15 O15 S2 | C 1 2/c 1 | 22.0702; 27.4461; 14.1594 90; 105.325; 90 | 8272 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514276 | CIF | C89 H64 Co3 N15 O15 S2 | C 1 2/c 1 | 21.9628; 27.4453; 14.1306 90; 104.658; 90 | 8240.4 | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 35141-35149 |
| 4514295 | CIF | C30 H30 Cd2 Cl9 N20 O11.17 | R -3 m | 38.586; 38.586; 29.661 90; 90; 120 | 38245 | Yao, Yu-Qing; Zhang, Ying-Jie; Zhang, Yun-Qian; Tao, Zhu; Ni, Xin-Long; Wei, Gang Multiple Efficient Fluorescence Emission from Cucurbit[10]uril-[Cd4Cl16]8‒Based Pillared Diamond Porous Supramolecular Frameworks. ACS applied materials & interfaces, 2017, 9, 40760-40765 |
| 4514303 | CIF | C60 H46 Co3 N6 O14 | R -3 c | 37.914; 37.914; 29.541 90; 90; 120 | 36775 | Zhang, Tao; Hu, Yue-Qiao; Mo, Zong-Wen; Liao, Pei-Qin; Sakiyama, Hiroshi; Han, Tian; Chen, Xiao-Ming; Zheng, Yan-Zhen Cobalt(II) Magnetic Metal-Organic Framework with an Effective Kagomé Lattice, Large Surface Area, and High Spin-Canted Ordering Temperature. ACS applied materials & interfaces, 2017, 9, 38181-38186 |
| 4514304 | CIF | C6 H6 Au Cl F9 O3 P | P -1 | 11.1897; 13.3772; 18.9706 86.4062; 89.5645; 84.3179 | 2820.1 | Carden, Will G.; Pedziwiatr, Jakub; Abboud, Khalil A.; McElwee-White, Lisa Halide Effects on the Sublimation Temperature of X-Au-L Complexes: Implications for Their Use as Precursors in Vapor Phase Deposition Methods. ACS applied materials & interfaces, 2017, 9, 40998-41005 |
| 4514305 | CIF | C6 H18 Au Br N3 P | P n m a | 14.8743; 11.3479; 7.2893 90; 90; 90 | 1230.38 | Carden, Will G.; Pedziwiatr, Jakub; Abboud, Khalil A.; McElwee-White, Lisa Halide Effects on the Sublimation Temperature of X-Au-L Complexes: Implications for Their Use as Precursors in Vapor Phase Deposition Methods. ACS applied materials & interfaces, 2017, 9, 40998-41005 |
| 4514306 | CIF | C6 H6 Au F9 I O3 P | P 1 21/c 1 | 16.7653; 21.4245; 8.369 90; 99.527; 90 | 2964.6 | Carden, Will G.; Pedziwiatr, Jakub; Abboud, Khalil A.; McElwee-White, Lisa Halide Effects on the Sublimation Temperature of X-Au-L Complexes: Implications for Their Use as Precursors in Vapor Phase Deposition Methods. ACS applied materials & interfaces, 2017, 9, 40998-41005 |
| 4514307 | CIF | C6 H18 Au I N3 P | P n m a | 15.0773; 11.4116; 7.5983 90; 90; 90 | 1307.33 | Carden, Will G.; Pedziwiatr, Jakub; Abboud, Khalil A.; McElwee-White, Lisa Halide Effects on the Sublimation Temperature of X-Au-L Complexes: Implications for Their Use as Precursors in Vapor Phase Deposition Methods. ACS applied materials & interfaces, 2017, 9, 40998-41005 |
| 4514308 | CIF | C48 H46 Au8 Br8 F72 O24 P8 | P 1 21/n 1 | 12.816; 24.424; 36.1 90; 90.887; 90 | 11299 | Carden, Will G.; Pedziwiatr, Jakub; Abboud, Khalil A.; McElwee-White, Lisa Halide Effects on the Sublimation Temperature of X-Au-L Complexes: Implications for Their Use as Precursors in Vapor Phase Deposition Methods. ACS applied materials & interfaces, 2017, 9, 40998-41005 |
| 4514309 | CIF | C26 H16 N2 O8 Zn | P 1 21/c 1 | 10.1; 15.2; 14.3 90; 104.5; 90 | 2125.4 | Hu, Shuzhi; Zhang, Jie; Chen, Shuhuang; Dai, Jingcao; Fu, Zhiyong Efficient Ultraviolet Light Detector Based on a Crystalline Viologen-Based Metal-Organic Framework with Rapid Visible Color Change under Irradiation. ACS applied materials & interfaces, 2017, 9, 39926-39929 |
| 4514310 | CIF | Al16 Ba8 Si30 | P m -3 n | 10.5888; 10.5888; 10.5888 90; 90; 90 | 1187.24 | Zhao, Ran; Bobev, Svilen; Krishna, Lakshmi; Yang, Ting; Weller, J. Mark; Jing, Hangkun; Chan, Candace K. Anodes for Lithium-Ion Batteries Based on Type I Silicon Clathrate Ba8Al16Si30 - Role of Processing on Surface Properties and Electrochemical Behavior. ACS applied materials & interfaces, 2017, 9, 41246-41257 |
| 4514311 | CIF | C18 H16 Mn2 N2 O15 | P 1 21/c 1 | 7.591; 17.6666; 15.5193 90; 98.904; 90 | 2056.2 | Qin, Liang; Sun, Zi-Yan; Cheng, Kai; Liu, Shu-Wen; Pang, Jian-Xin; Xia, Li-Ming; Chen, Wen-Hua; Cheng, Zhen; Chen, Jin-Xiang Zwitterionic Manganese and Gadolinium Metal-Organic Frameworks as Efficient Contrast Agents for in Vivo Magnetic Resonance Imaging. ACS applied materials & interfaces, 2017, 9, 41378-41386 |
| 4514312 | CIF | C9 H17 Gd N2 O15 | P 1 21/n 1 | 10.1468; 15.5239; 10.5159 90; 102.202; 90 | 1619.02 | Qin, Liang; Sun, Zi-Yan; Cheng, Kai; Liu, Shu-Wen; Pang, Jian-Xin; Xia, Li-Ming; Chen, Wen-Hua; Cheng, Zhen; Chen, Jin-Xiang Zwitterionic Manganese and Gadolinium Metal-Organic Frameworks as Efficient Contrast Agents for in Vivo Magnetic Resonance Imaging. ACS applied materials & interfaces, 2017, 9, 41378-41386 |
| 4514313 | CIF | C46 H58 N4 Pt | C 2 2 21 | 14.0588; 27.7078; 21.3914 90; 90; 90 | 8332.8 | Bullock, James D.; Salehi, Amin; Zeman, 4th, Charles J; Abboud, Khalil A.; So, Franky; Schanze, Kirk S. In Search of Deeper Blues: Trans-N-Heterocyclic Carbene Platinum Phenylacetylide as a Dopant for Phosphorescent OLEDs. ACS applied materials & interfaces, 2017, 9, 41111-41114 |
| 4514329 | CIF | C16 H56 Br7.06 I2.94 N8 Sn | P -1 | 10.4611; 10.4724; 10.7499 81.643; 63.925; 74.142 | 1017.12 | Zhou, Chenkun; Tian, Yu; Yuan, Zhao; Lin, Haoran; Chen, Banghao; Clark, Ronald; Dilbeck, Tristan; Zhou, Yan; Hurley, Joseph; Neu, Jennifer; Besara, Tiglet; Siegrist, Theo; Djurovich, Peter; Ma, Biwu Highly Efficient Broadband Yellow Phosphor Based on Zero-Dimensional Tin Mixed-Halide Perovskite. ACS applied materials & interfaces, 2017, 9, 44579-44583 |
| 4514330 | CIF | C39 H29 Ho2 N O12 | P 6/m m m | 26.5159; 26.5159; 16.5671 90; 90; 120 | 10087.6 | Angeli, Giasemi K.; Sartsidou, Christina; Vlachaki, Styliani; Spanopoulos, Ioannis; Tsangarakis, Constantinos; Kourtellaris, Andreas; Klontzas, Emmanuel; Froudakis, George E.; Tasiopoulos, Anastasios; Trikalitis, Pantelis N. Reticular Chemistry and the Discovery of a New Family of Rare Earth (4, 8)-Connected Metal-Organic Frameworks with csq Topology Based on RE4(μ3-O)2(COO)8 Clusters. ACS applied materials & interfaces, 2017, 9, 44560-44566 |
| 4514331 | CIF | C39 H29 N O12 Y2 | P 6/m m m | 26.4725; 26.4725; 16.6116 90; 90; 120 | 10081.7 | Angeli, Giasemi K.; Sartsidou, Christina; Vlachaki, Styliani; Spanopoulos, Ioannis; Tsangarakis, Constantinos; Kourtellaris, Andreas; Klontzas, Emmanuel; Froudakis, George E.; Tasiopoulos, Anastasios; Trikalitis, Pantelis N. Reticular Chemistry and the Discovery of a New Family of Rare Earth (4, 8)-Connected Metal-Organic Frameworks with csq Topology Based on RE4(μ3-O)2(COO)8 Clusters. ACS applied materials & interfaces, 2017, 9, 44560-44566 |
| 4514406 | CIF | C52 H49 Cl2 I O2 P2 Pd | P 1 21 1 | 11.6182; 17.9333; 12.329 90; 115.788; 90 | 2312.95 | Batuecas, María; Luo, Junfei; Gergelitsová, Ivana; Krämer, Katrina; Whitaker, Daniel; Vitorica-Yrezabal, Iñigo J.; Larrosa, Igor Catalytic Asymmetric C‒H Arylation of (η6-Arene)Chromium Complexes: Facile Access to Planar-Chiral Phosphines ACS Catalysis, 2019, 9, 5268 |
| 4514407 | CIF | C37 H36 Cr N O5 P | P 21 21 21 | 7.15; 19.5691; 24.0399 90; 90; 90 | 3363.6 | Batuecas, María; Luo, Junfei; Gergelitsová, Ivana; Krämer, Katrina; Whitaker, Daniel; Vitorica-Yrezabal, Iñigo J.; Larrosa, Igor Catalytic Asymmetric C‒H Arylation of (η6-Arene)Chromium Complexes: Facile Access to Planar-Chiral Phosphines ACS Catalysis, 2019, 9, 5268 |
| 4514408 | CIF | C62 H74.56 Ag O4.78 P2 | I 1 2 1 | 11.7485; 26.0007; 18.5841 90; 106.036; 90 | 5456 | Batuecas, María; Luo, Junfei; Gergelitsová, Ivana; Krämer, Katrina; Whitaker, Daniel; Vitorica-Yrezabal, Iñigo J.; Larrosa, Igor Catalytic Asymmetric C–H Arylation of (η6-Arene)Chromium Complexes: Facile Access to Planar-Chiral Phosphines ACS Catalysis, 2019, 9, 5268 |
| 4514409 | CIF | C31 H31 N O3 S | P 1 21/c 1 | 6.4182; 21.7785; 19.0994 90; 96.787; 90 | 2651 | Li, Man-Bo; Grape, Erik Svensson; Bäckvall, Jan-E. Palladium-Catalyzed Stereospecific Oxidative Cascade Reaction of Allenes for the Construction of Pyrrole Rings: Control of Reactivity and Selectivity ACS Catalysis, 2019, 9, 5184 |
| 4514412 | CIF | C20 H26 Cl Rh | P 1 21/c 1 | 7.4511; 12.8249; 18.6937 90; 94.11; 90 | 1781.8 | Burman, Jacob S.; Harris, Robert J.; B. Farr, Caitlin M.; Bacsa, John; Blakey, Simon B. Rh(III) and Ir(III)Cp* Complexes Provide Complementary Regioselectivity Profiles in Intermolecular Allylic C–H Amidation Reactions ACS Catalysis, 2019, 9, 5474 |
| 4514413 | CIF | C20 H26 Cl Ir | P 1 21/c 1 | 7.46343; 12.81878; 18.68909 90; 93.9187; 90 | 1783.84 | Burman, Jacob S.; Harris, Robert J.; B. Farr, Caitlin M.; Bacsa, John; Blakey, Simon B. Rh(III) and Ir(III)Cp* Complexes Provide Complementary Regioselectivity Profiles in Intermolecular Allylic C‒H Amidation Reactions ACS Catalysis, 2019, 9, 5474 |
| 4514414 | CIF | C15 H27 Br2 Co N3 | P 1 21/c 1 | 10.8842; 11.4192; 15.8101 90; 104.557; 90 | 1901.94 | Pattanaik, Sandip; Gunanathan, Chidambaram Cobalt-Catalyzed Selective Synthesis of Disiloxanes and Hydrodisiloxanes ACS Catalysis, 2019, 9, 5552 |
| 4514415 | CIF | C17 H15 N3 O2 | P 1 21/c 1 | 11.1449; 12.2086; 11.4303 90; 107.468; 90 | 1483.5 | Zhao, Kang; Du, Rongrong; Wang, Bingyang; Liu, Jianhua; Xia, Chungu; Yang, Lei RhCl3·3H2O-Catalyzed Regioselective C(sp2)–H Alkoxycarbonylation: Efficient Synthesis of Indole- and Pyrrole-2-carboxylic Acid Esters ACS Catalysis, 2019, 9, 5545 |
| 4514416 | CIF | C22 H25 N3 O4 | P -1 | 8.7858; 9.9521; 13.706 100.933; 94.003; 112.813 | 1070.9 | Zhao, Kang; Du, Rongrong; Wang, Bingyang; Liu, Jianhua; Xia, Chungu; Yang, Lei RhCl3·3H2O-Catalyzed Regioselective C(sp2)–H Alkoxycarbonylation: Efficient Synthesis of Indole- and Pyrrole-2-carboxylic Acid Esters ACS Catalysis, 2019, 9, 5545 |
| 4514417 | CIF | C18 H15 N3 O2 | P b c a | 15.251; 10.6393; 19.017 90; 90; 90 | 3085.7 | Zhao, Kang; Du, Rongrong; Wang, Bingyang; Liu, Jianhua; Xia, Chungu; Yang, Lei RhCl3·3H2O-Catalyzed Regioselective C(sp2)–H Alkoxycarbonylation: Efficient Synthesis of Indole- and Pyrrole-2-carboxylic Acid Esters ACS Catalysis, 2019, 9, 5545 |
| 4514418 | CIF | C15 H11 N3 O2 | C 1 2/c 1 | 19.26; 6.4425; 20.274 90; 100.533; 90 | 2473.3 | Zhao, Kang; Du, Rongrong; Wang, Bingyang; Liu, Jianhua; Xia, Chungu; Yang, Lei RhCl3·3H2O-Catalyzed Regioselective C(sp2)–H Alkoxycarbonylation: Efficient Synthesis of Indole- and Pyrrole-2-carboxylic Acid Esters ACS Catalysis, 2019, 9, 5545 |
| 4514419 | CIF | C12 H10 I N O | P 1 21/c 1 | 16.093; 9.8036; 6.9586 90; 93.02; 90 | 1096.33 | Chen, Fumin; He, Dongxu; Chen, Li; Chang, Xiaoyong; Wang, David Zhigang; Xu, Chen; Xing, Xiangyou Chirality-Economy Catalysis: Asymmetric Transfer Hydrogenation of Ketones by Ru-Catalysts of Minimal Stereogenicity ACS Catalysis, 2019, 9, 5562 |
| 4514420 | CIF | C59 H60 Cl2 N2 P2 Ru | P 21 21 21 | 10.9656; 11.9509; 38.4007 90; 90; 90 | 5032.4 | Chen, Fumin; He, Dongxu; Chen, Li; Chang, Xiaoyong; Wang, David Zhigang; Xu, Chen; Xing, Xiangyou Chirality-Economy Catalysis: Asymmetric Transfer Hydrogenation of Ketones by Ru-Catalysts of Minimal Stereogenicity ACS Catalysis, 2019, 9, 5562 |
| 4514611 | CIF | C29 H33 B O4 Si | P 1 | 6.264; 9.621; 11.639 91.385; 96.47; 100.453 | 684.7 | Zhao, Zhi-Yuan; Nie, Yi-Xue; Tang, Ren-He; Yin, Guan-Wu; Cao, Jian; Xu, Zheng; Cui, Yu-Ming; Zheng, Zhan-Jiang; Xu, Li-Wen Enantioselective Rhodium-Catalyzed Desymmetric Hydrosilylation of Cyclopropenes ACS Catalysis, 2019, 9, 9110 |
| 4514612 | CIF | C72 H63 Ir N2 O6 P2 | P 21 21 21 | 15.155; 17.531; 22.268 90; 90; 90 | 5916.2 | Kim, Seung Wook; Meyer, Cole C.; Mai, Binh Khanh; Liu, Peng; Krische, Michael J. Inversion of Enantioselectivity in Allene Gas versus Allyl Acetate Reductive Aldehyde Allylation Guided by Metal-Centered Stereogenicity: An Experimental and Computational Study ACS Catalysis, 2019, 9, 9158 |
| 4514613 | CIF | C23 H29 B O3 | P 21 21 21 | 11.8365; 12.8133; 13.5157 90; 90; 90 | 2049.85 | Whyte, Andrew; Mirabi, Bijan; Torelli, Alexa; Prieto, Liher; Bajohr, Jonathan; Lautens, Mark Asymmetric Synthesis of Boryl-Functionalized Cyclobutanols ACS Catalysis, 2019, 9, 9253 |
| 4514614 | CIF | C14 H14 Br F2 N O | P -1 | 9.6165; 11.7307; 12.572 93.33; 100.541; 92.151 | 1390.3 | Chen, Yuanjin; Li, Liangkui; He, Xiao; Li, Zhiping Four-Component Reactions for the Synthesis of Perfluoroalkyl Isoxazoles ACS Catalysis, 2019, 9, 9098 |
| 4514615 | CIF | C20 H17 N3 O Pd | P 65 | 22.1057; 22.1057; 6.7305 90; 90; 120 | 2848.31 | Agasti, Soumitra; Mondal, Bhaskar; Achar, Tapas Kumar; Sinha, Soumya Kumar; Sarala Suseelan, Anjana; Szabo, Kalman J.; Schoenebeck, Franziska; Maiti, Debabrata Orthogonal Selectivity in C‒H Olefination: Synthesis of Branched Vinylarene with Unactivated Aliphatic Substitution ACS Catalysis, 2019, 9, 9606 |
| 4514616 | CIF | C23 N3 O Pd | P -1 | 9.6348; 10.7198; 11.5837 105.639; 103.125; 104.695 | 1056.88 | Agasti, Soumitra; Mondal, Bhaskar; Achar, Tapas Kumar; Sinha, Soumya Kumar; Sarala Suseelan, Anjana; Szabo, Kalman J.; Schoenebeck, Franziska; Maiti, Debabrata Orthogonal Selectivity in C‒H Olefination: Synthesis of Branched Vinylarene with Unactivated Aliphatic Substitution ACS Catalysis, 2019, 9, 9606 |
| 4514617 | CIF | C24 H25 N2 O2 | P -1 | 8.8691; 10.1304; 12.2386 105.617; 100.765; 93.916 | 1032.17 | Agasti, Soumitra; Mondal, Bhaskar; Achar, Tapas Kumar; Sinha, Soumya Kumar; Sarala Suseelan, Anjana; Szabo, Kalman J.; Schoenebeck, Franziska; Maiti, Debabrata Orthogonal Selectivity in C‒H Olefination: Synthesis of Branched Vinylarene with Unactivated Aliphatic Substitution ACS Catalysis, 2019, 9, 9606 |
| 4514618 | CIF | C20 H26 I N O2 S | P 1 21/c 1 | 12.2416; 20.4922; 7.9382 90; 91.862; 90 | 1990.3 | Nugent, Jeremy; Arroniz, Carlos; Shire, Bethany R.; Sterling, Alistair J.; Pickford, Helena D.; Wong, Marie L. J.; Mansfield, Steven J.; Caputo, Dimitri F. J.; Owen, Benjamin; Mousseau, James J.; Duarte, Fernanda; Anderson, Edward A. A General Route to Bicyclo[1.1.1]pentanes through Photoredox Catalysis ACS Catalysis, 2019, 9, 9568 |
| 4514619 | CIF | C24 H35 I O | P 21 21 21 | 6.30332; 11.85008; 28.71209 90; 90; 90 | 2144.65 | Nugent, Jeremy; Arroniz, Carlos; Shire, Bethany R.; Sterling, Alistair J.; Pickford, Helena D.; Wong, Marie L. J.; Mansfield, Steven J.; Caputo, Dimitri F. J.; Owen, Benjamin; Mousseau, James J.; Duarte, Fernanda; Anderson, Edward A. A General Route to Bicyclo[1.1.1]pentanes through Photoredox Catalysis ACS Catalysis, 2019, 9, 9568 |
| 4514620 | CIF | C21 H25 B O2 | P -1 | 10.2291; 13.3412; 13.527 87.464; 88.582; 80.599 | 1819.14 | Léonard, Nadia G.; Palmer, W. Neil; Friedfeld, Max R.; Bezdek, Máté J.; Chirik, Paul J. Remote, Diastereoselective Cobalt-Catalyzed Alkene Isomerization–Hydroboration: Access to Stereodefined 1,3-Difunctionalized Indanes ACS Catalysis, 2019, 9, 9034 |
| 4514621 | CIF | C18 H16 N2 O3 | P 1 c 1 | 11.4615; 5.5002; 12.6887 90; 105.131; 90 | 772.17 | Yang, Hui; Wei, Guo; Jiang, Zhiyong Access to Isoxazolidines through Visible-Light-Induced Difunctionalization of Alkenes ACS Catalysis, 2019, 9, 9599 |
| 4514622 | CIF | C44 H57 F6 N5 O6 | I 1 2/a 1 | 17.95158; 10.14969; 23.05206 90; 98.418; 90 | 4154.9 | Zhang, Yunfei; Jermaks, Janis; MacMillan, Samantha N.; Lambert, Tristan H. Synthesis of 2H-Chromenes via Hydrazine-Catalyzed Ring-Closing Carbonyl-Olefin Metathesis ACS Catalysis, 2019, 9, 9259 |
| 4514623 | CIF | C28 H46 Cl2 F3 Ir O5 P2 S | P n m a | 15.492; 24.393; 18.535 90; 90; 90 | 7004 | Chu, Wan-Yi; Culakova, Zuzana; Wang, Bernie T.; Goldberg, Karen I. Acid-Assisted Hydrogenation of CO2 to Methanol in a Homogeneous Catalytic Cascade System ACS Catalysis, 2019, 9, 9317 |
| 4514624 | CIF | C44 H43 F3 O4 P4 Ru S | P b c a | 23.1713; 14.6301; 24.6604 90; 90; 90 | 8359.8 | Chu, Wan-Yi; Culakova, Zuzana; Wang, Bernie T.; Goldberg, Karen I. Acid-Assisted Hydrogenation of CO2 to Methanol in a Homogeneous Catalytic Cascade System ACS Catalysis, 2019, 9, 9317 |
| 4514625 | CIF | C46 H45 F6 N O6 P4 Ru S2 | P 1 21/c 1 | 17.445; 19.175; 28.449 90; 95.41; 90 | 9474 | Chu, Wan-Yi; Culakova, Zuzana; Wang, Bernie T.; Goldberg, Karen I. Acid-Assisted Hydrogenation of CO2 to Methanol in a Homogeneous Catalytic Cascade System ACS Catalysis, 2019, 9, 9317 |
| 4514626 | CIF | C27 H46 Cl2 F3 Ir O4 P2 S | P 1 21/n 1 | 16.5246; 12.6284; 17.54 90; 116.553; 90 | 3274.16 | Chu, Wan-Yi; Culakova, Zuzana; Wang, Bernie T.; Goldberg, Karen I. Acid-Assisted Hydrogenation of CO2 to Methanol in a Homogeneous Catalytic Cascade System ACS Catalysis, 2019, 9, 9317 |
| 4514627 | CIF | C15 H12 O2 S | C 1 2/c 1 | 20.5001; 9.8972; 14.0168 90; 114.293; 90 | 2592.1 | Liu, Can; Fang, Yi; Wang, Shun-Yi; Ji, Shun-Jun RhCl3·3H2O-Catalyzed Ligand-Enabled Highly Regioselective Thiolation of Acrylic Acids ACS Catalysis, 2019, 9, 8910 |
| 4514628 | CIF | C9 H6 F6 O9 S2 U | P -1 | 8.7768; 9.4553; 11.5011 75.998; 71.713; 79.448 | 873.34 | Monsigny, Louis; Thuéry, Pierre; Berthet, Jean-Claude; Cantat, Thibault Breaking C‒O Bonds with Uranium: Uranyl Complexes as Selective Catalysts in the Hydrosilylation of Aldehydes ACS Catalysis, 2019, 9, 9025 |
| 4514629 | CIF | C32 H24 F12 O20 S4 U2 | P -1 | 5.6883; 12.7612; 16.5764 102.634; 94.632; 96.374 | 1160.02 | Monsigny, Louis; Thuéry, Pierre; Berthet, Jean-Claude; Cantat, Thibault Breaking C–O Bonds with Uranium: Uranyl Complexes as Selective Catalysts in the Hydrosilylation of Aldehydes ACS Catalysis, 2019, 9, 9025 |
| 4514630 | CIF | C29 H33 F6 N3 O11 S2 U | P 1 21/c 1 | 9.2981; 22.059; 18.3163 90; 102.709; 90 | 3664.8 | Monsigny, Louis; Thuéry, Pierre; Berthet, Jean-Claude; Cantat, Thibault Breaking C‒O Bonds with Uranium: Uranyl Complexes as Selective Catalysts in the Hydrosilylation of Aldehydes ACS Catalysis, 2019, 9, 9025 |
| 4514631 | CIF | C25 H22 F N O | P 21 21 21 | 6.9609; 9.0105; 32.0299 90; 90; 90 | 2008.95 | Ma, Teng; Chen, Yate; Li, Yuxiu; Ping, Yuanyuan; Kong, Wangqing Nickel-Catalyzed Enantioselective Reductive Aryl Fluoroalkenylation of Alkenes ACS Catalysis, 2019, 9, 9127 |
| 4514632 | CIF | C24 H43.5 O4.75 | P 1 21 1 | 12.5451; 25.5594; 15.6511 90; 110.747; 90 | 4693.02 | Nguyen, Vu T.; Nguyen, Viet D.; Haug, Graham C.; Dang, Hang T.; Jin, Shengfei; Li, Zhiliang; Flores-Hansen, Carsten; Benavides, Brenda S.; Arman, Hadi D.; Larionov, Oleg V. Alkene Synthesis by Photocatalytic Chemoenzymatically Compatible Dehydrodecarboxylation of Carboxylic Acids and Biomass ACS Catalysis, 2019, 9, 9485 |
| 4514633 | CIF | C15 H17 N3 O4 S | P 1 21/n 1 | 13.3181; 6.9639; 17.0635 90; 90.091; 90 | 1582.6 | Nguyen, Vu T.; Nguyen, Viet D.; Haug, Graham C.; Dang, Hang T.; Jin, Shengfei; Li, Zhiliang; Flores-Hansen, Carsten; Benavides, Brenda S.; Arman, Hadi D.; Larionov, Oleg V. Alkene Synthesis by Photocatalytic Chemoenzymatically Compatible Dehydrodecarboxylation of Carboxylic Acids and Biomass ACS Catalysis, 2019, 9, 9485 |
| 4514634 | CIF | C21 H17 N | C 1 2/c 1 | 18.1884; 10.5558; 25.3027 90; 108.216; 90 | 4614.5 | Nguyen, Vu T.; Nguyen, Viet D.; Haug, Graham C.; Dang, Hang T.; Jin, Shengfei; Li, Zhiliang; Flores-Hansen, Carsten; Benavides, Brenda S.; Arman, Hadi D.; Larionov, Oleg V. Alkene Synthesis by Photocatalytic Chemoenzymatically Compatible Dehydrodecarboxylation of Carboxylic Acids and Biomass ACS Catalysis, 2019, 9, 9485 |
| 4514635 | CIF | C22 H19 N | P 1 21/c 1 | 8.8592; 22.189; 8.984 90; 114.717; 90 | 1604.25 | Nguyen, Vu T.; Nguyen, Viet D.; Haug, Graham C.; Dang, Hang T.; Jin, Shengfei; Li, Zhiliang; Flores-Hansen, Carsten; Benavides, Brenda S.; Arman, Hadi D.; Larionov, Oleg V. Alkene Synthesis by Photocatalytic Chemoenzymatically Compatible Dehydrodecarboxylation of Carboxylic Acids and Biomass ACS Catalysis, 2019, 9, 9485 |
| 4514636 | CIF | C51 H57 Cl Ni O2 P2 | P 1 21/n 1 | 13.151; 15.965; 21.319 90; 91.921; 90 | 4474 | McGuire, Ryan T.; Paffile, Julia F. J.; Zhou, Yuqiao; Stradiotto, Mark Nickel-Catalyzed C‒N Cross-Coupling of Ammonia, (Hetero)anilines, and Indoles with Activated (Hetero)aryl Chlorides Enabled by Ligand Design ACS Catalysis, 2019, 9, 9292 |
| 4514637 | CIF | C159 H188 Cl4 N12 Rh4 | P 1 21/n 1 | 22.2298; 14.0027; 23.0551 90; 102.788; 90 | 6998.5 | Azpíroz, Ramón; Di Giuseppe, Andrea; Urriolabeitia, Asier; Passarelli, Vincenzo; Polo, Victor; Pérez-Torrente, Jesús J.; Oro, Luis A.; Castarlenas, Ricardo Hydride‒Rhodium(III)-N-Heterocyclic Carbene Catalyst for Tandem Alkylation/Alkenylation via C‒H Activation ACS Catalysis, 2019, 9, 9372 |
| 4514638 | CIF | C34 H36 Fe N O3 P S | P 1 21 1 | 11.5035; 10.7831; 13.3149 90; 110.777; 90 | 1544.22 | Han, Jie; Zhou, Wei; Zhang, Pei-Chao; Wang, Huamin; Zhang, Ronghua; Wu, Hai-Hong; Zhang, Junliang Design and Synthesis of WJ-Phos, and Application in Cu-Catalyzed Enantioselective Boroacylation of 1,1-Disubstituted Allenes ACS Catalysis, 2019, 9, 6890 |
| 4514639 | CIF | C24 H29 B O3 | P 21 21 21 | 8.8534; 12.6813; 18.9601 90; 90; 90 | 2128.7 | Han, Jie; Zhou, Wei; Zhang, Pei-Chao; Wang, Huamin; Zhang, Ronghua; Wu, Hai-Hong; Zhang, Junliang Design and Synthesis of WJ-Phos, and Application in Cu-Catalyzed Enantioselective Boroacylation of 1,1-Disubstituted Allenes ACS Catalysis, 2019, 9, 6890 |
| 4514640 | CIF | C38 H37 Cl3 Fe N O2 P S | P 1 21 1 | 10.5036; 11.7796; 15.6619 90; 106.748; 90 | 1855.62 | Han, Jie; Zhou, Wei; Zhang, Pei-Chao; Wang, Huamin; Zhang, Ronghua; Wu, Hai-Hong; Zhang, Junliang Design and Synthesis of WJ-Phos, and Application in Cu-Catalyzed Enantioselective Boroacylation of 1,1-Disubstituted Allenes ACS Catalysis, 2019, 9, 6890 |
| 4514641 | CIF | C50 H60 N4 O4 Rh2 | P 1 21/c 1 | 19.9451; 11.5613; 20.0794 90; 94.241; 90 | 4617.5 | Zhu, Weihao; Luo, Zhongwen; Chen, Junqi; Liu, Chang; Yang, Lu; Dickie, Diane A.; Liu, Naiming; Zhang, Sen; Davis, Robert J.; Gunnoe, T. Brent Mechanistic Studies of Single-Step Styrene Production Catalyzed by Rh Complexes with Diimine Ligands: An Evaluation of the Role of Ligands and Induction Period ACS Catalysis, 2019, 9, 7457 |
| 4514642 | CIF | C40 H26 F20 N4 O5 Rh2 | P 1 21/c 1 | 23.889; 9.9822; 19.624 90; 110.013; 90 | 4397.1 | Zhu, Weihao; Luo, Zhongwen; Chen, Junqi; Liu, Chang; Yang, Lu; Dickie, Diane A.; Liu, Naiming; Zhang, Sen; Davis, Robert J.; Gunnoe, T. Brent Mechanistic Studies of Single-Step Styrene Production Catalyzed by Rh Complexes with Diimine Ligands: An Evaluation of the Role of Ligands and Induction Period ACS Catalysis, 2019, 9, 7457 |
| 4514643 | CIF | C103 H224 Ni4 O32 Si8 | P 1 21/c 1 | 24.2076; 27.078; 21.532 90; 106.288; 90 | 13547.6 | Moroz, Ilia B.; Lund, Alicia; Kaushik, Monu; Severy, Laurent; Gajan, David; Fedorov, Alexey; Lesage, Anne; Copéret, Christophe Specific Localization of Aluminum Sites Favors Ethene-to-Propene Conversion on (Al)MCM-41-Supported Ni(II) Single Sites ACS Catalysis, 2019, 9, 7476 |
| 4514644 | CIF | C48 H60 Co Li N2 O | P m n 21 | 17.4715; 10.5472; 10.9763 90; 90; 90 | 2022.66 | Sandl, Sebastian; Maier, Thomas M.; van Leest, Nicolaas P.; Kröncke, Susanne; Chakraborty, Uttam; Demeshko, Serhiy; Koszinowski, Konrad; de Bruin, Bas; Meyer, Franc; Bodensteiner, Michael; Herrmann, Carmen; Wolf, Robert; Jacobi von Wangelin, Axel Cobalt-Catalyzed Hydrogenations via Olefin Cobaltate and Hydride Intermediates ACS Catalysis, 2019, 9, 7596 |
| 4514645 | CIF | C45 H53 Co N2 | P -1 | 12.3103; 12.6855; 13.5302 69.519; 77.844; 79.251 | 1920.22 | Sandl, Sebastian; Maier, Thomas M.; van Leest, Nicolaas P.; Kröncke, Susanne; Chakraborty, Uttam; Demeshko, Serhiy; Koszinowski, Konrad; de Bruin, Bas; Meyer, Franc; Bodensteiner, Michael; Herrmann, Carmen; Wolf, Robert; Jacobi von Wangelin, Axel Cobalt-Catalyzed Hydrogenations via Olefin Cobaltate and Hydride Intermediates ACS Catalysis, 2019, 9, 7596 |
| 4514646 | CIF | C36 H40 Br2 Co N2 | P 1 21/c 1 | 27.0266; 12.0329; 22.8033 90; 113.047; 90 | 6823.9 | Sandl, Sebastian; Maier, Thomas M.; van Leest, Nicolaas P.; Kröncke, Susanne; Chakraborty, Uttam; Demeshko, Serhiy; Koszinowski, Konrad; de Bruin, Bas; Meyer, Franc; Bodensteiner, Michael; Herrmann, Carmen; Wolf, Robert; Jacobi von Wangelin, Axel Cobalt-Catalyzed Hydrogenations via Olefin Cobaltate and Hydride Intermediates ACS Catalysis, 2019, 9, 7596 |
| 4514648 | CIF | C90 H121 Co2 Li N4 O4.5 | P b c a | 25.0102; 21.4146; 30.8908 90; 90; 90 | 16544.6 | Sandl, Sebastian; Maier, Thomas M.; van Leest, Nicolaas P.; Kröncke, Susanne; Chakraborty, Uttam; Demeshko, Serhiy; Koszinowski, Konrad; de Bruin, Bas; Meyer, Franc; Bodensteiner, Michael; Herrmann, Carmen; Wolf, Robert; Jacobi von Wangelin, Axel Cobalt-Catalyzed Hydrogenations via Olefin Cobaltate and Hydride Intermediates ACS Catalysis, 2019, 9, 7596 |
| 4514649 | CIF | C92 H123 Co2 Li N4 O5 | P 1 21/n 1 | 21.4917; 13.0279; 29.987 90; 101.086; 90 | 8239.4 | Sandl, Sebastian; Maier, Thomas M.; van Leest, Nicolaas P.; Kröncke, Susanne; Chakraborty, Uttam; Demeshko, Serhiy; Koszinowski, Konrad; de Bruin, Bas; Meyer, Franc; Bodensteiner, Michael; Herrmann, Carmen; Wolf, Robert; Jacobi von Wangelin, Axel Cobalt-Catalyzed Hydrogenations via Olefin Cobaltate and Hydride Intermediates ACS Catalysis, 2019, 9, 7596 |
| 4514650 | CIF | C48 H44 B Br N2 P4 | P -1 | 10.551; 12.062; 18.905 82.63; 81.72; 66.18 | 2171.5 | Bäcker, Andreas; Li, Yinwu; Fritz, Maximilian; Grätz, Maik; Ke, Zhuofeng; Langer, Robert Redox-Active, Boron-Based Ligands in Iron Complexes with Inverted Hydride Reactivity in Dehydrogenation Catalysis ACS Catalysis, 2019, 9, 7300 |
| 4514651 | CIF | C54.5 H51 B Br Cl5 Fe O2 P4 | P -1 | 11.496; 12.374; 20.858 97.02; 94.81; 111.71 | 2709 | Bäcker, Andreas; Li, Yinwu; Fritz, Maximilian; Grätz, Maik; Ke, Zhuofeng; Langer, Robert Redox-Active, Boron-Based Ligands in Iron Complexes with Inverted Hydride Reactivity in Dehydrogenation Catalysis ACS Catalysis, 2019, 9, 7300 |
| 4514652 | CIF | C18 H44 B Br Fe N2 O2 P4 | P 1 21/c 1 | 12.7253; 10.5434; 21.3482 90; 102.389; 90 | 2797.5 | Bäcker, Andreas; Li, Yinwu; Fritz, Maximilian; Grätz, Maik; Ke, Zhuofeng; Langer, Robert Redox-Active, Boron-Based Ligands in Iron Complexes with Inverted Hydride Reactivity in Dehydrogenation Catalysis ACS Catalysis, 2019, 9, 7300 |
| 4514653 | CIF | C19 H43 B Br Fe N2 O3 P4 | P n a 21 | 14.623; 15.131; 12.874 90; 90; 90 | 2848.5 | Bäcker, Andreas; Li, Yinwu; Fritz, Maximilian; Grätz, Maik; Ke, Zhuofeng; Langer, Robert Redox-Active, Boron-Based Ligands in Iron Complexes with Inverted Hydride Reactivity in Dehydrogenation Catalysis ACS Catalysis, 2019, 9, 7300 |
| 4514654 | CIF | C18 H21 N O5 S | P 1 21/n 1 | 9.7666; 7.7835; 22.574 90; 94.062; 90 | 1711.73 | Zhou, Kehan; Zhu, Yan; Fan, Weitai; Chen, Yujie; Xu, Xu; Zhang, Jingyu; Zhao, Yingsheng Late-Stage Functionalization of Aromatic Acids with Aliphatic Aziridines: Direct Approach to Form β-Branched Arylethylamine Backbones ACS Catalysis, 2019, 9, 6738 |
| 4514655 | CIF | C18 H23 N O6 S | P 1 21 1 | 8.1162; 11.0214; 10.5496 90; 91.17; 90 | 943.48 | Zhou, Kehan; Zhu, Yan; Fan, Weitai; Chen, Yujie; Xu, Xu; Zhang, Jingyu; Zhao, Yingsheng Late-Stage Functionalization of Aromatic Acids with Aliphatic Aziridines: Direct Approach to Form β-Branched Arylethylamine Backbones ACS Catalysis, 2019, 9, 6738 |
| 4514656 | CIF | C27 H48 Cl N2 P Ru | P 41 | 13.2477; 13.2477; 32.623 90; 90; 90 | 5725.4 | Paulson, Erik R.; Moore, Curtis E.; Rheingold, Arnold L.; Pullman, David P.; Sindewald, Ryan W.; Cooksy, Andrew L.; Grotjahn, Douglas B. Dynamic π-Bonding of Imidazolyl Substituent in a Formally 16-Electron Cp*Ru(κ2-P,N)+ Catalyst Allows Dramatic Rate Increases in (E)-Selective Monoisomerization of Alkenes ACS Catalysis, 2019, 9, 7217 |
| 4514657 | CIF | C24 H39 F9 N2 P2 Ru | P 1 21/c 1 | 22.5581; 12.7798; 22.1335 90; 113.18; 90 | 5865.7 | Paulson, Erik R.; Moore, Curtis E.; Rheingold, Arnold L.; Pullman, David P.; Sindewald, Ryan W.; Cooksy, Andrew L.; Grotjahn, Douglas B. Dynamic π-Bonding of Imidazolyl Substituent in a Formally 16-Electron Cp*Ru(κ2-P,N)+ Catalyst Allows Dramatic Rate Increases in (E)-Selective Monoisomerization of Alkenes ACS Catalysis, 2019, 9, 7217 |
| 4514658 | CIF | C40 H48 Cl4 F12 Ru4 | P -1 | 11.6853; 20.7278; 21.1082 114.576; 96.847; 99.355 | 4487.1 | Paulson, Erik R.; Moore, Curtis E.; Rheingold, Arnold L.; Pullman, David P.; Sindewald, Ryan W.; Cooksy, Andrew L.; Grotjahn, Douglas B. Dynamic π-Bonding of Imidazolyl Substituent in a Formally 16-Electron Cp*Ru(κ2-P,N)+ Catalyst Allows Dramatic Rate Increases in (E)-Selective Monoisomerization of Alkenes ACS Catalysis, 2019, 9, 7217 |
| 4514659 | CIF | C20 H34 Cl N2 P Ru | P 1 21/c 1 | 13.3641; 15.0206; 10.9602 90; 93.975; 90 | 2194.82 | Paulson, Erik R.; Moore, Curtis E.; Rheingold, Arnold L.; Pullman, David P.; Sindewald, Ryan W.; Cooksy, Andrew L.; Grotjahn, Douglas B. Dynamic π-Bonding of Imidazolyl Substituent in a Formally 16-Electron Cp*Ru(κ2-P,N)+ Catalyst Allows Dramatic Rate Increases in (E)-Selective Monoisomerization of Alkenes ACS Catalysis, 2019, 9, 7217 |
| 4514660 | CIF | C24 H42 F6 N2 P2 Ru | P n a 21 | 22.7385; 13.1551; 9.5634 90; 90; 90 | 2860.67 | Paulson, Erik R.; Moore, Curtis E.; Rheingold, Arnold L.; Pullman, David P.; Sindewald, Ryan W.; Cooksy, Andrew L.; Grotjahn, Douglas B. Dynamic π-Bonding of Imidazolyl Substituent in a Formally 16-Electron Cp*Ru(κ2-P,N)+ Catalyst Allows Dramatic Rate Increases in (E)-Selective Monoisomerization of Alkenes ACS Catalysis, 2019, 9, 7217 |
| 4514661 | CIF | C20 H31 Cl F3 N2 P Ru | P 1 21/c 1 | 13.915; 14.954; 10.922 90; 95.212; 90 | 2263.3 | Paulson, Erik R.; Moore, Curtis E.; Rheingold, Arnold L.; Pullman, David P.; Sindewald, Ryan W.; Cooksy, Andrew L.; Grotjahn, Douglas B. Dynamic π-Bonding of Imidazolyl Substituent in a Formally 16-Electron Cp*Ru(κ2-P,N)+ Catalyst Allows Dramatic Rate Increases in (E)-Selective Monoisomerization of Alkenes ACS Catalysis, 2019, 9, 7217 |
| 4514662 | CIF | C24.5 H0.5 Cl1.5 N2 O2 S3 | P 1 | 5.7084; 14.6112; 15.7856 72.801; 87.877; 87.344 | 1256.02 | Liang, Yaoyu; Zhao, Xiaodan Enantioselective Construction of Chiral Sulfides via Catalytic Electrophilic Azidothiolation and Oxythiolation of N-Allyl Sulfonamides ACS Catalysis, 2019, 9, 6896 |
| 4514663 | CIF | C19 H32 Fe N5 O7 S2 | P 1 21/c 1 | 11.986; 9.3819; 21.7658 90; 90; 90 | 2447.6 | Warner, Genoa R.; Somasundar, Yogesh; Jansen, Kyle C.; Kaaret, Evan Z.; Weng, Cindy; Burton, Abigail E.; Mills, Matthew R.; Shen, Longzhu Q.; Ryabov, Alexander D.; Pros, Gabrielle; Pintauer, Tomislav; Biswas, Saborni; Hendrich, Michael P.; Taylor, Julia A.; Vom Saal, Frederick S.; Collins, Terrence J. Bioinspired, Multidisciplinary, Iterative Catalyst Design Creates the Highest Performance Peroxidase Mimics and the Field of Sustainable Ultradilute Oxidation Catalysis (SUDOC) ACS Catalysis, 2019, 9, 7023 |
| 4514664 | CIF | C20 H21 N | P 1 21/c 1 | 10.3039; 11.9306; 12.985 90; 90.816; 90 | 1596.1 | Ping, Yuanyuan; Wang, Kuai; Pan, Qi; Ding, Zhengtian; Zhou, Zhijun; Guo, Ya; Kong, Wangqing Ni-Catalyzed Regio- and Enantioselective Domino Reductive Cyclization: One-Pot Synthesis of 2,3-Fused Cyclopentannulated Indolines ACS Catalysis, 2019, 9, 7335 |
| 4514665 | CIF | C20 H21 N | P 1 21/c 1 | 10.2763; 11.8965; 12.9403 90; 90.785; 90 | 1581.83 | Ping, Yuanyuan; Wang, Kuai; Pan, Qi; Ding, Zhengtian; Zhou, Zhijun; Guo, Ya; Kong, Wangqing Ni-Catalyzed Regio- and Enantioselective Domino Reductive Cyclization: One-Pot Synthesis of 2,3-Fused Cyclopentannulated Indolines ACS Catalysis, 2019, 9, 7335 |
| 4514666 | CIF | C108 H92 Cl12 N8 O4 | C 1 c 1 | 16.9269; 16.7619; 8.8583 90; 91.738; 90 | 2512.18 | Ping, Yuanyuan; Wang, Kuai; Pan, Qi; Ding, Zhengtian; Zhou, Zhijun; Guo, Ya; Kong, Wangqing Ni-Catalyzed Regio- and Enantioselective Domino Reductive Cyclization: One-Pot Synthesis of 2,3-Fused Cyclopentannulated Indolines ACS Catalysis, 2019, 9, 7335 |
| 4514667 | CIF | C18 H14 Br F3 N2 O3 | P 1 21 1 | 9.89; 9.938; 18.564 90; 101.954; 90 | 1785 | Ibáñez, Ignacio; Kaneko, Mio; Kamei, Yuto; Tsutsumi, Ryosuke; Yamanaka, Masahiro; Akiyama, Takahiko Enantioselective Friedel–Crafts Alkylation Reaction of Indoles with α-Trifluoromethylated β-Nitrostyrenes Catalyzed by Chiral BINOL Metal Phosphate ACS Catalysis, 2019, 9, 6903 |
| 4514668 | CIF | C38 H27 Br3 N2 O3 | P 21 21 21 | 6.8271; 16.06; 29.396 90; 90; 90 | 3223.1 | Ibáñez, Ignacio; Kaneko, Mio; Kamei, Yuto; Tsutsumi, Ryosuke; Yamanaka, Masahiro; Akiyama, Takahiko Enantioselective Friedel–Crafts Alkylation Reaction of Indoles with α-Trifluoromethylated β-Nitrostyrenes Catalyzed by Chiral BINOL Metal Phosphate ACS Catalysis, 2019, 9, 6903 |
| 4514669 | CIF | C25 H25 Br N2 O2 S | P 41 | 9.7248; 9.7248; 48.32 90; 90; 90 | 4569.7 | Ibáñez, Ignacio; Kaneko, Mio; Kamei, Yuto; Tsutsumi, Ryosuke; Yamanaka, Masahiro; Akiyama, Takahiko Enantioselective Friedel–Crafts Alkylation Reaction of Indoles with α-Trifluoromethylated β-Nitrostyrenes Catalyzed by Chiral BINOL Metal Phosphate ACS Catalysis, 2019, 9, 6903 |
| 4514670 | CIF | C22 H20 O2 | C 1 2/c 1 | 15.8408; 13.142; 16.3982 90; 98.987; 90 | 3371.9 | Giri, Sovan Sundar; Liu, Rai-Shung Copper-Catalyzed [4+2]-Cycloadditions of Isoxazoles with 2-Alkynylbenzaldehydes To Access Distinct α-Carbonylnaphthalene Derivatives: C(3,4)- versus C(4,5)-Regioselectivity at Isoxazoles ACS Catalysis, 2019, 9, 7328 |
| 4514671 | CIF | C25 H19 N O2 | P 1 21/c 1 | 15.6269; 10.8792; 22.0724 90; 100.839; 90 | 3685.5 | Giri, Sovan Sundar; Liu, Rai-Shung Copper-Catalyzed [4+2]-Cycloadditions of Isoxazoles with 2-Alkynylbenzaldehydes To Access Distinct α-Carbonylnaphthalene Derivatives: C(3,4)- versus C(4,5)-Regioselectivity at Isoxazoles ACS Catalysis, 2019, 9, 7328 |
| 4514672 | CIF | C18 H11 N O | P 1 21/c 1 | 8.2853; 31.984; 19.542 90; 93.546; 90 | 5168.7 | Giri, Sovan Sundar; Liu, Rai-Shung Copper-Catalyzed [4+2]-Cycloadditions of Isoxazoles with 2-Alkynylbenzaldehydes To Access Distinct α-Carbonylnaphthalene Derivatives: C(3,4)- versus C(4,5)-Regioselectivity at Isoxazoles ACS Catalysis, 2019, 9, 7328 |
| 4514673 | CIF | C22 H14 N4 | P 1 21/c 1 | 9.9466; 17.8664; 9.4521 90; 100.253; 90 | 1652.91 | Giri, Sovan Sundar; Liu, Rai-Shung Copper-Catalyzed [4+2]-Cycloadditions of Isoxazoles with 2-Alkynylbenzaldehydes To Access Distinct α-Carbonylnaphthalene Derivatives: C(3,4)- versus C(4,5)-Regioselectivity at Isoxazoles ACS Catalysis, 2019, 9, 7328 |
| 4514674 | CIF | C19 H13 N O | P -1 | 7.861; 9.282; 9.934 83.675; 72.702; 85.815 | 687.2 | Giri, Sovan Sundar; Liu, Rai-Shung Copper-Catalyzed [4+2]-Cycloadditions of Isoxazoles with 2-Alkynylbenzaldehydes To Access Distinct α-Carbonylnaphthalene Derivatives: C(3,4)- versus C(4,5)-Regioselectivity at Isoxazoles ACS Catalysis, 2019, 9, 7328 |
| 4514675 | CIF | C30 H22 O3 | P 1 21/c 1 | 24.6109; 12.239; 14.7299 90; 98.22; 90 | 4391.3 | Giri, Sovan Sundar; Liu, Rai-Shung Copper-Catalyzed [4+2]-Cycloadditions of Isoxazoles with 2-Alkynylbenzaldehydes To Access Distinct α-Carbonylnaphthalene Derivatives: C(3,4)- versus C(4,5)-Regioselectivity at Isoxazoles ACS Catalysis, 2019, 9, 7328 |
| 4514676 | CIF | C54 H55 B F4 N3 O5 P2 Rh | P -1 | 14.1394; 15.0162; 28.9031 77.688; 87.174; 78.469 | 5874.4 | Daubignard, Julien; Lutz, Martin; Detz, Remko J.; de Bruin, Bas; Reek, Joost N. H. Origin of the Selectivity and Activity in the Rhodium-Catalyzed Asymmetric Hydrogenation Using Supramolecular Ligands ACS Catalysis, 2019, 9, 7535 |
| 4514677 | CIF | C50 H49 B F4 N5 O5 P2 Rh | P -1 | 12.6207; 13.6039; 15.2008 72.598; 83.301; 76.784 | 2421.15 | Daubignard, Julien; Lutz, Martin; Detz, Remko J.; de Bruin, Bas; Reek, Joost N. H. Origin of the Selectivity and Activity in the Rhodium-Catalyzed Asymmetric Hydrogenation Using Supramolecular Ligands ACS Catalysis, 2019, 9, 7535 |
| 4514678 | CIF | C92 H86 B2 F8 N6 O10 P4 Rh2 | P 1 21/n 1 | 14.1446; 25.4077; 15.6384 90; 94.839; 90 | 5600.1 | Daubignard, Julien; Lutz, Martin; Detz, Remko J.; de Bruin, Bas; Reek, Joost N. H. Origin of the Selectivity and Activity in the Rhodium-Catalyzed Asymmetric Hydrogenation Using Supramolecular Ligands ACS Catalysis, 2019, 9, 7535 |
| 4514679 | CIF | C17 H21 B Br N O2 | P 1 21 1 | 11.3502; 7.45; 20.6376 90; 91.376; 90 | 1744.59 | Jia, Tao; Smith, Marshall J.; Pulis, Alexander P.; Perry, Gregory J. P.; Procter, David J. Enantioselective and Regioselective Copper-Catalyzed Borocyanation of 1-Aryl-1,3-Butadienes ACS Catalysis, 2019, 9, 6744 |
| 4514680 | CIF | C20 H16 Br N O2 | P 1 21 1 | 14.62776; 8.05742; 15.00218 90; 97.0979; 90 | 1754.64 | Jia, Tao; Smith, Marshall J.; Pulis, Alexander P.; Perry, Gregory J. P.; Procter, David J. Enantioselective and Regioselective Copper-Catalyzed Borocyanation of 1-Aryl-1,3-Butadienes ACS Catalysis, 2019, 9, 6744 |
| 4514681 | CIF | C11 H10 I0.96 N O | P 1 21 1 | 9.8268; 5.6439; 9.8652 90; 99.353; 90 | 539.86 | Jia, Tao; Smith, Marshall J.; Pulis, Alexander P.; Perry, Gregory J. P.; Procter, David J. Enantioselective and Regioselective Copper-Catalyzed Borocyanation of 1-Aryl-1,3-Butadienes ACS Catalysis, 2019, 9, 6744 |
| 4514682 | CIF | C14 H24 N2 O4 Pd | P 1 21/c 1 | 9.3121; 10.7025; 8.4772 90; 97.201; 90 | 838.2 | Feng, Wenhui; Wang, Tianyang; Liu, Dongzhi; Wang, Xiaotai; Dang, Yanfeng Mechanism of the Palladium-Catalyzed C(sp3)–H Arylation of Aliphatic Amines: Unraveling the Crucial Role of Silver(I) Additives ACS Catalysis, 2019, 9, 6672 |
| 4514683 | CIF | C42 H35 F12 N11 P2 Pd2 | P -1 | 12.0088; 12.3492; 17.137 101.431; 106.142; 105.372 | 2250.17 | Zhu, Jiancheng; Lindsay, Vincent N. G. Benzimidazolyl Palladium Complexes as Highly Active and General Bifunctional Catalysts in Sustainable Cross-Coupling Reactions ACS Catalysis, 2019, 9, 6993 |
| 4514684 | CIF | C25 H20 Cl F6 N4 O P Pd | P -1 | 8.7896; 12.4079; 13.433 108.517; 105.407; 103.424 | 1256.4 | Zhu, Jiancheng; Lindsay, Vincent N. G. Benzimidazolyl Palladium Complexes as Highly Active and General Bifunctional Catalysts in Sustainable Cross-Coupling Reactions ACS Catalysis, 2019, 9, 6993 |
| 4514685 | CIF | C45 H48 F12 N8 O3 P2 Pd2 | C 1 2/c 1 | 25.202; 8.3844; 24.157 90; 108.454; 90 | 4842 | Zhu, Jiancheng; Lindsay, Vincent N. G. Benzimidazolyl Palladium Complexes as Highly Active and General Bifunctional Catalysts in Sustainable Cross-Coupling Reactions ACS Catalysis, 2019, 9, 6993 |
| 4514686 | CIF | C12 H11 Br F3 N3 O2 | P 1 21/c 1 | 10.3636; 10.0648; 28.9197 90; 99.7; 90 | 2973.4 | Chen, Zhen; Ren, Nan; Ma, Xiaoxiao; Nie, Jing; Zhang, Fa-Guang; Ma, Jun-An Silver-Catalyzed [3 + 3] Dipolar Cycloaddition of Trifluorodiazoethane and Glycine Imines: Access to Highly Functionalized Trifluoromethyl-Substituted Triazines and Pyridines ACS Catalysis, 2019, 9, 4600 |
| 4514687 | CIF | C15 H11 Cl F3 N O2 | P 1 21/n 1 | 17.29; 4.519; 20.77 90; 111.24; 90 | 1513 | Chen, Zhen; Ren, Nan; Ma, Xiaoxiao; Nie, Jing; Zhang, Fa-Guang; Ma, Jun-An Silver-Catalyzed [3 + 3] Dipolar Cycloaddition of Trifluorodiazoethane and Glycine Imines: Access to Highly Functionalized Trifluoromethyl-Substituted Triazines and Pyridines ACS Catalysis, 2019, 9, 4600 |
| 4514688 | CIF | C34 H26 N2 | P 1 21/n 1 | 11.5593; 7.8828; 27.35 90; 98.043; 90 | 2467.6 | Noto, Naoki; Koike, Takashi; Akita, Munetaka Visible-Light-Triggered Monofluoromethylation of Alkenes by Strongly Reducing 1,4-Bis(diphenylamino)naphthalene Photoredox Catalysis ACS Catalysis, 2019, 9, 4382 |
| 4514689 | CIF | C21 H20 F3 N O5 S | P 1 | 9.0328; 9.506; 13.9771 90.165; 95.249; 115.51 | 1077.42 | He, Xiao-Long; Zhao, Hui-Ru; Song, Xue; Jiang, Bo; Du, Wei; Chen, Ying-Chun Asymmetric Barton–Zard Reaction To Access 3-Pyrrole-Containing Axially Chiral Skeletons ACS Catalysis, 2019, 9, 4374 |
| 4514690 | CIF | C24 H25 N3 O4 | P 21 21 21 | 9.2464; 10.0773; 23.4808 90; 90; 90 | 2187.91 | He, Xiao-Long; Zhao, Hui-Ru; Song, Xue; Jiang, Bo; Du, Wei; Chen, Ying-Chun Asymmetric Barton–Zard Reaction To Access 3-Pyrrole-Containing Axially Chiral Skeletons ACS Catalysis, 2019, 9, 4374 |
| 4514691 | CIF | C25 H17 N O | P 1 21/n 1 | 8.618; 11.775; 18.166 90; 103.293; 90 | 1794 | Yuan, Hairui; Guo, Lirong; Liu, Fengting; Miao, Zechen; Feng, Lei; Gao, Hongyin Copper-Catalyzed Tandem O-Vinylation of Arylhydroxylamines/[3,3]-Rearrangement/Cyclization: Synthesis of Highly Substituted Indoles and Benzoindoles ACS Catalysis, 2019, 9, 3906 |
| 4514692 | CIF | C31 H21 N O | P 21 21 21 | 8.1125; 12.1517; 23.1044 90; 90; 90 | 2277.65 | Yuan, Hairui; Guo, Lirong; Liu, Fengting; Miao, Zechen; Feng, Lei; Gao, Hongyin Copper-Catalyzed Tandem O-Vinylation of Arylhydroxylamines/[3,3]-Rearrangement/Cyclization: Synthesis of Highly Substituted Indoles and Benzoindoles ACS Catalysis, 2019, 9, 3906 |
| 4514693 | CIF | C24 H46 N6 Ni O6 | P 21 21 21 | 8.7123; 16.0813; 20.4271 90; 90; 90 | 2861.9 | Garrido-Barros, Pablo; Grau, Sergi; Drouet, Samuel; Benet-Buchholz, Jordi; Gimbert-Suriñach, Carolina; Llobet, Antoni Can Ni Complexes Behave as Molecular Water Oxidation Catalysts? ACS Catalysis, 2019, 9, 3936 |
| 4514694 | CIF | C21 H44 N6 Ni O9 | C 1 2/c 1 | 55.552; 6.2616; 15.8906 90; 100.323; 90 | 5438 | Garrido-Barros, Pablo; Grau, Sergi; Drouet, Samuel; Benet-Buchholz, Jordi; Gimbert-Suriñach, Carolina; Llobet, Antoni Can Ni Complexes Behave as Molecular Water Oxidation Catalysts? ACS Catalysis, 2019, 9, 3936 |
| 4514695 | CIF | C26 H29 N O | P 1 21/c 1 | 6.2208; 18.757; 17.484 90; 93.268; 90 | 2036.8 | Han, Chunhua; Fu, Zhiyuan; Guo, Songjin; Fang, Xinxin; Lin, Aijun; Yao, Hequan Palladium-Catalyzed Remote 1,n-Arylamination of Unactivated Terminal Alkenes ACS Catalysis, 2019, 9, 4196 |
| 4514696 | CIF | C58 H84 F7 N2 O4 P Pd S | P 1 21/c 1 | 20.138; 13.1828; 24.998 90; 106.912; 90 | 6349.4 | Dennis, Joseph M.; White, Nicholas A.; Liu, Richard Y.; Buchwald, Stephen L. Pd-Catalyzed C‒N Coupling Reactions Facilitated by Organic Bases: Mechanistic Investigation Leads to Enhanced Reactivity in the Arylation of Weakly Binding Amines ACS Catalysis, 2019, 9, 3822 |
| 4514697 | CIF | C43 H73.5 P2 Ru S | P -1 | 13.159; 15.396; 21.596 90.092; 92.283; 101.727 | 4280.3 | Zhou, Xiaoguang; Malakar, Santanu; Zhou, Tian; Murugesan, Sathiyamoorthy; Huang, Carlos; Emge, Thomas J.; Krogh-Jespersen, Karsten; Goldman, Alan S. Catalytic Alkane Transfer Dehydrogenation by PSP-Pincer-Ligated Ruthenium. Deactivation of an Extremely Reactive Fragment by Formation of Allyl Hydride Complexes ACS Catalysis, 2019, 9, 4072 |
| 4514698 | CIF | C38 H62 P2 Ru S | P 1 21/c 1 | 13.2907; 15.6689; 18.8836 90; 105.176; 90 | 3795.4 | Zhou, Xiaoguang; Malakar, Santanu; Zhou, Tian; Murugesan, Sathiyamoorthy; Huang, Carlos; Emge, Thomas J.; Krogh-Jespersen, Karsten; Goldman, Alan S. Catalytic Alkane Transfer Dehydrogenation by PSP-Pincer-Ligated Ruthenium. Deactivation of an Extremely Reactive Fragment by Formation of Allyl Hydride Complexes ACS Catalysis, 2019, 9, 4072 |
| 4514699 | CIF | C30 H41 Br1.02 Fe P3 | P -1 | 9.4966; 9.593; 17.63 101.894; 96.481; 102.236 | 1515.2 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514700 | CIF | C30 H41 Fe N4 P3 | P 1 21/c 1 | 17.626; 10.7764; 16.1774 90; 98.63; 90 | 3038 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514701 | CIF | C129 H106 B2 F48 Fe2 N8 P6 | P 1 21/n 1 | 22.4451; 12.1053; 25.482 90; 101.904; 90 | 6774.7 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514702 | CIF | C42 H65 Fe K N2 O6 P3 | P 1 21/n 1 | 10.4864; 23.9154; 17.8619 90; 93.645; 90 | 4470.5 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514703 | CIF | C40 H61 Fe K N2 O4 P3 | P n m a | 25.9569; 17.0296; 12.1851 90; 90; 90 | 5386.2 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514704 | CIF | C84 H130 Fe2 K4 N4 O6 P6 | P 1 21/n 1 | 14.6713; 16.6256; 18.7129 90; 102.506; 90 | 4456.1 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514705 | CIF | C33 H50 Fe K N2 P3 Si | P 21 21 21 | 10.5863; 16.3326; 20.8095 90; 90; 90 | 3598 | Schild, Dirk J.; Peters, Jonas C. Light Enhanced Fe-Mediated Nitrogen Fixation: Mechanistic Insights Regarding H<sub>2</sub> Elimination, HER, and NH<sub>3</sub> Generation. ACS catalysis, 2019, 9, 4286-4295 |
| 4514706 | CIF | C28 H26 N4 O2 Pd | P 1 21/n 1 | 8.3908; 20.0893; 14.6398 90; 100.46; 90 | 2426.75 | Luo, Yun-Cheng; Yang, Chao; Qiu, Sheng-Qi; Liang, Qiu-Ju; Xu, Yun-He; Loh, Teck-Peng Palladium(II)-Catalyzed Stereospecific Alkenyl C‒H Bond Alkylation of Allylamines with Alkyl Iodides ACS Catalysis, 2019, 9, 4271 |
| 4514707 | CIF | C26 H28 Cl2 Co N4 O | P 21 21 21 | 9.5625; 11.3203; 24.4937 90; 90; 90 | 2651.5 | Chen, Xu; Cheng, Zhaoyang; Lu, Zhan Cobalt-Catalyzed Asymmetric Markovnikov Hydroboration of Styrenes ACS Catalysis, 2019, 9, 4025 |
| 4514708 | CIF | C63 H73 Ni2 O3 P2 | P -1 | 10.2617; 16.0861; 17.7316 100.697; 90.004; 105.821 | 2763.17 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni‒O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514709 | CIF | C32 H37 Ni O2 P S | P -1 | 8.6245; 9.0612; 20.838 84.848; 88.901; 62.929 | 1443.8 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni‒O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514710 | CIF | C34 H42 B Ni O3 P | P 1 21/c 1 | 22.1829; 9.2102; 15.4936 90; 94.271; 90 | 3156.7 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni‒O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514711 | CIF | C36 H44 B Ni O P | P 1 21/n 1 | 8.8285; 20.3843; 17.3286 90; 95.23; 90 | 3105.5 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni‒O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514712 | CIF | C28 H31 Ni P | P -1 | 8.8889; 15.1597; 17.8889 91.217; 96.831; 90.693 | 2392.67 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni‒O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514713 | CIF | C28 H30 Br Ni P | P n a 21 | 16.7529; 10.1199; 14.6061 90; 90; 90 | 2476.28 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni‒O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514714 | CIF | C21 H31 B2 N O4 | P 1 21/c 1 | 15.588; 10.6978; 14.1186 90; 107.935; 90 | 2239.97 | Liu, Jianguo; Chen, Jia-Yi; Jia, Mengjing; Ming, Bangrong; Jia, Jiong; Liao, Rong-Zhen; Tung, Chen-Ho; Wang, Wenguang Ni–O Cooperation versus Nickel(II) Hydride in Catalytic Hydroboration of N-Heteroarenes ACS Catalysis, 2019, 9, 3849 |
| 4514715 | CIF | C23 H21 Br N2 O3 | P 32 | 9.5332; 9.5332; 19.5349 90; 90; 120 | 1537.51 | Das, Tamal Kanti; Ghosh, Avik; Balanna, Kuruva; Behera, Pradipta; Gonnade, Rajesh G.; Marelli, Udaya Kiran; Das, Abhijit Kumar; Biju, Akkattu T. N-Heterocyclic Carbene-Catalyzed Umpolung of Imines for the Enantioselective Synthesis of Dihydroquinoxalines ACS Catalysis, 2019, 9, 4065 |
| 4514716 | CIF | C14 H11 N O2 S2 | P 1 21/n 1 | 8.3903; 17.9634; 9.3448 90; 112.656; 90 | 1299.75 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514717 | CIF | C18 H10 Br2 N2 O2 S | I 1 2/a 1 | 17.7962; 4.9199; 19.1526 90; 105.417; 90 | 1616.57 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514718 | CIF | C12 H11 N O2 S | P 1 21/c 1 | 14.2892; 10.414; 7.4904 90; 103.95; 90 | 1081.76 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514719 | CIF | C18 H10 Cl2 N2 S | I 1 2/c 1 | 18.9763; 13.5616; 24.1428 90; 95.348; 90 | 6186.1 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514720 | CIF | C10 H8 Cl N O2 S | P 1 21/c 1 | 14.4698; 5.8318; 11.9918 90; 103.449; 90 | 984.18 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514721 | CIF | C17 H15 Cl N2 O4 S | P 1 21/n 1 | 10.7209; 11.7327; 13.2944 90; 97.17; 90 | 1659.16 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514722 | CIF | C16 H13 N O2 S | P 1 21/c 1 | 8.3782; 8.266; 20.0756 90; 97; 90 | 1379.96 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514723 | CIF | C18 H10 Cl2 N2 O2 S | P 1 21/c 1 | 12.9582; 9.0843; 14.2001 90; 108.155; 90 | 1588.37 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514724 | CIF | C14 H13 N O2 S | P 21 21 21 | 8.9497; 9.3068; 15.389 90; 90; 90 | 1281.8 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514725 | CIF | C16 H12 Cl N O2 S | P 1 21/c 1 | 8.2088; 24.9454; 6.8433 90; 94.558; 90 | 1396.88 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514726 | CIF | C18 H12 N2 O2 S | P -1 | 7.6361; 13.7285; 14.864 69.516; 85.244; 83.871 | 1449.62 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514727 | CIF | C17 H14 F N O4 S | P -1 | 7.5118; 8.3229; 12.1237 84.045; 88.396; 77.487 | 735.96 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514728 | CIF | C22 H24 N2 O6 S | P -1 | 7.8092; 9.7669; 14.5366 104.686; 101.315; 100.756 | 1018.49 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514729 | CIF | C22 H22 Cl N O2 S | C 1 2/c 1 | 15.7798; 11.6418; 22.199 90; 106.677; 90 | 3906.54 | Nguyen, Viet D.; Nguyen, Vu T.; Haug, Graham C.; Dang, Hang T.; Arman, Hadi D.; Ermler, Walter C.; Larionov, Oleg V. Rapid and Chemodivergent Synthesis of N-Heterocyclic Sulfones and Sulfides: Mechanistic and Computational Details of the Persulfate-Initiated Catalysis ACS Catalysis, 2019, 9, 4015 |
| 4514730 | CIF | C18 H20 I2 N4 Pd | P 1 21/c 1 | 8.3065; 16.337; 7.6187 90; 99.14; 90 | 1020.8 | Chernyshev, Victor M.; Astakhov, Alexander V.; Chikunov, Ilya E.; Tyurin, Roman V.; Eremin, Dmitry B.; Ranny, Gleb S.; Khrustalev, Victor N.; Ananikov, Valentine P. Pd and Pt Catalyst Poisoning in the Study of Reaction Mechanisms: What Does the Mercury Test Mean for Catalysis? ACS Catalysis, 2019, 9, 2984 |
| 4514731 | CIF | C26 H36 Br4 Hg2 N4 | C 1 2/c 1 | 18.486; 9.2309; 20.682 90; 106.8; 90 | 3378.6 | Chernyshev, Victor M.; Astakhov, Alexander V.; Chikunov, Ilya E.; Tyurin, Roman V.; Eremin, Dmitry B.; Ranny, Gleb S.; Khrustalev, Victor N.; Ananikov, Valentine P. Pd and Pt Catalyst Poisoning in the Study of Reaction Mechanisms: What Does the Mercury Test Mean for Catalysis? ACS Catalysis, 2019, 9, 2984 |
| 4514732 | CIF | C18 H20 Hg2 I4 N4 | P 1 21/n 1 | 10.648; 20.021; 12.134 90; 95.49; 90 | 2574.9 | Chernyshev, Victor M.; Astakhov, Alexander V.; Chikunov, Ilya E.; Tyurin, Roman V.; Eremin, Dmitry B.; Ranny, Gleb S.; Khrustalev, Victor N.; Ananikov, Valentine P. Pd and Pt Catalyst Poisoning in the Study of Reaction Mechanisms: What Does the Mercury Test Mean for Catalysis? ACS Catalysis, 2019, 9, 2984 |
| 4514733 | CIF | C102.56 H52 F2 O34 Zr6 | P 6/m m m | 39.446; 39.446; 16.4166 90; 90; 120 | 22122 | Liu, Jian; Li, Zhanyong; Zhang, Xuan; Otake, Ken-ichi; Zhang, Lin; Peters, Aaron W.; Young, Matthias J.; Bedford, Nicholas M.; Letourneau, Steven P.; Mandia, David J.; Elam, Jeffrey W.; Farha, Omar K.; Hupp, Joseph T. Introducing Nonstructural Ligands to Zirconia-like Metal‒Organic Framework Nodes To Tune the Activity of Node-Supported Nickel Catalysts for Ethylene Hydrogenation ACS Catalysis, 2019, 9, 3198 |
| 4514734 | CIF | C51 H53 Ni P2 | P 1 2/c 1 | 22.883; 9.2579; 21.1481 90; 115.533; 90 | 4042.6 | Charboneau, David J.; Brudvig, Gary W.; Hazari, Nilay; Lant, Hannah M. C.; Saydjari, Andrew K. Development of an Improved System for the Carboxylation of Aryl Halides through Mechanistic Studies. ACS catalysis, 2019, 9, 3228-3241 |
| 4514735 | CIF | C17 H14 Cl N O4 | P 21 21 21 | 7.7672; 8.6398; 22.845 90; 90; 90 | 1533.1 | Dai, Yuanwei; Tian, Baotong; Chen, Huan; Zhang, Qiang Palladium-Catalyzed Stereospecific C-Glycosylation of Glycals with Vinylogous Acceptors ACS Catalysis, 2019, 9, 2909 |
| 4514736 | CIF | C22 H37 N3 O4 Si | P 1 21 1 | 9.1154; 9.7854; 14.6304 90; 96.443; 90 | 1296.76 | Zhan, Bei-Bei; Fan, Jun; Jin, Liang; Shi, Bing-Feng Divergent Synthesis of Silicon-Containing Peptides via Pd-Catalyzed Post-Assembly γ-C(sp3)–H Silylation ACS Catalysis, 2019, 9, 3298 |
| 4514737 | CIF | C89 H64 Al B2 F36 N O6 P4 Rh2 | P -1 | 14.5138; 18.5644; 21.462 104.385; 102.683; 107.545 | 5062.15 | Adams, Gemma M.; Ryan, David E.; Beattie, Nicholas A.; McKay, Alasdair I.; Lloyd-Jones, Guy C; Weller, Andrew S. Dehydropolymerization of H<sub>3</sub>B·NMeH<sub>2</sub> Using a [Rh(DPEphos)]<sup>+</sup> Catalyst: The Promoting Effect of NMeH<sub>2</sub>. ACS catalysis, 2019, 9, 3657-3666 |
| 4514738 | CIF | C27 H36 Cl F Ni P2 | P 1 21/n 1 | 11.8371; 14.1571; 16.2044 90; 99.776; 90 | 2676.1 | Russell, John E. A.; Entz, Emily D.; Joyce, Ian M.; Neufeldt, Sharon R. Nickel-Catalyzed Stille Cross Coupling of C-O Electrophiles. ACS catalysis, 2019, 9, 3304-3310 |
| 4514739 | CIF | C29 H42 F N Ni O3 P2 S | P 1 21/m 1 | 8.6752; 12.5702; 14.4059 90; 101.795; 90 | 1537.78 | Russell, John E. A.; Entz, Emily D.; Joyce, Ian M.; Neufeldt, Sharon R. Nickel-Catalyzed Stille Cross Coupling of C-O Electrophiles. ACS catalysis, 2019, 9, 3304-3310 |
| 4514740 | CIF | C32 H58 Co I N4 P2 Zr | P n m a | 15.4307; 22.1735; 10.8845 90; 90; 90 | 3724.2 | Gramigna, Kathryn M.; Dickie, Diane A.; Foxman, Bruce M.; Thomas, Christine M. Cooperative H2 Activation across a Metal‒Metal Multiple Bond and Hydrogenation Reactions Catalyzed by a Zr/Co Heterobimetallic Complex ACS Catalysis, 2019, 9, 3153 |
| 4514741 | CIF | C56 H92 Co2 I6 N4 P4 Zr2 | P -1 | 11.4073; 12.4796; 14.109 100.063; 97.493; 112.211 | 1787.87 | Gramigna, Kathryn M.; Dickie, Diane A.; Foxman, Bruce M.; Thomas, Christine M. Cooperative H2 Activation across a Metal‒Metal Multiple Bond and Hydrogenation Reactions Catalyzed by a Zr/Co Heterobimetallic Complex ACS Catalysis, 2019, 9, 3153 |
| 4514742 | CIF | C45 H67 Co I N2 O P3 Zr | P -1 | 9.9663; 10.4166; 23.1907 81.58; 83.529; 82.278 | 2349.34 | Gramigna, Kathryn M.; Dickie, Diane A.; Foxman, Bruce M.; Thomas, Christine M. Cooperative H2 Activation across a Metal‒Metal Multiple Bond and Hydrogenation Reactions Catalyzed by a Zr/Co Heterobimetallic Complex ACS Catalysis, 2019, 9, 3153 |
| 4514743 | CIF | C35 H65 Co I N2 O P3 Zr | C 1 2/c 1 | 38.6599; 12.0858; 18.3535 90; 103.833; 90 | 8326.7 | Gramigna, Kathryn M.; Dickie, Diane A.; Foxman, Bruce M.; Thomas, Christine M. Cooperative H2 Activation across a Metal‒Metal Multiple Bond and Hydrogenation Reactions Catalyzed by a Zr/Co Heterobimetallic Complex ACS Catalysis, 2019, 9, 3153 |
| 4514744 | CIF | C45 H69 Co I N2 O P3 Zr | P -1 | 12.2182; 13.374; 16.9003 70.756; 71.3; 74.862 | 2432.1 | Gramigna, Kathryn M.; Dickie, Diane A.; Foxman, Bruce M.; Thomas, Christine M. Cooperative H2 Activation across a Metal‒Metal Multiple Bond and Hydrogenation Reactions Catalyzed by a Zr/Co Heterobimetallic Complex ACS Catalysis, 2019, 9, 3153 |
| 4514745 | CIF | C46 H64 Co I N2 O P2 Zr | P -1 | 10.7474; 11.7734; 20.3607 77.69; 79.557; 69.802 | 2345.95 | Gramigna, Kathryn M.; Dickie, Diane A.; Foxman, Bruce M.; Thomas, Christine M. Cooperative H2 Activation across a Metal‒Metal Multiple Bond and Hydrogenation Reactions Catalyzed by a Zr/Co Heterobimetallic Complex ACS Catalysis, 2019, 9, 3153 |
| 4514746 | CIF | C31 H38 B N3 O4 | P 1 21 1 | 6.5323; 24.418; 9.191 90; 104.387; 90 | 1420.04 | Liu, Zhen; Li, Xiaohan; Zeng, Tian; Engle, Keary M. Directed, Palladium(II)-Catalyzed Enantioselective anti-Carboboration of Alkenyl Carbonyl Compounds ACS Catalysis, 2019, 9, 3260 |
| 4514747 | CIF | C17 H18 N2 O3 Pd | P 1 21/n 1 | 8.6104; 10.5955; 17.71 90; 99.051; 90 | 1595.59 | Liu, Zhen; Li, Xiaohan; Zeng, Tian; Engle, Keary M. Directed, Palladium(II)-Catalyzed Enantioselective anti-Carboboration of Alkenyl Carbonyl Compounds ACS Catalysis, 2019, 9, 3260 |
| 4514748 | CIF | C30 H36 B N3 O3 | P 1 21 1 | 6.3743; 23.6017; 9.0486 90; 101.68; 90 | 1333.12 | Liu, Zhen; Li, Xiaohan; Zeng, Tian; Engle, Keary M. Directed, Palladium(II)-Catalyzed Enantioselective anti-Carboboration of Alkenyl Carbonyl Compounds ACS Catalysis, 2019, 9, 3260 |
| 4514749 | CIF | C44 H40 N6 O10 Zn2 | P -1 | 8.7707; 11.7137; 13.5892 82.784; 81.615; 88.403 | 1370.2 | Markad, Datta; Mandal, Sanjay K. Design of a Primary-Amide-Functionalized Highly Efficient and Recyclable Hydrogen-Bond-Donating Heterogeneous Catalyst for the Friedel‒Crafts Alkylation of Indoles with β-Nitrostyrenes ACS Catalysis, 2019, 9, 3165 |
| 4514750 | CIF | C42 H33 Cl F2 Ni P2 | C 1 2/c 1 | 30.115; 11.645; 20.4586 90; 102.223; 90 | 7012 | Stadler, Sonja M.; Göttker-Schnetmann, Inigo; Mecking, Stefan Incorporation of Radicals during Ni(II)-Catalyzed Ethylene Insertion Polymerization ACS Catalysis, 2019, 9, 2760 |
| 4514751 | CIF | C51 H58 F2 N Ni O2 P | P b c a | 16.868; 20.0011; 26.7439 90; 90; 90 | 9022.8 | Stadler, Sonja M.; Göttker-Schnetmann, Inigo; Mecking, Stefan Incorporation of Radicals during Ni(II)-Catalyzed Ethylene Insertion Polymerization ACS Catalysis, 2019, 9, 2760 |
| 4514752 | CIF | C10 H9 Br O3 | P 1 21 1 | 4.7773; 16.685; 6.289 90; 104.66; 90 | 485 | Sawano, Takahiro; Yamamoto, Hisashi Enantioselective Epoxidation of β,γ-Unsaturated Carboxylic Acids by a Cooperative Binuclear Titanium Complex ACS Catalysis, 2019, 9, 3384 |
| 4514753 | CIF | C22 H19 Br N2 O2 | P 21 21 21 | 7.3331; 9.8564; 25.7259 90; 90; 90 | 1859.42 | Yang, Qian-Qian; Yin, Xiang; He, Xiao-Long; Du, Wei; Chen, Ying-Chun Asymmetric Formal [5 + 3] Cycloadditions with Unmodified Morita–Baylis–Hillman Alcohols via Double Activation Catalysis ACS Catalysis, 2019, 9, 1258 |
| 4514754 | CIF | C36 H32 Cl2 N4 O2 | P 1 21 1 | 11.3963; 10.25731; 13.268 90; 95.0958; 90 | 1544.84 | Yang, Qian-Qian; Yin, Xiang; He, Xiao-Long; Du, Wei; Chen, Ying-Chun Asymmetric Formal [5 + 3] Cycloadditions with Unmodified Morita–Baylis–Hillman Alcohols via Double Activation Catalysis ACS Catalysis, 2019, 9, 1258 |
| 4514755 | CIF | C22 H19 N O3 S | P 1 21 1 | 17.546; 6.607; 17.993 90; 115.207; 90 | 1887.2 | Bai, Xing-Feng; Mu, Qiu-Chao; Xu, Zheng; Yang, Ke-Fang; Li, Li; Zheng, Zhan-Jiang; Xia, Chun-Gu; Xu, Li-Wen Catalytic Asymmetric Carbonylation of Prochiral Sulfonamides via C–H Desymmetrization ACS Catalysis, 2019, 9, 1431 |
| 4514756 | CIF | C25 H24 N O3 S | P 21 21 21 | 9.162; 10.694; 22.484 90; 90; 90 | 2203 | Bai, Xing-Feng; Mu, Qiu-Chao; Xu, Zheng; Yang, Ke-Fang; Li, Li; Zheng, Zhan-Jiang; Xia, Chun-Gu; Xu, Li-Wen Catalytic Asymmetric Carbonylation of Prochiral Sulfonamides via C‒H Desymmetrization ACS Catalysis, 2019, 9, 1431 |
| 4514757 | CIF | C29 H21 N O3 S | P 21 21 21 | 6.556; 13.237; 25.625 90; 90; 90 | 2223.8 | Bai, Xing-Feng; Mu, Qiu-Chao; Xu, Zheng; Yang, Ke-Fang; Li, Li; Zheng, Zhan-Jiang; Xia, Chun-Gu; Xu, Li-Wen Catalytic Asymmetric Carbonylation of Prochiral Sulfonamides via C–H Desymmetrization ACS Catalysis, 2019, 9, 1431 |
| 4514758 | CIF | C23 H21 N O5 S | P 21 21 21 | 8.9405; 10.0639; 23.127 90; 90; 90 | 2080.9 | Bai, Xing-Feng; Mu, Qiu-Chao; Xu, Zheng; Yang, Ke-Fang; Li, Li; Zheng, Zhan-Jiang; Xia, Chun-Gu; Xu, Li-Wen Catalytic Asymmetric Carbonylation of Prochiral Sulfonamides via C–H Desymmetrization ACS Catalysis, 2019, 9, 1431 |
| 4514759 | CIF | C18 H16 Br2 O2 | P -3 | 24.679; 24.679; 9.5417 90; 90; 120 | 5032.8 | Trost, Barry M.; Tracy, Jacob S. Vanadium-Catalyzed Synthesis of Geometrically Defined Acyclic Tri- and Tetrasubstituted Olefins from Propargyl Alcohols ACS Catalysis, 2019, 9, 1584 |
| 4514760 | CIF | C12.5 H16 Cl2 Co N1.5 O | P 1 | 8.5586; 8.9303; 9.6822 76.723; 86.703; 85.126 | 717.08 | Wen, Huanan; Wang, Kuan; Zhang, Yanlu; Liu, Guixia; Huang, Zheng Cobalt-Catalyzed Regio- and Enantioselective Markovnikov 1,2-Hydrosilylation of Conjugated Dienes ACS Catalysis, 2019, 9, 1612 |
| 4514761 | CIF | C16 H18 Cl2 Co N2 O | P 1 21 1 | 9.7507; 13.413; 12.9181 90; 90.316; 90 | 1689.48 | Wen, Huanan; Wang, Kuan; Zhang, Yanlu; Liu, Guixia; Huang, Zheng Cobalt-Catalyzed Regio- and Enantioselective Markovnikov 1,2-Hydrosilylation of Conjugated Dienes ACS Catalysis, 2019, 9, 1612 |
| 4514762 | CIF | C29.48 H29.66 Cl1.27 N O3 | C 1 2 1 | 25.1281; 6.268; 15.987 90; 99.524; 90 | 2483.29 | Trost, Barry M.; Hung, Chao-I Joey; Gnanamani, Elumalai Tuning the Reactivity of Ketones through Unsaturation: Construction of Cyclic and Acyclic Quaternary Stereocenters via Zn-ProPhenol Catalyzed Mannich Reactions ACS Catalysis, 2019, 9, 1549 |
| 4514763 | CIF | C22 H19 O P | P 1 21 1 | 15.7797; 6.4246; 18.8309 90; 114.711; 90 | 1734.23 | Lu, Zhiwu; Zhang, Haoyang; Yang, Zhiping; Ding, Ning; Meng, Ling; Wang, Jun Asymmetric Hydrophosphination of Heterobicyclic Alkenes: Facile Access to Phosphine Ligands for Asymmetric Catalysis ACS Catalysis, 2019, 9, 1457 |
| 4514764 | CIF | C27 H26 F2 N O2 P | P 1 21 1 | 10.6041; 11.5598; 19.577 90; 94.744; 90 | 2391.6 | Lu, Zhiwu; Zhang, Haoyang; Yang, Zhiping; Ding, Ning; Meng, Ling; Wang, Jun Asymmetric Hydrophosphination of Heterobicyclic Alkenes: Facile Access to Phosphine Ligands for Asymmetric Catalysis ACS Catalysis, 2019, 9, 1457 |
| 4514765 | CIF | C24 H21 O3 P | P 21 21 21 | 9.561; 9.713; 20.717 90; 90; 90 | 1923.9 | Lu, Zhiwu; Zhang, Haoyang; Yang, Zhiping; Ding, Ning; Meng, Ling; Wang, Jun Asymmetric Hydrophosphination of Heterobicyclic Alkenes: Facile Access to Phosphine Ligands for Asymmetric Catalysis ACS Catalysis, 2019, 9, 1457 |
| 4514766 | CIF | C20 H27 N O6 | P 1 21 1 | 6.03; 19.3547; 9.0029 90; 102.453; 90 | 1026 | Sim, Jaehoon; Campbell, Mark W.; Molander, Gary A. Synthesis of α-Fluoro-α-Amino Acid Derivatives via Photoredox-Catalyzed Carbofluorination. ACS catalysis, 2019, 9, 1558-1563 |
| 4514767 | CIF | C15 H16 O2 | P 21 21 21 | 5.6039; 10.7509; 19.196 90; 90; 90 | 1156.5 | Zheng, Pengfei; Wang, Chengpeng; Chen, Ying-Chun; Dong, Guangbin Pd-Catalyzed Intramolecular α-Allylic Alkylation of Ketones with Alkynes: Rapid and Stereodivergent Construction of [3.2.1] Bicycles ACS Catalysis, 2019, 9, 5515 |
| 4514768 | CIF | C35 H51 F6 N3 O5 S2 Zn | P 21 21 21 | 13.6599; 14.2563; 20.5882 90; 90; 90 | 4009.34 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514769 | CIF | C37 H47 F6 N3 O4 S2 Zn | P 1 21/c 1 | 19.3499; 20.6938; 20.4521 90; 105.975; 90 | 7873.2 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514770 | CIF | C26.67 H32.67 Cl2 F4 N2 O2.67 S1.33 Zn0.67 | P -1 | 10.0474; 16.5268; 16.5479 117.002; 106.69; 94.539 | 2273.4 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514771 | CIF | C47 H56 N2 Zn | P 1 21/c 1 | 19.3717; 16.9243; 27.5305 90; 101.738; 90 | 8837.2 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514772 | CIF | C35 H54 Cl2 N2 O1.5 Zn | P 1 21/c 1 | 12.9149; 19.5194; 19.2829 90; 133.379; 90 | 3533.1 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514773 | CIF | C41 H52 N2 Zn | P 1 21/c 1 | 20.3293; 9.7719; 18.4536 90; 106.688; 90 | 3511.5 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514774 | CIF | C43 H57 F6 N3 O6 S2 Zn | P -1 | 11.9544; 13.4764; 15.7416 95.505; 100.925; 110.249 | 2299.96 | Procter, Richard J.; Uzelac, Marina; Cid, Jessica; Rushworth, Philip J.; Ingleson, Michael J. Low-Coordinate NHC‒Zinc Hydride Complexes Catalyze Alkyne C‒H Borylation and Hydroboration Using Pinacolborane ACS Catalysis, 2019, 9, 5760 |
| 4514775 | CIF | C19 H18 O2 | P 21 21 21 | 9.663; 9.7186; 31.0442 90; 90; 90 | 2915.39 | Yang, Junfeng; Sekiguchi, Yoshiya; Yoshikai, Naohiko Cobalt-Catalyzed Enantioselective and Chemodivergent Addition of Cyclopropanols to Oxabicyclic Alkenes ACS Catalysis, 2019, 9, 5638 |
| 4514776 | CIF | C27 H25 O3 P S | P 21 21 2 | 13.6131; 35.785; 9.9738 90; 90; 90 | 4858.7 | Zhang, Yu; Zhang, Fengcai; Chen, Long; Xu, Jian; Liu, Xiaohua; Feng, Xiaoming Asymmetric Synthesis of P-Stereogenic Compounds via Thulium(III)-Catalyzed Desymmetrization of Dialkynylphosphine Oxides ACS Catalysis, 2019, 9, 4834 |
| 4514777 | CIF | C46 H72 Dy F9 N4 O17 S3 | P 1 21 1 | 12.1386; 16.1932; 15.8018 90; 97.546; 90 | 3079.1 | Zhang, Yu; Zhang, Fengcai; Chen, Long; Xu, Jian; Liu, Xiaohua; Feng, Xiaoming Asymmetric Synthesis of P-Stereogenic Compounds via Thulium(III)-Catalyzed Desymmetrization of Dialkynylphosphine Oxides ACS Catalysis, 2019, 9, 4834 |
| 4514778 | CIF | C51 H84 F9 N4 O18 Pr S3 | P 1 21 1 | 12.1823; 16.5445; 16.408 90; 101.368; 90 | 3242.2 | Zhang, Yu; Zhang, Fengcai; Chen, Long; Xu, Jian; Liu, Xiaohua; Feng, Xiaoming Asymmetric Synthesis of P-Stereogenic Compounds via Thulium(III)-Catalyzed Desymmetrization of Dialkynylphosphine Oxides ACS Catalysis, 2019, 9, 4834 |
| 4514779 | CIF | C53 H82 F9 N4 O15 S3 Tm | P 21 21 21 | 15.6161; 19.6361; 21.6999 90; 90; 90 | 6654 | Zhang, Yu; Zhang, Fengcai; Chen, Long; Xu, Jian; Liu, Xiaohua; Feng, Xiaoming Asymmetric Synthesis of P-Stereogenic Compounds via Thulium(III)-Catalyzed Desymmetrization of Dialkynylphosphine Oxides ACS Catalysis, 2019, 9, 4834 |
| 4514780 | CIF | C44 H40 O P2 | P 21 21 21 | 9.9449; 17.1268; 19.9556 90; 90; 90 | 3398.92 | Batuecas, María; Luo, Junfei; Gergelitsová, Ivana; Krämer, Katrina; Whitaker, Daniel; Vitorica-Yrezabal, Iñigo J.; Larrosa, Igor Catalytic Asymmetric C‒H Arylation of (η6-Arene)Chromium Complexes: Facile Access to Planar-Chiral Phosphines ACS Catalysis, 2019, 9, 5268 |
| 4514781 | CIF | C17 H11 Cr F O5 | P 1 | 7.0791; 7.2172; 16.4881 85.775; 87.502; 64.437 | 757.81 | Batuecas, María; Luo, Junfei; Gergelitsová, Ivana; Krämer, Katrina; Whitaker, Daniel; Vitorica-Yrezabal, Iñigo J.; Larrosa, Igor Catalytic Asymmetric C‒H Arylation of (η6-Arene)Chromium Complexes: Facile Access to Planar-Chiral Phosphines ACS Catalysis, 2019, 9, 5268 |
| 4514782 | CIF | C43 H32 Cl2 N4 O | P -1 | 11.209; 13.582; 13.728 60.753; 79.38; 76.89 | 1769.4 | Takamatsu, Kazutaka; Hayashi, Yoshihiro; Kawauchi, Susumu; Hirano, Koji; Miura, Masahiro Copper-Catalyzed Regioselective C–H Amination of Phenol Derivatives with Assistance of Phenanthroline-Based Bidentate Auxiliary ACS Catalysis, 2019, 9, 5336 |
| 4514783 | CIF | C31 H31 N O2 S | P -1 | 10.628; 11.4207; 12.9524 65.936; 85.626; 72.954 | 1370.77 | Li, Man-Bo; Grape, Erik Svensson; Bäckvall, Jan-E. Palladium-Catalyzed Stereospecific Oxidative Cascade Reaction of Allenes for the Construction of Pyrrole Rings: Control of Reactivity and Selectivity ACS Catalysis, 2019, 9, 5184 |
| 4514784 | CIF | C28 H27 N O2 S | P 1 21/c 1 | 14.0088; 9.652; 19.0811 90; 109.714; 90 | 2428.79 | Li, Man-Bo; Grape, Erik Svensson; Bäckvall, Jan-E. Palladium-Catalyzed Stereospecific Oxidative Cascade Reaction of Allenes for the Construction of Pyrrole Rings: Control of Reactivity and Selectivity ACS Catalysis, 2019, 9, 5184 |
| 4514785 | CIF | C15 H17 N O4 | P n a 21 | 9.7201; 26.2838; 5.4483 90; 90; 90 | 1391.94 | Wu, Wenli; Cui, Enxin; Zhang, Yun; Zhang, Chen; Zhu, Feng; Tung, Chen-Ho; Wang, Yifeng Involving Single-Atom Silver(0) in Selective Dehalogenation by AgF under Visible-Light Irradiation ACS Catalysis, 2019, 9, 6335 |
| 4514786 | CIF | C16 H12 N2 | P n a 21 | 7.5559; 13.9087; 11.4271 90; 90; 90 | 1200.91 | Wu, Wenli; Cui, Enxin; Zhang, Yun; Zhang, Chen; Zhu, Feng; Tung, Chen-Ho; Wang, Yifeng Involving Single-Atom Silver(0) in Selective Dehalogenation by AgF under Visible-Light Irradiation ACS Catalysis, 2019, 9, 6335 |
| 4514787 | CIF | C8 H6 N | P 1 21/n 1 | 7.8048; 5.9454; 13.2408 90; 92.593; 90 | 613.78 | Wu, Wenli; Cui, Enxin; Zhang, Yun; Zhang, Chen; Zhu, Feng; Tung, Chen-Ho; Wang, Yifeng Involving Single-Atom Silver(0) in Selective Dehalogenation by AgF under Visible-Light Irradiation ACS Catalysis, 2019, 9, 6335 |
| 4514788 | CIF | C11 H11 F3 O2 | P 41 21 2 | 7.262; 7.262; 41.516 90; 90; 90 | 2189.41 | Kerdphon, Sutthichat; Ponra, Sudipta; Yang, Jianping; Wu, Haibo; Eriksson, Lars; Andersson, Pher G. Diastereo- and Enantioselective Synthesis of Structurally Diverse Succinate, Butyrolactone, and Trifluoromethyl Derivatives by Iridium-Catalyzed Hydrogenation of Tetrasubstituted Olefins ACS Catalysis, 2019, 9, 6169 |
| 4514789 | CIF | C18 H15 N O2 | P 21 21 21 | 8.98144; 9.10592; 35.9259 90; 90; 90 | 2938.17 | Li, Yi-Pan; Li, Zi-Qi; Zhou, Biying; Li, Mao-Lin; Xue, Xiao-Song; Zhu, Shou-Fei; Zhou, Qi-Lin Chiral Spiro Phosphoric Acid-Catalyzed Friedel–Crafts Conjugate Addition/Enantioselective Protonation Reactions ACS Catalysis, 2019, 9, 6522 |
| 4514790 | CIF | C19 H17 N O | P 1 21 1 | 9.3678; 6.9408; 11.2829 90; 93.95; 90 | 731.872 | Li, Yi-Pan; Li, Zi-Qi; Zhou, Biying; Li, Mao-Lin; Xue, Xiao-Song; Zhu, Shou-Fei; Zhou, Qi-Lin Chiral Spiro Phosphoric Acid-Catalyzed Friedel–Crafts Conjugate Addition/Enantioselective Protonation Reactions ACS Catalysis, 2019, 9, 6522 |
| 4514791 | CIF | C25 H22 I O P | P n a 21 | 14.0443; 8.9519; 34.5515 90; 90; 90 | 4343.92 | Zhang, Lumin; Si, Xiaojia; Yang, Yangyang; Witzel, Sina; Sekine, Kohei; Rudolph, Matthias; Rominger, Frank; Hashmi, A. Stephen K. Reductive C–C Coupling by Desulfurizing Gold-Catalyzed Photoreactions ACS Catalysis, 2019, 9, 6118 |
| 4514792 | CIF | C40 H48 B2 Fe N12 | C 1 2/c 1 | 20.1074; 16.9145; 25.426 90; 108.024; 90 | 8223.2 | Isbill, Sara B.; Chandrachud, Preeti P.; Kern, Jesse L.; Jenkins, David M.; Roy, Sharani Elucidation of the Reaction Mechanism of C<sub>2</sub> + N<sub>1</sub> Aziridination from Tetracarbene Iron Catalysts. ACS catalysis, 2019, 9, 6223-6233 |
| 4514793 | CIF | C24 H31 Cl Ir N O | P 1 21/n 1 | 8.81332; 15.7101; 17.1127 90; 102.781; 90 | 2310.68 | Chen, Shuyou; Zhang, Min; Su, Rongchuan; Chen, Xingyu; Feng, Boya; Yang, Yudong; You, Jingsong C2/C4 Regioselective Heteroarylation of Indoles by Tuning C‒H Metalation Modes ACS Catalysis, 2019, 9, 6372 |
| 4514794 | CIF | C32 H36 Ir N O2 | P -1 | 11.5179; 13.5428; 18.483 76.588; 87.879; 89.094 | 2802.44 | Chen, Shuyou; Zhang, Min; Su, Rongchuan; Chen, Xingyu; Feng, Boya; Yang, Yudong; You, Jingsong C2/C4 Regioselective Heteroarylation of Indoles by Tuning C‒H Metalation Modes ACS Catalysis, 2019, 9, 6372 |
| 4514795 | CIF | C19 H21 N O S | P b c a | 10.7285; 17.9511; 18.0222 90; 90; 90 | 3470.87 | Chen, Shuyou; Zhang, Min; Su, Rongchuan; Chen, Xingyu; Feng, Boya; Yang, Yudong; You, Jingsong C2/C4 Regioselective Heteroarylation of Indoles by Tuning C–H Metalation Modes ACS Catalysis, 2019, 9, 6372 |
| 4514796 | CIF | C22 H21 N O2 | P 21 21 21 | 7.1896; 13.9891; 17.894 90; 90; 90 | 1799.71 | Chen, Shuyou; Zhang, Min; Su, Rongchuan; Chen, Xingyu; Feng, Boya; Yang, Yudong; You, Jingsong C2/C4 Regioselective Heteroarylation of Indoles by Tuning C–H Metalation Modes ACS Catalysis, 2019, 9, 6372 |
| 4514797 | CIF | C22 H23 N O | P 43 | 10.6545; 10.6545; 15.1128 90; 90; 90 | 1715.58 | Sahani, Rajkumar Lalji; Liu, Rai-Shung Gold-Catalyzed Oxidative Arylations of 3-Butyn-1-ols and 2-Propyn-1-ols with Nitrones to Yield Distinct Fused Indoles Bearing a Heterocyclic Ring ACS Catalysis, 2019, 9, 5890 |
| 4514798 | CIF | C20 H19 N O | P 21 21 21 | 5.6073; 16.7309; 16.9207 90; 90; 90 | 1587.42 | Sahani, Rajkumar Lalji; Liu, Rai-Shung Gold-Catalyzed Oxidative Arylations of 3-Butyn-1-ols and 2-Propyn-1-ols with Nitrones to Yield Distinct Fused Indoles Bearing a Heterocyclic Ring ACS Catalysis, 2019, 9, 5890 |
| 4514799 | CIF | C24 H22 N2 O | P b c a | 10.4266; 18.053; 19.734 90; 90; 90 | 3714.6 | Sahani, Rajkumar Lalji; Liu, Rai-Shung Gold-Catalyzed Oxidative Arylations of 3-Butyn-1-ols and 2-Propyn-1-ols with Nitrones to Yield Distinct Fused Indoles Bearing a Heterocyclic Ring ACS Catalysis, 2019, 9, 5890 |
| 4514800 | CIF | C26 H24 N2 O | P 1 21 1 | 8.7098; 8.9173; 13.0467 90; 93.444; 90 | 1011.48 | Sahani, Rajkumar Lalji; Liu, Rai-Shung Gold-Catalyzed Oxidative Arylations of 3-Butyn-1-ols and 2-Propyn-1-ols with Nitrones to Yield Distinct Fused Indoles Bearing a Heterocyclic Ring ACS Catalysis, 2019, 9, 5890 |
| 4514801 | CIF | C18 H19 N O2 | P -1 | 9.859; 10.008; 15.838 93.054; 90.75; 99.872 | 1537 | Sahani, Rajkumar Lalji; Liu, Rai-Shung Gold-Catalyzed Oxidative Arylations of 3-Butyn-1-ols and 2-Propyn-1-ols with Nitrones to Yield Distinct Fused Indoles Bearing a Heterocyclic Ring ACS Catalysis, 2019, 9, 5890 |
| 4514802 | CIF | C30 H36 B N3 O3 | P 1 21 1 | 6.5399; 23.9124; 9.103 90; 102.293; 90 | 1390.93 | Bai, Zibo; Zheng, Sujuan; Bai, Ziqian; Song, Fangfang; Wang, Hao; Peng, Qian; Chen, Gong; He, Gang Palladium-Catalyzed Amide-Directed Enantioselective Carboboration of Unactivated Alkenes Using a Chiral Monodentate Oxazoline Ligand ACS Catalysis, 2019, 9, 6502 |
| 4514803 | CIF | C30 H36 B N3 O3 | P 41 21 2 | 9.0322; 9.0322; 68.9818 90; 90; 90 | 5627.58 | Bai, Zibo; Zheng, Sujuan; Bai, Ziqian; Song, Fangfang; Wang, Hao; Peng, Qian; Chen, Gong; He, Gang Palladium-Catalyzed Amide-Directed Enantioselective Carboboration of Unactivated Alkenes Using a Chiral Monodentate Oxazoline Ligand ACS Catalysis, 2019, 9, 6502 |
| 4514804 | CIF | C34 H36 O S2 | P 1 21/c 1 | 12.8072; 13.6963; 17.6483 90; 110.451; 90 | 2900.59 | Yang, Shiping; Cheng, Rui; Zhang, Min; Bin, Zhengyang; You, Jingsong Rh/Ag-Mediated Peri-Selective Heteroarylation/Single Electron Transfer Annulation Cascade of 1-(Methylthio)naphthalenes and Analogues: Road Less Traveled to Benzo[de]thioacenes ACS Catalysis, 2019, 9, 6188 |
| 4514805 | CIF | C19 H14 S2 | P -1 | 7.9503; 8.3038; 12.6012 78.352; 79.15; 72.944 | 771.51 | Yang, Shiping; Cheng, Rui; Zhang, Min; Bin, Zhengyang; You, Jingsong Rh/Ag-Mediated Peri-Selective Heteroarylation/Single Electron Transfer Annulation Cascade of 1-(Methylthio)naphthalenes and Analogues: Road Less Traveled to Benzo[de]thioacenes ACS Catalysis, 2019, 9, 6188 |
| 4514806 | CIF | C19 H14 O S2 | C 1 2/c 1 | 16.653; 5.92231; 33.4022 90; 104.977; 90 | 3182.36 | Yang, Shiping; Cheng, Rui; Zhang, Min; Bin, Zhengyang; You, Jingsong Rh/Ag-Mediated Peri-Selective Heteroarylation/Single Electron Transfer Annulation Cascade of 1-(Methylthio)naphthalenes and Analogues: Road Less Traveled to Benzo[de]thioacenes ACS Catalysis, 2019, 9, 6188 |
| 4514807 | CIF | C21 H24 Cl Rh S | P 1 21 1 | 7.74658; 14.0941; 9.1196 90; 108.015; 90 | 946.87 | Yang, Shiping; Cheng, Rui; Zhang, Min; Bin, Zhengyang; You, Jingsong Rh/Ag-Mediated Peri-Selective Heteroarylation/Single Electron Transfer Annulation Cascade of 1-(Methylthio)naphthalenes and Analogues: Road Less Traveled to Benzo[de]thioacenes ACS Catalysis, 2019, 9, 6188 |
| 4514808 | CIF | C18 H10 S2 | P 1 21/c 1 | 3.95493; 12.7072; 25.5848 90; 91.496; 90 | 1285.35 | Yang, Shiping; Cheng, Rui; Zhang, Min; Bin, Zhengyang; You, Jingsong Rh/Ag-Mediated Peri-Selective Heteroarylation/Single Electron Transfer Annulation Cascade of 1-(Methylthio)naphthalenes and Analogues: Road Less Traveled to Benzo[de]thioacenes ACS Catalysis, 2019, 9, 6188 |
| 4514809 | CIF | C42 H78 N6 O Si6 Th | P -1 | 11.208; 13.909; 19.199 69.17; 83.14; 71.15 | 2647.3 | Saha, Sayantani; Eisen, Moris S. Catalytic Recycling of a Th–H Bond via Single or Double Hydroboration of Inactivated Imines or Nitriles ACS Catalysis, 2019, 9, 5947 |
| 4514810 | CIF | C10 H10 F2 O2 | P 1 21/c 1 | 9.946; 9.088; 10.222 90; 102.351; 90 | 902.6 | Nakayama, Yoshiki; Ando, Gaku; Abe, Manabu; Koike, Takashi; Akita, Munetaka Keto-Difluoromethylation of Aromatic Alkenes by Photoredox Catalysis: Step-Economical Synthesis of α-CF2H-Substituted Ketones in Flow ACS Catalysis, 2019, 9, 6555 |
| 4514811 | CIF | C15 H18 O2 | P n a 21 | 25.8841; 7.333; 6.343 90; 90; 90 | 1203.95 | Luo, Youran; Gutiérrez-Bonet, Álvaro; Matsui, Jennifer K.; Rotella, Madeline E.; Dykstra, Ryan; Gutierrez, Osvaldo; Molander, Gary A. Oxa- and Azabenzonorbornadienes as Electrophilic Partners under Photoredox/Nickel Dual Catalysis ACS Catalysis, 2019, 9, 8835 |
| 4514812 | CIF | C21 H29 N O2 | P 1 21 1 | 5.5974; 16.9126; 19.3211 90; 90.056; 90 | 1829.1 | Luo, Youran; Gutiérrez-Bonet, Álvaro; Matsui, Jennifer K.; Rotella, Madeline E.; Dykstra, Ryan; Gutierrez, Osvaldo; Molander, Gary A. Oxa- and Azabenzonorbornadienes as Electrophilic Partners under Photoredox/Nickel Dual Catalysis ACS Catalysis, 2019, 9, 8835 |
| 4514813 | CIF | C93 H84 F3 O31 P4 S Yb2 | P 1 21 1 | 17.0655; 17.2352; 23.1949 90; 95.16; 90 | 6794.6 | Luo, Weiwei; Sun, Zhicheng; Fernando, E. H. Nisala; Nesterov, Vladimir N.; Cundari, Thomas R.; Wang, Hong Asymmetric Ring-Opening of Donor‒Acceptor Cyclopropanes with Primary Arylamines Catalyzed by a Chiral Heterobimetallic Catalyst ACS Catalysis, 2019, 9, 8285 |
| 4514814 | CIF | C20 H23 N O5 | P 21 21 21 | 5.78428; 12.07053; 25.84988 90; 90; 90 | 1804.82 | Luo, Weiwei; Sun, Zhicheng; Fernando, E. H. Nisala; Nesterov, Vladimir N.; Cundari, Thomas R.; Wang, Hong Asymmetric Ring-Opening of Donor–Acceptor Cyclopropanes with Primary Arylamines Catalyzed by a Chiral Heterobimetallic Catalyst ACS Catalysis, 2019, 9, 8285 |
| 4514815 | CIF | C25 H9 B F15 N O | P 1 21/c 1 | 15.7548; 8.5218; 17.5186 90; 91.195; 90 | 2351.52 | Meng, Shan-Shui; Tang, Xiaowen; Luo, Xiang; Wu, Ruibo; Zhao, Jun-Ling; Chan, Albert S. C. Borane-Catalyzed Chemoselectivity-Controllable N-Alkylation and ortho C-Alkylation of Unprotected Arylamines Using Benzylic Alcohols ACS Catalysis, 2019, 9, 8397 |
| 4514816 | CIF | C44 H55 Au N O2 P | P -1 | 11.7663; 12.5195; 15.6679 101.971; 95.869; 117.925 | 1941.11 | Verlee, Arno; Heugebaert, Thomas; van der Meer, Tom; Kerchev, Pavel; Van Hecke, Kristof; Van Breusegem, Frank; Stevens, Christian V. Gold and Palladium Mediated Bimetallic Catalysis: Mechanistic Investigation through the Isolation of the Organogold(I) Intermediates ACS Catalysis, 2019, 9, 7862 |
| 4514817 | CIF | C30 H25 Au N O2 P | P 1 21/c 1 | 12.35599; 11.5441; 17.5685 90; 98.0363; 90 | 2481.34 | Verlee, Arno; Heugebaert, Thomas; van der Meer, Tom; Kerchev, Pavel; Van Hecke, Kristof; Van Breusegem, Frank; Stevens, Christian V. Gold and Palladium Mediated Bimetallic Catalysis: Mechanistic Investigation through the Isolation of the Organogold(I) Intermediates ACS Catalysis, 2019, 9, 7862 |
| 4514818 | CIF | C19 H20 O | P 1 21 1 | 8.803; 5.4591; 15.567 90; 104.94; 90 | 722.8 | Yu, Zhunzhun; Mendoza, Abraham Enantioselective Assembly of Congested Cyclopropanes using Redox-Active Aryldiazoacetates ACS Catalysis, 2019, 9, 7870 |
| 4514819 | CIF | C24 H16 Br N O4 | P 1 21 1 | 9.7213; 9.12937; 12.1367 90; 102.827; 90 | 1050.24 | Yu, Zhunzhun; Mendoza, Abraham Enantioselective Assembly of Congested Cyclopropanes using Redox-Active Aryldiazoacetates ACS Catalysis, 2019, 9, 7870 |
| 4514820 | CIF | C25 H15 N3 O | C 1 2/c 1 | 39.582; 6.6842; 13.9095 90; 97.656; 90 | 3647.3 | Tian, Cong; Dhawa, Uttam; Scheremetjew, Alexej; Ackermann, Lutz Cupraelectro-Catalyzed Alkyne Annulation: Evidence for Distinct C–H Alkynylation and Decarboxylative C–H/C–C Manifolds ACS Catalysis, 2019, 9, 7690 |
| 4514821 | CIF | C14 H17 N O2 | P 1 21/c 1 | 10.9605; 9.5967; 11.9487 90; 93.832; 90 | 1254 | Pang, Hailiang; Wu, Dong; Cong, Hengjiang; Yin, Guoyin Stereoselective Palladium-Catalyzed 1,3-Arylboration of Unconjugated Dienes for Expedient Synthesis of 1,3-Disubstituted Cyclohexanes ACS Catalysis, 2019, 9, 8555 |
| 4514822 | CIF | C16 H21 N O2 | P n a 21 | 23.054; 8.4318; 7.3235 90; 90; 90 | 1423.6 | Pang, Hailiang; Wu, Dong; Cong, Hengjiang; Yin, Guoyin Stereoselective Palladium-Catalyzed 1,3-Arylboration of Unconjugated Dienes for Expedient Synthesis of 1,3-Disubstituted Cyclohexanes ACS Catalysis, 2019, 9, 8555 |
| 4514823 | CIF | C15 H18 O3 | P 1 21/c 1 | 12.827; 20.383; 5.0473 90; 96.027; 90 | 1312.3 | Pang, Hailiang; Wu, Dong; Cong, Hengjiang; Yin, Guoyin Stereoselective Palladium-Catalyzed 1,3-Arylboration of Unconjugated Dienes for Expedient Synthesis of 1,3-Disubstituted Cyclohexanes ACS Catalysis, 2019, 9, 8555 |
| 4514824 | CIF | C16 H20 O3 | C 1 2/c 1 | 31.2814; 6.1424; 15.8248 90; 111.709; 90 | 2825 | Pang, Hailiang; Wu, Dong; Cong, Hengjiang; Yin, Guoyin Stereoselective Palladium-Catalyzed 1,3-Arylboration of Unconjugated Dienes for Expedient Synthesis of 1,3-Disubstituted Cyclohexanes ACS Catalysis, 2019, 9, 8555 |
| 4514825 | CIF | C19 H28 Cl Cu N3 O4 | P n a 21 | 23.1742; 9.9101; 9.2756 90; 90; 90 | 2130.22 | Hunt, Andrew P.; Batka, Allison E.; Hosseinzadeh, Marjan; Gregory, Jordan D.; Haque, Halima K.; Ren, Hang; Meyerhoff, Mark E.; Lehnert, Nicolai Nitric Oxide Generation On Demand for Biomedical Applications via Electrocatalytic Nitrite Reduction by Copper BMPA- and BEPA-Carboxylate Complexes. ACS catalysis, 2019, 9, 7746-7758 |
| 4514826 | CIF | C50 H52 Ir N4 | P 1 21/c 1 | 20.5401; 12.5368; 16.2915 90; 100.551; 90 | 4124.2 | Shon, Jong-Hwa; Sittel, Steven; Teets, Thomas S. Synthesis and Characterization of Strong Cyclometalated Iridium Photoreductants for Application in Photocatalytic Aryl Bromide Hydrodebromination ACS Catalysis, 2019, 9, 8646 |
| 4514827 | CIF | C43 H42 Ir N6 | P -1 | 10.1805; 13.1835; 14.4356 85.2561; 69.5849; 77.2239 | 1770.8 | Shon, Jong-Hwa; Sittel, Steven; Teets, Thomas S. Synthesis and Characterization of Strong Cyclometalated Iridium Photoreductants for Application in Photocatalytic Aryl Bromide Hydrodebromination ACS Catalysis, 2019, 9, 8646 |
| 4514828 | CIF | C41 H36 Ir N6 | P 1 21/n 1 | 14.476; 14.367; 34.464 90; 101.797; 90 | 7016.3 | Shon, Jong-Hwa; Sittel, Steven; Teets, Thomas S. Synthesis and Characterization of Strong Cyclometalated Iridium Photoreductants for Application in Photocatalytic Aryl Bromide Hydrodebromination ACS Catalysis, 2019, 9, 8646 |
| 4514829 | CIF | C39 H45 Ir N4 | P 1 21/c 1 | 11.3918; 14.4386; 20.4434 90; 99.64; 90 | 3315.1 | Shon, Jong-Hwa; Sittel, Steven; Teets, Thomas S. Synthesis and Characterization of Strong Cyclometalated Iridium Photoreductants for Application in Photocatalytic Aryl Bromide Hydrodebromination ACS Catalysis, 2019, 9, 8646 |
| 4514830 | CIF | C49 H55 Ir N6 | P 1 21/c 1 | 17.6455; 12.6291; 20.6034 90; 111.016; 90 | 4286 | Shon, Jong-Hwa; Sittel, Steven; Teets, Thomas S. Synthesis and Characterization of Strong Cyclometalated Iridium Photoreductants for Application in Photocatalytic Aryl Bromide Hydrodebromination ACS Catalysis, 2019, 9, 8646 |
| 4514831 | CIF | C11 H23 N3 O3 S | P 21 21 21 | 8.3707; 11.4502; 14.6387 90; 90; 90 | 1403.06 | Duhamel, Thomas; Martínez, Mario D.; Sideri, Ioanna K.; Muñiz, Kilian 1,3-Diamine Formation from an Interrupted Hofmann–Löffler Reaction: Iodine Catalyst Turnover through Ritter-Type Amination ACS Catalysis, 2019, 9, 7741 |
| 4514832 | CIF | C12 H18 N2 O2 S | P b c a | 17.0285; 6.9101; 21.3006 90; 90; 90 | 2506.41 | Duhamel, Thomas; Martínez, Mario D.; Sideri, Ioanna K.; Muñiz, Kilian 1,3-Diamine Formation from an Interrupted Hofmann–Löffler Reaction: Iodine Catalyst Turnover through Ritter-Type Amination ACS Catalysis, 2019, 9, 7741 |
| 4514833 | CIF | C29 H47 N3 O6 S | P 1 | 7.0841; 14.1779; 15.2277 98.32; 100.672; 103.356 | 1433.94 | Duhamel, Thomas; Martínez, Mario D.; Sideri, Ioanna K.; Muñiz, Kilian 1,3-Diamine Formation from an Interrupted Hofmann–Löffler Reaction: Iodine Catalyst Turnover through Ritter-Type Amination ACS Catalysis, 2019, 9, 7741 |
| 4514834 | CIF | C17 H20 N2 O2 S | P 1 21/n 1 | 10.2981; 7.0578; 21.651 90; 94.024; 90 | 1569.8 | Duhamel, Thomas; Martínez, Mario D.; Sideri, Ioanna K.; Muñiz, Kilian 1,3-Diamine Formation from an Interrupted Hofmann–Löffler Reaction: Iodine Catalyst Turnover through Ritter-Type Amination ACS Catalysis, 2019, 9, 7741 |
| 4514835 | CIF | C20 H30 Cl N3 O3 S | P b c a | 15.2153; 14.9228; 18.7632 90; 90; 90 | 4260.3 | Lam, Ying-Pong; Wang, Xinyan; Tan, Fei; Ng, Wing-Hin; Tse, Ying-Lung Steve; Yeung, Ying-Yeung Amide/Iminium Zwitterionic Catalysts for (Trans)esterification: Application in Biodiesel Synthesis ACS Catalysis, 2019, 9, 8083 |
| 4514836 | CIF | C32 H29 N O4 S | P 1 21/c 1 | 13.6328; 9.7259; 19.2323 90; 94.976; 90 | 2540.42 | Zeng, Rong; Li, Jun-Long; Zhang, Xiang; Liu, Yan-Qing; Jia, Zhi-Qiang; Leng, Hai-Jun; Huang, Qian-Wei; Liu, Yue; Li, Qing-Zhu Diastereoselective Construction of 6,8-Dioxabicyclo[3.2.1]octane Frameworks from Vinylethylene Carbonates via Palladium-Organo Relay Catalysis ACS Catalysis, 2019, 9, 8256 |
| 4514837 | CIF | C27 H27 N O4 S | P 1 21/c 1 | 37.0525; 12.0473; 10.4128 90; 90.415; 90 | 4647.97 | Zeng, Rong; Li, Jun-Long; Zhang, Xiang; Liu, Yan-Qing; Jia, Zhi-Qiang; Leng, Hai-Jun; Huang, Qian-Wei; Liu, Yue; Li, Qing-Zhu Diastereoselective Construction of 6,8-Dioxabicyclo[3.2.1]octane Frameworks from Vinylethylene Carbonates via Palladium-Organo Relay Catalysis ACS Catalysis, 2019, 9, 8256 |
| 4514838 | CIF | C25 H23 N O2 | P 1 21/c 1 | 18.0757; 14.6438; 7.2015 90; 101.012; 90 | 1871.12 | Zeng, Rong; Li, Jun-Long; Zhang, Xiang; Liu, Yan-Qing; Jia, Zhi-Qiang; Leng, Hai-Jun; Huang, Qian-Wei; Liu, Yue; Li, Qing-Zhu Diastereoselective Construction of 6,8-Dioxabicyclo[3.2.1]octane Frameworks from Vinylethylene Carbonates via Palladium-Organo Relay Catalysis ACS Catalysis, 2019, 9, 8256 |
| 4514839 | CIF | C21 H26 B N O4 S | P 21 21 21 | 10.4319; 14.2343; 29.1953 90; 90; 90 | 4335.2 | Kim, Jeongho; Shin, Minkyeong; Cho, Seung Hwan Copper-Catalyzed Diastereoselective and Enantioselective Addition of 1,1-Diborylalkanes to Cyclic Ketimines and α-Imino Esters ACS Catalysis, 2019, 9, 8503 |
| 4514840 | CIF | C21 H26 B N O5 S | P 31 | 9.9417; 9.9417; 18.9939 90; 90; 120 | 1625.8 | Kim, Jeongho; Shin, Minkyeong; Cho, Seung Hwan Copper-Catalyzed Diastereoselective and Enantioselective Addition of 1,1-Diborylalkanes to Cyclic Ketimines and α-Imino Esters ACS Catalysis, 2019, 9, 8503 |
| 4514841 | CIF | C23 H36 B F3 N2 O6 S | P 21 21 21 | 9.2674; 10.7476; 28.5667 90; 90; 90 | 2845.3 | Kim, Jeongho; Shin, Minkyeong; Cho, Seung Hwan Copper-Catalyzed Diastereoselective and Enantioselective Addition of 1,1-Diborylalkanes to Cyclic Ketimines and α-Imino Esters ACS Catalysis, 2019, 9, 8503 |
| 4514842 | CIF | C31 H65 K N3 Si6 Y | P -1 | 9.999; 11.964; 19.292 83.01; 85.8; 82.27 | 2266.1 | Zhai, Dan-Dan; Du, Hui-Zhen; Zhang, Xiang-Yu; Liu, Yu-Feng; Guan, Bing-Tao Potassium Yttrium Ate Complexes: Synergistic Effect Enabled Reversible H2 Activation and Catalytic Hydrogenation ACS Catalysis, 2019, 9, 8766 |
| 4514843 | CIF | C29 H69 K N3 O Si6 Y | P 1 21/c 1 | 11.344; 11.734; 31.997 90; 92.915; 90 | 4253.6 | Zhai, Dan-Dan; Du, Hui-Zhen; Zhang, Xiang-Yu; Liu, Yu-Feng; Guan, Bing-Tao Potassium Yttrium Ate Complexes: Synergistic Effect Enabled Reversible H2 Activation and Catalytic Hydrogenation ACS Catalysis, 2019, 9, 8766 |
| 4514844 | CIF | C38 H30 F6 N2 O4 Pd S4 | C 1 2/c 1 | 15.336; 10.1947; 24.0955 90; 98.408; 90 | 3726.7 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514845 | CIF | C34 H26 Cl2 F6 N2 O4 Pd S4 | P -1 | 9.0381; 10.3207; 10.3832 68.768; 89.673; 88.327 | 902.4 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514846 | CIF | C17 H15 N O2 S2 | C 1 2/c 1 | 32.753; 4.888; 23.981 90; 124.967; 90 | 3146.2 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514847 | CIF | C22 H23 N O2 S2 | P -1 | 8.6349; 9.3163; 13.5605 70.251; 85.755; 83.165 | 1018.75 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514848 | CIF | C22 H24 O6 | P 1 21/c 1 | 19.271; 4.5166; 23.345 90; 107.803; 90 | 1934.6 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514849 | CIF | C24 H23 N O4 S2 | P 1 21/c 1 | 15.796; 15.246; 9.849 90; 105.81; 90 | 2282.17 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514850 | CIF | C23 H26 O6 | P -1 | 9.7261; 10.89; 11.528 65.75; 69.528; 86.877 | 1037.3 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514851 | CIF | C23 H19 N S2 | P 1 21/n 1 | 10.584; 4.346; 40.473 90; 95.273; 90 | 1853.8 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514852 | CIF | C20 H18 F N O2 S2 | P -1 | 7.0055; 10.2801; 13.131 79.22; 84.888; 80.238 | 913.91 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514853 | CIF | C24 H32 O10 | P 1 21 1 | 11.2; 5.0559; 11.554 90; 115.351; 90 | 591.25 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514854 | CIF | C28 H25 N O4 S2 | P -1 | 8.4844; 12.3314; 12.7997 112.337; 94.171; 98.558 | 1212.59 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514855 | CIF | C19 H16 Cl N O2 S2 | P -1 | 6.5696; 10.4589; 13.1664 79.911; 84.189; 81.356 | 877.96 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514856 | CIF | C23 H19 N O2 S3 | P 1 21/n 1 | 6.9999; 10.6761; 27.063 90; 92.75; 90 | 2020.1 | Romine, Andrew M.; Yang, Kin S.; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Synthetic and Mechanistic Studies of a Versatile Heteroaryl Thioether Directing Group for Pd(II) Catalysis ACS Catalysis, 2019, 9, 7626 |
| 4514857 | CIF | C23 H17 Br N2 | P 1 21 1 | 11.03; 5.7133; 14.591 90; 92.925; 90 | 918.3 | Hatano, Manabu; Nishio, Kosuke; Mochizuki, Takuya; Nishikawa, Keisuke; Ishihara, Kazuaki Highly Active Chiral Dilithium(I) Binaphthyldisulfonate Catalysts for Enantio- and Chemoselective Strecker-Type Reactions ACS Catalysis, 2019, 9, 8178 |
| 4514858 | CIF | C20 H19 N O3 S | P 1 21/c 1 | 8.2877; 14.334; 14.903 90; 103.09; 90 | 1724.4 | Liu, Jibing; Chakraborty, Pushkin; Zhang, Heng; Zhong, Liang; Wang, Zhi-Xiang; Huang, Xueliang Gold-Catalyzed Atom-Economic Synthesis of Sulfone-Containing Pyrrolo[2,1-a]isoquinolines from Diynamides: Evidence for Consecutive Sulfonyl Migration ACS Catalysis, 2019, 9, 2610 |
| 4514859 | CIF | C17 H19 N O6 S | P 1 21/c 1 | 7.5531; 28.802; 8.5314 90; 113.57; 90 | 1701.1 | Liu, Jibing; Chakraborty, Pushkin; Zhang, Heng; Zhong, Liang; Wang, Zhi-Xiang; Huang, Xueliang Gold-Catalyzed Atom-Economic Synthesis of Sulfone-Containing Pyrrolo[2,1-a]isoquinolines from Diynamides: Evidence for Consecutive Sulfonyl Migration ACS Catalysis, 2019, 9, 2610 |
| 4514860 | CIF | C22 H25 I N2 O2 Ru | P -1 | 8.8149; 10.4274; 12.2762 74.663; 83.855; 77.212 | 1059.8 | Kumar, Abhishek; Semwal, Shrivats; Choudhury, Joyanta Catalytic Conversion of CO2 to Formate with Renewable Hydrogen Donors: An Ambient-Pressure and H2-Independent Strategy ACS Catalysis, 2019, 9, 2164 |
| 4514861 | CIF | C20 H14 Cl N O | P 1 | 8.6566; 11.3426; 16.584 89.235; 77.991; 89.031 | 1592.41 | Fan, Xiaozhong; Zhang, Xue; Li, Chunyu; Gu, Zhenhua Enantioselective Atropisomeric Anilides Synthesis via Cu-Catalyzed Intramolecular Adjacent C–N Coupling ACS Catalysis, 2019, 9, 2286 |
| 4514862 | CIF | C28 H32 N2 O2 | P 1 21/c 1 | 13.969; 27.1371; 6.25424 90; 99.738; 90 | 2336.69 | Wu, Xiao; Chen, Chentuo; Guo, Ziyang; North, Michael; Whitwood, Adrian C. Metal- and Halide-Free Catalyst for the Synthesis of Cyclic Carbonates from Epoxides and Carbon Dioxide ACS Catalysis, 2019, 9, 1895 |
| 4514863 | CIF | C13 H12 Br Mn N2 O4 | P 1 21/c 1 | 11.071; 10.4143; 13.4557 90; 105.015; 90 | 1498.43 | Steinlechner, Christoph; Roesel, Arend F.; Oberem, Elisabeth; Päpcke, Ayla; Rockstroh, Nils; Gloaguen, Frédéric; Lochbrunner, Stefan; Ludwig, Ralf; Spannenberg, Anke; Junge, Henrik; Francke, Robert; Beller, Matthias Selective Earth-Abundant System for CO2 Reduction: Comparing Photo- and Electrocatalytic Processes ACS Catalysis, 2019, 9, 2091 |
| 4514864 | CIF | C15 H10 Br Mn N2 O4 | P -1 | 7.1769; 9.2213; 11.5716 85.6351; 84.0784; 82.509 | 753.7 | Steinlechner, Christoph; Roesel, Arend F.; Oberem, Elisabeth; Päpcke, Ayla; Rockstroh, Nils; Gloaguen, Frédéric; Lochbrunner, Stefan; Ludwig, Ralf; Spannenberg, Anke; Junge, Henrik; Francke, Robert; Beller, Matthias Selective Earth-Abundant System for CO2 Reduction: Comparing Photo- and Electrocatalytic Processes ACS Catalysis, 2019, 9, 2091 |
| 4514865 | CIF | C17 H13 Br O3 | P c a 21 | 10.7383; 18.1542; 7.5303 90; 90; 90 | 1468 | Zhang, Cheng; Li, Hongli; Pei, Chao; Qiu, Lihua; Hu, Wenhao; Bao, Xiaoguang; Xu, Xinfang Selective Vinylogous Reactivity of Carbene Intermediate in Gold-Catalyzed Alkyne Carbocyclization: Synthesis of Indenols ACS Catalysis, 2019, 9, 2440 |
| 4514866 | CIF | C27 H32 O3 | P 1 21 1 | 9.72; 7.5084; 16.171 90; 94.588; 90 | 1176.4 | Zhang, Cheng; Li, Hongli; Pei, Chao; Qiu, Lihua; Hu, Wenhao; Bao, Xiaoguang; Xu, Xinfang Selective Vinylogous Reactivity of Carbene Intermediate in Gold-Catalyzed Alkyne Carbocyclization: Synthesis of Indenols ACS Catalysis, 2019, 9, 2440 |
| 4514867 | CIF | C18 H12 F3 N3 O3 | P 1 21/c 1 | 10.5383; 19.337; 7.9828 90; 92.029; 90 | 1625.7 | Zhang, Cheng; Li, Hongli; Pei, Chao; Qiu, Lihua; Hu, Wenhao; Bao, Xiaoguang; Xu, Xinfang Selective Vinylogous Reactivity of Carbene Intermediate in Gold-Catalyzed Alkyne Carbocyclization: Synthesis of Indenols ACS Catalysis, 2019, 9, 2440 |
| 4514868 | CIF | C50 H39 N Ni O P2 | P -1 | 13.3161; 14.0105; 15.2863 72.192; 64.226; 62.74 | 2262.59 | Orsino, Alessio F.; Gutiérrez Del Campo, Manuel; Lutz, Martin; Moret, Marc-Etienne Enhanced Catalytic Activity of Nickel Complexes of an Adaptive Diphosphine-Benzophenone Ligand in Alkyne Cyclotrimerization. ACS catalysis, 2019, 9, 2458-2481 |
| 4514869 | CIF | C49 H39 N Ni O P2 | P -1 | 9.5744; 11.9148; 18.1503 102.462; 103.789; 97.605 | 1926.26 | Orsino, Alessio F.; Gutiérrez Del Campo, Manuel; Lutz, Martin; Moret, Marc-Etienne Enhanced Catalytic Activity of Nickel Complexes of an Adaptive Diphosphine-Benzophenone Ligand in Alkyne Cyclotrimerization. ACS catalysis, 2019, 9, 2458-2481 |
| 4514870 | CIF | C54 H47 Ni P3 | P 1 21/c 1 | 20.6558; 9.9242; 22.517 90; 109.612; 90 | 4348 | Orsino, Alessio F.; Gutiérrez Del Campo, Manuel; Lutz, Martin; Moret, Marc-Etienne Enhanced Catalytic Activity of Nickel Complexes of an Adaptive Diphosphine-Benzophenone Ligand in Alkyne Cyclotrimerization. ACS catalysis, 2019, 9, 2458-2481 |
| 4514871 | CIF | C54.5 H46 Ni O P2 | P -1 | 10.3659; 14.4217; 16.331 102.781; 99.4257; 110.567 | 2149.77 | Orsino, Alessio F.; Gutiérrez Del Campo, Manuel; Lutz, Martin; Moret, Marc-Etienne Enhanced Catalytic Activity of Nickel Complexes of an Adaptive Diphosphine-Benzophenone Ligand in Alkyne Cyclotrimerization. ACS catalysis, 2019, 9, 2458-2481 |
| 4514872 | CIF | C210 H154 Br2 Cu6 F18 N30 O24 | P -1 | 15.8225; 19.4848; 21.1157 70.092; 81.078; 72.501 | 5827.6 | Prakasam, Thirumurugan; Devaraj, Anthonisamy; Saha, Rupak; Lusi, Matteo; Brandel, Jeremy; Esteban-Gómez, David; Platas-Iglesias, Carlos; Olson, Mark Anthony; Mukherjee, Partha Sarathi; Trabolsi, Ali Metal‒Organic Self-Assembled Trefoil Knots for C—Br Bond Activation ACS Catalysis, 2019, 9, 1907 |
| 4514873 | CIF | C18 H28 O2 | P 3 | 15.378; 15.378; 5.9449 90; 90; 120 | 1217.5 | Yang, Junfeng; Sun, Qiao; Yoshikai, Naohiko Cobalt-Catalyzed Regio- and Diastereoselective Formal [3 + 2] Cycloaddition between Cyclopropanols and Allenes ACS Catalysis, 2019, 9, 1973 |
| 4514874 | CIF | C19 H26 O | I -4 c 2 | 15.4852; 15.4852; 26.1457 90; 90; 90 | 6269.5 | Yang, Junfeng; Sun, Qiao; Yoshikai, Naohiko Cobalt-Catalyzed Regio- and Diastereoselective Formal [3 + 2] Cycloaddition between Cyclopropanols and Allenes ACS Catalysis, 2019, 9, 1973 |
| 4514875 | CIF | C21 H22 O | P 1 21/n 1 | 8.787; 11.718; 14.849 90; 95.361; 90 | 1522.3 | Yang, Junfeng; Sun, Qiao; Yoshikai, Naohiko Cobalt-Catalyzed Regio- and Diastereoselective Formal [3 + 2] Cycloaddition between Cyclopropanols and Allenes ACS Catalysis, 2019, 9, 1973 |
| 4514876 | CIF | C20 H19 N3 O2 | P 21 21 21 | 7.1039; 11.823; 19.698 90; 90; 90 | 1654.4 | Zhang, Lin-Bao; Zhu, Ming-Hui; Ni, Shao-Fei; Wen, Li-Rong; Li, Ming Silver-Mediated Indole (4 + 2) Dearomative Annulation with N-Radicals: A Strategy To Construct Heterocycle-Fused Indolines ACS Catalysis, 2019, 9, 1680 |
| 4514877 | CIF | C27 H31 O2 Si | C 1 2/c 1 | 27.6888; 8.415; 21.6977 90; 90.427; 90 | 5055.5 | Zhang, Shuo; Yao, Qi-Jun; Liao, Gang; Li, Xin; Li, Han; Chen, Hao-Ming; Hong, Xin; Shi, Bing-Feng Enantioselective Synthesis of Atropisomers Featuring Pentatomic Heteroaromatics by Pd-Catalyzed C‒H Alkynylation ACS Catalysis, 2019, 9, 1956 |
| 4514878 | CIF | C30 H32 O S Si | P 21 21 21 | 10.8692; 13.9222; 17.5154 90; 90; 90 | 2650.49 | Zhang, Shuo; Yao, Qi-Jun; Liao, Gang; Li, Xin; Li, Han; Chen, Hao-Ming; Hong, Xin; Shi, Bing-Feng Enantioselective Synthesis of Atropisomers Featuring Pentatomic Heteroaromatics by Pd-Catalyzed C–H Alkynylation ACS Catalysis, 2019, 9, 1956 |
| 4514879 | CIF | C32 H33 N O Si | P 1 21 1 | 7.3547; 43.2835; 8.7345 90; 93.821; 90 | 2774.3 | Zhang, Shuo; Yao, Qi-Jun; Liao, Gang; Li, Xin; Li, Han; Chen, Hao-Ming; Hong, Xin; Shi, Bing-Feng Enantioselective Synthesis of Atropisomers Featuring Pentatomic Heteroaromatics by Pd-Catalyzed C–H Alkynylation ACS Catalysis, 2019, 9, 1956 |
| 4514880 | CIF | C23 H30 Br Mn N2 O9 P2 | P -1 | 11.5014; 12.237; 12.4559 61.15; 71.428; 73.307 | 1436.6 | Woo, Sung-Jun; Choi, Sunghan; Kim, So-Yoen; Kim, Pil Soo; Jo, Ju Hyoung; Kim, Chul Hoon; Son, Ho-Jin; Pac, Chyongjin; Kang, Sang Ook Highly Selective and Durable Photochemical CO2 Reduction by Molecular Mn(I) Catalyst Fixed on a Particular Dye-Sensitized TiO2 Platform ACS Catalysis, 2019, 9, 2580 |
| 4514881 | CIF | C17 H16 Br2 O5 | P 1 21/c 1 | 20.647; 10.3884; 17.2385 90; 114.021; 90 | 3377.26 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514882 | CIF | C17 H15 Cl O5 | P 1 21 1 | 6.1976; 17.271; 7.158 90; 103.688; 90 | 744.4 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514883 | CIF | C30 H25 Br N2 O5 | P 1 21 1 | 11.584; 7.7058; 15.1367 90; 109.376; 90 | 1274.63 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514884 | CIF | C11 H12 O5 | P 21 21 21 | 6.0801; 8.1103; 22.242 90; 90; 90 | 1096.8 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514885 | CIF | C33 H33 N3 O8 S | P 21 21 21 | 8.7971; 17.2916; 20.3839 90; 90; 90 | 3100.7 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514886 | CIF | C27 H26 Cl N O7 | P 1 21/c 1 | 6.2963; 32.789; 11.523 90; 100.644; 90 | 2338 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514887 | CIF | C11 H12 O5 | C 1 c 1 | 6.0855; 12.683; 13.554 90; 93.29; 90 | 1044.4 | Gao, Xing; Xia, Miaoren; Yuan, Chunhao; Zhou, Leijie; Sun, Wei; Li, Cheng; Wu, Bo; Zhu, Dongyu; Zhang, Cheng; Zheng, Bing; Wang, Dongqi; Guo, Hongchao Enantioselective Synthesis of Chiral Medium-Sized Cyclic Compounds via Tandem Cycloaddition/Cope Rearrangement Strategy ACS Catalysis, 2019, 9, 1645 |
| 4514888 | CIF | C28 H26 F6 N2 O8 | P 21 21 21 | 11.7248; 13.6488; 19.0159 90; 90; 90 | 3043.1 | Sletten, Eric T.; Tu, Yi-Jung; Schlegel, H. Bernhard; Nguyen, Hien M. Are Brønsted Acids the True Promoter of Metal-Triflate-Catalyzed Glycosylations? A Mechanistic Probe into 1,2-cis-Aminoglycoside Formation by Nickel Triflate ACS Catalysis, 2019, 9, 2110 |
| 4514889 | CIF | C16 H12 Cl N S | P n a 21 | 7.6912; 23.747; 7.518 90; 90; 90 | 1373.1 | Wang, Huamin; Li, Yongli; Lu, Qingquan; Yu, Mingming; Bai, Xudong; Wang, Shengchun; Cong, Hengjiang; Zhang, Heng; Lei, Aiwen Oxidation-Induced β-Selective C–H Bond Functionalization: Thiolation and Selenation of N-Heterocycles ACS Catalysis, 2019, 9, 1888 |
| 4515457 | CIF | C27 H25 N | P -1 | 11.627; 11.659; 15.889 85.73; 77.49; 69.54 | 1970.1 | Tian, Jun-Jie; Zeng, Ning-Ning; Liu, Ning; Tu, Xian-Shuang; Wang, Xiao-Chen Intramolecular Cyclizations of Vinyl-Substituted N,N-Dialkyl Arylamines Enabled by Borane-Assisted Hydride Transfer ACS Catalysis, 2018, 9, 295 |
| 4515458 | CIF | C25 H19 Br Mn N2 O2 P | P 1 21/c 1 | 12.9669; 13.874; 12.3572 90; 93.057; 90 | 2219.93 | Das, Uttam Kumar; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Milstein, David Dehydrogenative Cross-Coupling of Primary Alcohols To Form Cross-Esters Catalyzed by a Manganese Pincer Complex ACS Catalysis, 2018, 9, 479 |
| 4515459 | CIF | C32 H26 Mn N2 O3 P | P 1 21/c 1 | 9.7663; 16.9042; 16.0896 90; 97.951; 90 | 2630.72 | Das, Uttam Kumar; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Milstein, David Dehydrogenative Cross-Coupling of Primary Alcohols To Form Cross-Esters Catalyzed by a Manganese Pincer Complex ACS Catalysis, 2018, 9, 479 |
| 4515460 | CIF | C18 H23 N3 O2 | P 1 21/c 1 | 8.3986; 10.167; 18.964 90; 101.38; 90 | 1587.5 | van der Puyl, Vincent A.; Derosa, Joseph; Engle, Keary M. Directed, Nickel-Catalyzed Umpolung 1,2-Carboamination of Alkenyl Carbonyl Compounds ACS Catalysis, 2018, 9, 224 |
| 4515461 | CIF | C20 H27 N3 O2 | P -1 | 9.4368; 11.2965; 18.1549 81.081; 81.652; 73.77 | 1825.2 | van der Puyl, Vincent A.; Derosa, Joseph; Engle, Keary M. Directed, Nickel-Catalyzed Umpolung 1,2-Carboamination of Alkenyl Carbonyl Compounds ACS Catalysis, 2018, 9, 224 |
| 4515462 | CIF | C22 H33 B F2 O4 Si | P 21 21 21 | 7.4443; 10.4007; 31.5827 90; 90; 90 | 2445.32 | Guo, Wen-Hao; Zhao, Hai-Yang; Luo, Zhi-Ji; Zhang, Shu; Zhang, Xingang Fluoroalkylation–Borylation of Alkynes: An Efficient Method To Obtain (Z)-Tri- and Tetrasubstituted Fluoroalkylated Alkenylboronates ACS Catalysis, 2018, 9, 38 |
| 4515463 | CIF | C28 H47 B O8 P2 Pd | C 1 2/c 1 | 26.0162; 11.1134; 23.2857 90; 108.358; 90 | 6389.9 | Espinosa, Matthew R.; Charboneau, David J.; Garcia de Oliveira, André; Hazari, Nilay Controlling Selectivity in the Hydroboration of Carbon Dioxide to the Formic Acid, Formaldehyde, and Methanol Oxidation Levels ACS Catalysis, 2018, 9, 301 |
| 4515464 | CIF | C9 H15 B O2 | I 41/a c d :2 | 13.2301; 13.2301; 38.893 90; 90; 90 | 6807.7 | Espinosa, Matthew R.; Charboneau, David J.; Garcia de Oliveira, André; Hazari, Nilay Controlling Selectivity in the Hydroboration of Carbon Dioxide to the Formic Acid, Formaldehyde, and Methanol Oxidation Levels ACS Catalysis, 2018, 9, 301 |
| 4515465 | CIF | C15 H15 Cl N2 | P 1 21/n 1 | 8.473; 17.4446; 9.0374 90; 94.072; 90 | 1332.43 | Fu, Niankai; Shen, Yifan; Allen, Anthony R.; Song, Lu; Ozaki, Atsushi; Lin, Song Mn-Catalyzed Electrochemical Chloroalkylation of Alkenes. ACS catalysis, 2019, 9, 746-754 |
| 4515466 | CIF | C18 H14 F3 N O4 | P 1 21 1 | 11.8498; 9.5906; 14.708 90; 96.008; 90 | 1662.33 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515467 | CIF | C17 H15 N O4 | P 1 21 1 | 13.5517; 9.2461; 11.8061 90; 106.796; 90 | 1416.2 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515468 | CIF | C60 H79 N6 O15 P | P 21 21 21 | 9.8665; 19.0145; 31.36 90; 90; 90 | 5883.3 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515469 | CIF | C17 H14 Br N O4 | I 1 2 1 | 22.7393; 5.2121; 14.2943 90; 93.045; 90 | 1691.76 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515470 | CIF | C17 H15 N O4 | P 1 21 1 | 10.8042; 8.4963; 15.825 90; 103.232; 90 | 1414.1 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515471 | CIF | C18 H17 N O4 | P -1 | 9.806; 14.9855; 21.2136 89.141; 86.664; 88.303 | 3110.4 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515472 | CIF | C36 H57 N7 O7 | C 1 2 1 | 26.466; 17.7566; 22.8328 90; 124.789; 90 | 8812.3 | Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J. Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones. ACS catalysis, 2019, 9, 242-252 |
| 4515473 | CIF | C20 H23 N O2 | P b c a | 13.76; 7.1297; 34.2631 90; 90; 90 | 3361.37 | Ho, Hon Eong; Stephens, Thomas C.; Payne, Thomas J.; O’Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Merging π-Acid and Pd Catalysis: Dearomatizing Spirocyclization/Cross-Coupling Cascade Reactions of Alkyne-Tethered Aromatics ACS Catalysis, 2018, 9, 504 |
| 4515474 | CIF | C45.67 H35.35 Cl3.35 N2 O2 | I 1 2/a 1 | 7.38319; 26.3138; 19.6731 90; 93.6518; 90 | 3814.33 | Ho, Hon Eong; Stephens, Thomas C.; Payne, Thomas J.; O’Brien, Peter; Taylor, Richard J. K.; Unsworth, William P. Merging π-Acid and Pd Catalysis: Dearomatizing Spirocyclization/Cross-Coupling Cascade Reactions of Alkyne-Tethered Aromatics ACS Catalysis, 2018, 9, 504 |
| 4515475 | CIF | C22 H40 Mn N3 O5 P2 S | P b c a | 11.5; 14.765; 34.41 90; 90; 90 | 5843 | Bertini, Federica; Glatz, Mathias; Stöger, Berthold; Peruzzini, Maurizio; Veiros, Luis F.; Kirchner, Karl; Gonsalvi, Luca Carbon Dioxide Reduction to Methanol Catalyzed by Mn(I) PNP Pincer Complexes under Mild Reaction Conditions ACS Catalysis, 2018, 9, 632 |
| 4515476 | CIF | C27 H29 N | P -1 | 8.9763; 10.84; 11.572 109.84; 99.23; 93.29 | 1037.8 | Tang, Bin; Hu, Xiaoyan; Liu, Chunli; Jiang, Tao; Alam, Fakhre; Chen, Yanhui Tandem Cyclization/Hydroarylation of α,ω-Dienes Triggered by Scandium-Catalyzed C–H Activation ACS Catalysis, 2018, 9, 599 |
| 4515477 | CIF | C23 H40 N Sc Si2 | P -1 | 9.616; 10.433; 13.436 100.936; 95.927; 95.808 | 1306.3 | Tang, Bin; Hu, Xiaoyan; Liu, Chunli; Jiang, Tao; Alam, Fakhre; Chen, Yanhui Tandem Cyclization/Hydroarylation of α,ω-Dienes Triggered by Scandium-Catalyzed C‒H Activation ACS Catalysis, 2018, 9, 599 |
| 4515478 | CIF | C15 H24 F6 N P | C 1 c 1 | 19.003; 10.452; 8.8763 90; 96.73; 90 | 1750.9 | Tang, Bin; Hu, Xiaoyan; Liu, Chunli; Jiang, Tao; Alam, Fakhre; Chen, Yanhui Tandem Cyclization/Hydroarylation of α,ω-Dienes Triggered by Scandium-Catalyzed C–H Activation ACS Catalysis, 2018, 9, 599 |
| 4515479 | CIF | C29 H20 B F18 N6 Rh | P 1 21/c 1 | 18.0106; 9.0679; 19.7109 90; 96.859; 90 | 3196.1 | Avullala, Thirupataiah; Asgari, Parham; Hua, Yuanda; Bokka, Apparao; Ridlen, Shawn G.; Yum, Kyungsuk; Dias, H. V. Rasika; Jeon, Junha Umpolung <i>α</i>-Silylation of Cyclopropyl Acetates via Low-Temperature Catalytic C-C Activation. ACS catalysis, 2019, 9, 402-408 |
| 4515480 | CIF | C36 H48 Cl2 N2 O Ru | P 1 21/c 1 | 19.3364; 10.43031; 16.58648 90; 95.7369; 90 | 3328.48 | Małecki, Paweł; Gajda, Katarzyna; Gajda, Roman; Woźniak, Krzysztof; Trzaskowski, Bartosz; Kajetanowicz, Anna; Grela, Karol Specialized Ruthenium Olefin Metathesis Catalysts Bearing Bulky Unsymmetrical NHC Ligands: Computations, Synthesis, and Application ACS Catalysis, 2018, 9, 587 |
| 4515481 | CIF | C53 H50 Cl2 N2 O Ru | P 1 21/n 1 | 13.16; 10.12687; 37.8176 90; 98.1376; 90 | 4989.19 | Małecki, Paweł; Gajda, Katarzyna; Gajda, Roman; Woźniak, Krzysztof; Trzaskowski, Bartosz; Kajetanowicz, Anna; Grela, Karol Specialized Ruthenium Olefin Metathesis Catalysts Bearing Bulky Unsymmetrical NHC Ligands: Computations, Synthesis, and Application ACS Catalysis, 2018, 9, 587 |
| 4515482 | CIF | C41 H48 Br N3 O7 | P 21 21 21 | 11.6704; 12.4895; 24.8148 90; 90; 90 | 3616.94 | Paria, Suva; Kang, Qi-Kai; Hatanaka, Miho; Maruoka, Keiji Design of Efficient Chiral Bifunctional Phase-Transfer Catalysts Possessing an Amino Functionality for Asymmetric Aminations ACS Catalysis, 2018, 9, 78 |
| 4515483 | CIF | C71 H72 N2 Ni | P 21 21 21 | 14.9159; 18.747; 20.4012 90; 90; 90 | 5704.8 | Cai, Yuan; Zhang, Jia-Wen; Li, Feng; Liu, Jia-Ming; Shi, Shi-Liang Nickel/N-Heterocyclic Carbene Complex-Catalyzed Enantioselective Redox-Neutral Coupling of Benzyl Alcohols and Alkynes to Allylic Alcohols ACS Catalysis, 2018, 9, 1 |
| 4515484 | CIF | C23 H22 N2 O4 S2 | P 1 | 9.0036; 10.9036; 11.9944 103.063; 98.741; 91.068 | 1132 | Yang, Shengbiao; Wang, Lihong; Zhang, Hongwei; Liu, Chunyang; Zhang, Linli; Wang, Xiaomin; Zhang, Ge; Li, Yan; Zhang, Qian Copper-Catalyzed Asymmetric Aminocyanation of Arylcyclopropanes for Synthesis of γ-Amino Nitriles ACS Catalysis, 2018, 9, 716 |
| 4515485 | CIF | C37 H31 F2 I P2 Pd | C 1 2/c 1 | 12.09; 15.2246; 20.0614 90; 91.35; 90 | 3691.6 | Hori, Kaishi; Motohashi, Hirotaka; Saito, Daichi; Mikami, Koichi Precatalyst Effects on Pd-Catalyzed Cross-Coupling Difluoromethylation of Aryl Boronic Acids ACS Catalysis, 2018, 9, 417 |
| 4515486 | CIF | C56 H34 F16 Ir N4 P | C 1 2/c 1 | 16.49; 22.606; 13.5064 90; 90.007; 90 | 5034.8 | Boyaala, Rabab; Touzani, Rachid; Roisnel, Thierry; Dorcet, Vincent; Caytan, Elsa; Jacquemin, Denis; Boixel, Julien; Guerchais, Véronique; Doucet, Henri; Soulé, Jean-François Catalyst-Controlled Regiodivergent C‒H Arylation Site of Fluorinated 2-Arylpyridine Derivatives: Application to Luminescent Iridium(III) Complexes ACS Catalysis, 2018, 9, 1320 |
| 4515487 | CIF | C49 H32 Cl2 F16 Ir N4 P | P -1 | 11.7565; 12.8586; 18.657 81.314; 80.238; 73.409 | 2648.1 | Boyaala, Rabab; Touzani, Rachid; Roisnel, Thierry; Dorcet, Vincent; Caytan, Elsa; Jacquemin, Denis; Boixel, Julien; Guerchais, Véronique; Doucet, Henri; Soulé, Jean-François Catalyst-Controlled Regiodivergent C‒H Arylation Site of Fluorinated 2-Arylpyridine Derivatives: Application to Luminescent Iridium(III) Complexes ACS Catalysis, 2018, 9, 1320 |
| 4515488 | CIF | C56 H34 F16 Ir N4 P | R -3 :H | 26.5472; 26.5472; 38.495 90; 90; 120 | 23494.8 | Boyaala, Rabab; Touzani, Rachid; Roisnel, Thierry; Dorcet, Vincent; Caytan, Elsa; Jacquemin, Denis; Boixel, Julien; Guerchais, Véronique; Doucet, Henri; Soulé, Jean-François Catalyst-Controlled Regiodivergent C‒H Arylation Site of Fluorinated 2-Arylpyridine Derivatives: Application to Luminescent Iridium(III) Complexes ACS Catalysis, 2018, 9, 1320 |
| 4515489 | CIF | C27 H43 Al Cl N3 Si3 | P -1 | 9.6279; 10.9013; 17.0857 98.271; 102.568; 108.408 | 1616.39 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515490 | CIF | C24 H24 Al N3 | P 21 21 21 | 7.3795; 13.4511; 21.1096 90; 90; 90 | 2095.39 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515491 | CIF | C18 H19 Al Cl N3 | P 1 21/c 1 | 8.9033; 22.602; 8.763 90; 100.967; 90 | 1731.2 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515492 | CIF | C35 H44 Al N4 | P -1 | 9.0364; 10.9957; 16.5417 91.033; 97.953; 107.345 | 1550.72 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515493 | CIF | C29 H33 Al N3 | P 1 21/n 1 | 9.6204; 24.1661; 10.8834 90; 94.131; 90 | 2523.68 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515494 | CIF | C33 H48 Al N3 Si3 | P -1 | 9.2076; 12.1268; 16.763 98.513; 98.865; 103.694 | 1763.3 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515495 | CIF | C15 H24 Al Cl4 N3 O7 | P 1 21/n 1 | 7.0617; 25.6486; 13.413 90; 105.218; 90 | 2344.2 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515496 | CIF | C27 H37 Al Cl N3 | P 1 21/n 1 | 9.2525; 15.9339; 17.4939 90; 95.425; 90 | 2567.5 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515497 | CIF | C27 H38 Al N3 | P -1 | 8.9098; 9.0012; 17.5788 89.93; 76.945; 69.158 | 1278.64 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515498 | CIF | C33 H42 Al N3 | P 1 21/c 1 | 16.055; 10.4568; 35.146 90; 98.496; 90 | 5835.7 | Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A. Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration ACS Catalysis, 2018, 9, 874 |
| 4515499 | CIF | C57 H34 B2 F30 Nd Si3 | C 1 2/c 1 | 39.687; 12.1443; 26.344 90; 98.409; 90 | 12561 | Schmidt, Bradley M.; Pindwal, Aradhana; Venkatesh, Amrit; Ellern, Arkady; Rossini, Aaron J.; Sadow, Aaron D. Zwitterionic Trivalent (Alkyl)lanthanide Complexes in Ziegler-Type Butadiene Polymerization ACS Catalysis, 2018, 9, 827 |
| 4515500 | CIF | C20 H16 O4 | I 1 a 1 | 6.101; 7.1857; 36.046 90; 94.848; 90 | 1574.6 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515501 | CIF | C23 H31 Cl Fe N2 | P 1 2/c 1 | 14.4785; 9.0523; 16.7522 90; 92.179; 90 | 2194 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515502 | CIF | C29 H35 Cl Fe N2 | P b c a | 16.5485; 10.4399; 31.246 90; 90; 90 | 5398.2 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515503 | CIF | C26 H38 Cl Fe N3 | P b c a | 11.9206; 15.6644; 27.735 90; 90; 90 | 5178.93 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515504 | CIF | C37 H40 Fe N2 | P 1 21/c 1 | 12.631; 15.5444; 16.5595 90; 105.365; 90 | 3135.1 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515505 | CIF | C25 H35 Cl Fe N2 | P 1 21/c 1 | 17.827; 15.8552; 11.0869 90; 104.133; 90 | 3038.9 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515506 | CIF | C24 H20 Fe2 | P 1 21/n 1 | 11.736; 10.478; 14.979 90; 102.775; 90 | 1796.4 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515507 | CIF | C28 H41 Cl Fe N2 | P 21 21 21 | 8.6146; 17.039; 19.7629 90; 90; 90 | 2900.9 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515508 | CIF | C32 H41 Cl Fe N2 | P 1 21/c 1 | 8.4344; 22.681; 15.3166 90; 90.017; 90 | 2930.1 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515509 | CIF | C26 H37 Cl Fe N2 | P 1 21/c 1 | 8.5309; 16.6841; 17.0048 90; 91.196; 90 | 2419.8 | Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes ACS Catalysis, 2018, 9, 810 |
| 4515510 | CIF | C19 H13 N O4 S | P -1 | 7.0423; 9.2936; 12.8025 89.117; 75.476; 77.243 | 790.39 | Shu, Chao; Shi, Chong-Yang; Sun, Qing; Zhou, Bo; Li, Tian-You; He, Qiao; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu Generation of Endocyclic Vinyl Carbene Complexes via Gold-Catalyzed Oxidative Cyclization of Terminal Diynes: Toward Naphthoquinones and Carbazolequinones ACS Catalysis, 2018, 9, 1019 |
| 4515511 | CIF | C30 H29 Al N4 O | P -1 | 9.633; 11.189; 12.051 89.56; 71.1; 83.22 | 1220 | Mandal, Mukunda; Luke, Anna M.; Dereli, Büşra; Elwell, Courtney E.; Reineke, Theresa M.; Tolman, William B.; Cramer, Christopher J. Computational Prediction and Experimental Verification of ε-Caprolactone Ring-Opening Polymerization Activity by an Aluminum Complex of an Indolide/Schiff-Base Ligand ACS Catalysis, 2018, 9, 885 |
| 4515512 | CIF | C26 H30 N2 O3 | P 21 21 21 | 9.1036; 13.3256; 36.2038 90; 90; 90 | 4391.92 | Shen, Hong-Cheng; Zhang, Ling; Chen, Shu-Sen; Feng, Jiajie; Zhang, Bo-Wen; Zhang, Ying; Zhang, Xinhao; Wu, Yun-Dong; Gong, Liu-Zhu Enantioselective Addition of Cyclic Ketones to Unactivated Alkenes Enabled by Amine/Pd(II) Cooperative Catalysis ACS Catalysis, 2018, 9, 791 |
| 4515513 | CIF | C25 H27 Br N2 O2 | P 21 21 21 | 9.0909; 13.2501; 36.0908 90; 90; 90 | 4347.3 | Shen, Hong-Cheng; Zhang, Ling; Chen, Shu-Sen; Feng, Jiajie; Zhang, Bo-Wen; Zhang, Ying; Zhang, Xinhao; Wu, Yun-Dong; Gong, Liu-Zhu Enantioselective Addition of Cyclic Ketones to Unactivated Alkenes Enabled by Amine/Pd(II) Cooperative Catalysis ACS Catalysis, 2018, 9, 791 |
| 4516631 | CIF | C15 H12 Co2 N4 O7 | C 1 2/c 1 | 34.882; 10.203; 13.579 90; 112.867; 90 | 4453 | Wang, Hai-Hua; Hou, Lei; Li, Yong-Zhi; Jiang, Chen-Yu; Wang, Yao-Yu; Zhu, Zhonghua Porous MOF with Highly Efficient Selectivity and Chemical Conversion for CO<sub>2</sub>. ACS applied materials & interfaces, 2017, 9, 17969-17976 |
| 4516632 | CIF | C36 H24 Cl2 Cu12 N36 Na2 O24 | P -1 | 10.5333; 12.8234; 13.1215 84.199; 82.718; 67.584 | 1622.5 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516633 | CIF | C36 H24 Br2 Cu12 N36 Na2 O24 | P -1 | 10.327; 13.165; 13.182 89.986; 81.289; 68.559 | 1645.9 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516634 | CIF | C36 H24 Cu12 I2 N36 Na2 O24 | P -1 | 10.397; 13.176; 13.196 89.966; 81.245; 69.982 | 1676.1 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516635 | CIF | C18 H12 Cl Cu6 K N18 O12 | P -1 | 10.602; 12.725; 13.11 83.607; 81.991; 67.784 | 1618 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516636 | CIF | C18 H12 Br Cu6 K N18 O12 | P -1 | 10.2886; 13.1326; 13.1248 89.9; 68.551; 81.119 | 1627.88 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516637 | CIF | C18 H12 Cu6 I K N18 O12 | P -1 | 10.336; 13.12; 13.11 89.928; 69.412; 81.047 | 1641.3 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516638 | CIF | C45 H64 Cu6 F N33 O27 | P -1 | 12.9723; 15.0889; 17.921 90.4389; 90.3035; 93.3656 | 3501.6 | Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides. ACS applied materials & interfaces, 2017, 9, 19980-19987 |
| 4516639 | CIF | C36 H34 B N | P 1 21/c 1 | 13.112; 13.4058; 16.2914 90; 101.021; 90 | 2810.84 | Lee, Young Hoon; Park, Sunghee; Oh, Jihun; Shin, Jong Won; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung Rigidity-Induced Delayed Fluorescence by Ortho Donor-Appended Triarylboron Compounds: Record-High Efficiency in Pure Blue Fluorescent Organic Light-Emitting Diodes. ACS applied materials & interfaces, 2017, 9, 24035-24042 |
| 4516640 | CIF | C36 H34 B N O | P 1 21/c 1 | 15.361; 12.176; 14.9 90; 90.95; 90 | 2786.4 | Lee, Young Hoon; Park, Sunghee; Oh, Jihun; Shin, Jong Won; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung Rigidity-Induced Delayed Fluorescence by Ortho Donor-Appended Triarylboron Compounds: Record-High Efficiency in Pure Blue Fluorescent Organic Light-Emitting Diodes. ACS applied materials & interfaces, 2017, 9, 24035-24042 |
| 4516641 | CIF | C36 H34 B N | P 1 21/n 1 | 8.346; 18.245; 17.714 90; 93.04; 90 | 2693.6 | Lee, Young Hoon; Park, Sunghee; Oh, Jihun; Shin, Jong Won; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung Rigidity-Induced Delayed Fluorescence by Ortho Donor-Appended Triarylboron Compounds: Record-High Efficiency in Pure Blue Fluorescent Organic Light-Emitting Diodes. ACS applied materials & interfaces, 2017, 9, 24035-24042 |
| 4516642 | CIF | C26 H18 Co4 N20 O10 | P -1 | 7.988; 9.978; 11.035 104.884; 98.534; 103.807 | 804.6 | Gong, Teng; Lou, Xiaobing; Gao, En-Qing; Hu, Bingwen Pillared-Layer Metal-Organic Frameworks for Improved Lithium-Ion Storage Performance. ACS applied materials & interfaces, 2017, 9, 21839-21847 |
| 4516643 | CIF | C22 H36 N2 O6 | P 21 21 21 | 5.6365; 7.316; 54.623 90; 90; 90 | 2252.5 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Surface-Tuned and Metal-Ion-Responsive Supramolecular Gels Based on Nucleolipids. ACS applied materials & interfaces, 2017, 9, 22864-22874 |
| 4516644 | CIF | C26 H44 N2 O6 | P 21 21 21 | 5.5928; 7.2712; 63.511 90; 90; 90 | 2582.8 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Surface-Tuned and Metal-Ion-Responsive Supramolecular Gels Based on Nucleolipids. ACS applied materials & interfaces, 2017, 9, 22864-22874 |
| 4516645 | CIF | C24 H40 N2 O6 | P 21 21 21 | 5.6059; 7.3036; 59.161 90; 90; 90 | 2422.24 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Surface-Tuned and Metal-Ion-Responsive Supramolecular Gels Based on Nucleolipids. ACS applied materials & interfaces, 2017, 9, 22864-22874 |
| 4516646 | CIF | C45 H28 N10 Ni3 O18 | R -3 :H | 22.3712; 22.3712; 95.1715 90; 90; 120 | 41249.3 | Yu, Mei-Hui; Zhang, Ping; Feng, Rui; Yao, Zhao-Quan; Yu, Yi-Chen; Hu, Tong-Liang; Bu, Xian-He Construction of a Multi-Cage-Based MOF with a Unique Network for Efficient CO<sub>2</sub> Capture. ACS applied materials & interfaces, 2017, 9, 26177-26183 |
| 4516647 | CIF | C54 H24 Br6 Fe2 N6 O26 | P -3 1 m | 13.7841; 13.7841; 9.2424 90; 90; 120 | 1520.8 | Benmansour, Samia; Abhervé, Alexandre; Gómez-Claramunt, Patricia; Vallés-García, Cristina; Gómez-García, Carlos J Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 26210-26218 |
| 4516648 | CIF | C54 H24 Cl6 Fe2 N6 O26 | P -3 1 m | 13.6909; 13.6909; 9.1968 90; 90; 120 | 1492.9 | Benmansour, Samia; Abhervé, Alexandre; Gómez-Claramunt, Patricia; Vallés-García, Cristina; Gómez-García, Carlos J Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 26210-26218 |
| 4516649 | CIF | C27 H30 B3 N3 O9 | P -1 | 15.255; 15.812; 16.019 61.29; 71.61; 83 | 3214 | Gontarczyk, Krzysztof; Bury, Wojciech; Serwatowski, Janusz; Wieciński, Piotr; Woźniak, Krzysztof; Durka, Krzysztof; Luliński, Sergiusz Hybrid Triazine-Boron Two-Dimensional Covalent Organic Frameworks: Synthesis, Characterization, and DFT Approach to Layer Interaction Energies. ACS applied materials & interfaces, 2017, 9, 31129-31141 |
| 4516650 | CIF | C42 H33 In3 N0 O20 P2 | C 1 2/c 1 | 28.825; 11.472; 18.905 90; 106.62; 90 | 5990 | Du, Xi; Fan, Ruiqing; Qiang, Liangsheng; Xing, Kai; Ye, Haoxin; Ran, Xinya; Song, Yang; Wang, Ping; Yang, Yulin Controlled Zn<sup>2+</sup>-Triggered Drug Release by Preferred Coordination of Open Active Sites within Functionalization Indium Metal Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 28939-28948 |
| 4516651 | CIF | C21 H12 In N0 O7 P | R 3 :H | 14.1755; 14.1755; 9.5058 90; 90; 120 | 1654.2 | Du, Xi; Fan, Ruiqing; Qiang, Liangsheng; Xing, Kai; Ye, Haoxin; Ran, Xinya; Song, Yang; Wang, Ping; Yang, Yulin Controlled Zn<sup>2+</sup>-Triggered Drug Release by Preferred Coordination of Open Active Sites within Functionalization Indium Metal Organic Frameworks. ACS applied materials & interfaces, 2017, 9, 28939-28948 |
| 4516652 | CIF | C52 H36 Cd5 N8 O28 | I 1 2/a 1 | 16.039; 13.034; 42.157 90; 100.927; 90 | 8653 | Hong, Xu-Jia; Wei, Qin; Cai, Yue-Peng; Wu, Bing-Bing; Feng, Hai-Xing; Yu, Ying; Dong, Ren-Feng Pillar-Layered Metal-Organic Framework with Sieving Effect and Pore Space Partition for Effective Separation of Mixed Gas C<sub>2</sub>H<sub>2</sub>/C<sub>2</sub>H<sub>4</sub>. ACS applied materials & interfaces, 2017, 9, 29374-29379 |
| 4516742 | CIF | C78 H60 Cu3 N8 O15 | R -3 :H | 15.598; 15.598; 59.01 90; 90; 120 | 12434 | Wang, Xiao-Kun; Liu, Jiang; Zhang, Lei; Dong, Long-Zhang; Li, Shun-Li; Kan, Yu-He; Li, Dong-Sheng; Lan, Ya-Qian Monometallic Catalytic Models Hosted in Stable Metal‒Organic Frameworks for Tunable CO2 Photoreduction ACS Catalysis, 2019, 9, 1726 |
| 4516743 | CIF | C78 H66 Co3 N8 O18 | R -3 :H | 15.7439; 15.7439; 61.146 90; 90; 120 | 13125.7 | Wang, Xiao-Kun; Liu, Jiang; Zhang, Lei; Dong, Long-Zhang; Li, Shun-Li; Kan, Yu-He; Li, Dong-Sheng; Lan, Ya-Qian Monometallic Catalytic Models Hosted in Stable Metal‒Organic Frameworks for Tunable CO2 Photoreduction ACS Catalysis, 2019, 9, 1726 |
| 4516744 | CIF | C468 H450 N48 Ni18 O135 | R -3 :H | 15.7128; 15.7128; 60.539 90; 90; 120 | 12944.1 | Wang, Xiao-Kun; Liu, Jiang; Zhang, Lei; Dong, Long-Zhang; Li, Shun-Li; Kan, Yu-He; Li, Dong-Sheng; Lan, Ya-Qian Monometallic Catalytic Models Hosted in Stable Metal‒Organic Frameworks for Tunable CO2 Photoreduction ACS Catalysis, 2019, 9, 1726 |
| 4516815 | CIF | C11 H6 Br N | P -1 | 4.7861; 5.9851; 7.9546 83.224; 75.23; 84.63 | 218.31 | Ossowski, Jakub; Wächter, Tobias; Silies, Laura; Kind, Martin; Noworolska, Agnieszka; Blobner, Florian; Gnatek, Dominika; Rysz, Jakub; Bolte, Michael; Feulner, Peter; Terfort, Andreas; Cyganik, Piotr; Zharnikov, Michael Thiolate versus Selenolate: Structure, Stability, and Charge Transfer Properties. ACS nano, 2015, 9, 4508-4526 |
| 4516816 | CIF | C11 H8 Br N O | P 1 21/c 1 | 18.518; 6.151; 8.6436 90; 90.291; 90 | 984.53 | Ossowski, Jakub; Wächter, Tobias; Silies, Laura; Kind, Martin; Noworolska, Agnieszka; Blobner, Florian; Gnatek, Dominika; Rysz, Jakub; Bolte, Michael; Feulner, Peter; Terfort, Andreas; Cyganik, Piotr; Zharnikov, Michael Thiolate versus Selenolate: Structure, Stability, and Charge Transfer Properties. ACS nano, 2015, 9, 4508-4526 |
| 4518011 | CIF | C39 H72 N15 P3 | P 1 21/c 1 | 19.771; 13.978; 16.975 90; 90.001; 90 | 4691 | Wang, Lebin; Zhang, Jinbo; Zhao, Na; Ren, Chuanli; Liu, Shaofeng; Li, Zhibo Synthesis of Tris-Phosphazene Bases with Triazine as Core and Their Applications for Efficient Ring-Opening Alternating Copolymerization of Epoxide and Anhydride: Notable Effect of Basicity and Molecular Size ACS Macro Letters, 2020, 9, 1398-1402 |
| 4518012 | CIF | C21 H54 N15 P3 | P 1 2/c 1 | 23.6761; 7.0053; 22.401 90; 117.192; 90 | 3304.8 | Wang, Lebin; Zhang, Jinbo; Zhao, Na; Ren, Chuanli; Liu, Shaofeng; Li, Zhibo Synthesis of Tris-Phosphazene Bases with Triazine as Core and Their Applications for Efficient Ring-Opening Alternating Copolymerization of Epoxide and Anhydride: Notable Effect of Basicity and Molecular Size ACS Macro Letters, 2020, 9, 1398-1402 |
| 4518408 | CIF | C164 H312 N16 O19 Zn8 | P 1 21/c 1 | 17.095; 14.339; 38.364 90; 106.233; 90 | 9029.1 | Krupiński, Piotr; Grala, Agnieszka; Wolska-Pietkiewicz, Małgorzata; Danowski, Wojciech; Justyniak, Iwona; Lewiński, Janusz From Uncommon Ethylzinc Complexes Supported by Ureate Ligands to Water-Soluble ZnO Nanocrystals: A Mechanochemical Approach ACS Sustainable Chemistry & Engineering, 2021, 9, 1540-1549 |
| 4518484 | CIF | C26 H45 N8 O30 Zn3.5 | P -1 | 7.272; 11.453; 12.792 105.317; 97.72; 94.62 | 1010.7 | Li, Yixing; Zhang, Xiao; Lan, Jianwen; Li, Dazhi; Wang, Zhijiang; Xu, Ping; Sun, Jianmin A High-Performance Zinc-Organic Framework with Accessible Open Metal Sites Catalyzes CO2 and Styrene Oxide into Styrene Carbonate under Mild Conditions ACS Sustainable Chemistry & Engineering, 2021, 9, 2795-2803 |
| 4518547 | CIF | C20 H27 N O2 | P -1 | 7.9105; 10.1433; 12.1778 68.787; 73.015; 71.871 | 847.74 | Zhou, Kun; Hao, Hong-Yan; Mao, Yang-Jie; Wu, Qiu-Zi; Chen, Lei; Wang, Shuang; Jin, Wu; Xu, Zhen-Yuan; Lou, Shao-Jie; Xu, Dan-Qian Solvent-less Dehydrogenative C–H Etherification with Alcohols Using Mechanochemistry ACS Sustainable Chemistry & Engineering, 2021, 9, 4433-4439 |
| 4518570 | CIF | C14 H14 N4 O6 V2 Zn | P 1 21/c 1 | 8.0272; 10.3866; 21.6398 90; 95.314; 90 | 1796.5 | Tian, Hongrui; Liu, Shumei; Zhang, Zhong; Dang, Tianyi; Lu, Ying; Liu, Shuxia Highly Stable Polyoxovanadate-Based Zn‒MOF with Dual Active Sites as a Solvent-free Catalyst for C‒C Bond Formation ACS Sustainable Chemistry & Engineering, 2021, 9, 4660-4667 |
| 4518716 | CIF | C12 H8 Br N O2 S2 | P -1 | 7.3124; 8.0674; 11.1844 90.429; 96.849; 93.54 | 653.76 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518717 | CIF | C12 H8 Br N O2 S2 | P -1 | 7.5012; 7.6684; 12.37 77.306; 82.115; 74.588 | 666.8 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518718 | CIF | C12 H8 Cl N O2 S2 | P -1 | 7.4862; 7.6173; 12.26 77.313; 81.768; 74.085 | 653.34 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518719 | CIF | C13 H11 N O2 S2 | P 1 21/c 1 | 6.637; 24.4347; 7.9539 90; 93.577; 90 | 1287.4 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518720 | CIF | C13 H9 Cl O2 S2 | P 1 21/c 1 | 5.4415; 7.9266; 30.427 90; 94.695; 90 | 1308 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518721 | CIF | C13 H9 Br O2 S2 | P 1 21/c 1 | 5.4811; 7.9282; 30.7236 90; 95.134; 90 | 1329.75 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518722 | CIF | C14 H14 O2 S2 | P 21 21 21 | 5.9037; 12.98; 17.9041 90; 90; 90 | 1371.99 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518723 | CIF | C12 H8 F2 S2 | P 21 21 21 | 5.7416; 13.0516; 14.497 90; 90; 90 | 1086.36 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4518724 | CIF | C12 H8 Br2 S2 | C c c 2 | 7.7242; 28.033; 5.9565 90; 90; 90 | 1289.8 | Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178 |
| 4519018 | CIF | C19 H15 F N O2 P | P -1 | 8.6254; 8.9016; 10.8499 80.225; 85.954; 77.248 | 800.24 | Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering, 2021, 9, 10704-10709 |
| 4519019 | CIF | C21 H20 N O4 P | P -1 | 11.1796; 12.4375; 14.5087 102.974; 93.417; 104.758 | 1886.37 | Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering, 2021, 9, 10704-10709 |
| 4519020 | CIF | C15 H16 N O2 P | P -1 | 8.7838; 8.7951; 20.4442 90.45; 93.891; 117.301 | 1398.88 | Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering, 2021, 9, 10704-10709 |
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