Crystallography Open Database

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4514699 CIFC30 H41 Br1.02 Fe P3P -19.4966; 9.593; 17.63
101.894; 96.481; 102.236
1515.2Schild, 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 CIFC30 H41 Fe N4 P3P 1 21/c 117.626; 10.7764; 16.1774
90; 98.63; 90
3038Schild, 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 CIFC129 H106 B2 F48 Fe2 N8 P6P 1 21/n 122.4451; 12.1053; 25.482
90; 101.904; 90
6774.7Schild, 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 CIFC42 H65 Fe K N2 O6 P3P 1 21/n 110.4864; 23.9154; 17.8619
90; 93.645; 90
4470.5Schild, 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 CIFC40 H61 Fe K N2 O4 P3P n m a25.9569; 17.0296; 12.1851
90; 90; 90
5386.2Schild, 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 CIFC84 H130 Fe2 K4 N4 O6 P6P 1 21/n 114.6713; 16.6256; 18.7129
90; 102.506; 90
4456.1Schild, 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 CIFC33 H50 Fe K N2 P3 SiP 21 21 2110.5863; 16.3326; 20.8095
90; 90; 90
3598Schild, 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 CIFC28 H26 N4 O2 PdP 1 21/n 18.3908; 20.0893; 14.6398
90; 100.46; 90
2426.75Luo, 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 CIFC26 H28 Cl2 Co N4 OP 21 21 219.5625; 11.3203; 24.4937
90; 90; 90
2651.5Chen, Xu; Cheng, Zhaoyang; Lu, Zhan
Cobalt-Catalyzed Asymmetric Markovnikov Hydroboration of Styrenes
ACS Catalysis, 2019, 9, 4025
4514708 CIFC63 H73 Ni2 O3 P2P -110.2617; 16.0861; 17.7316
100.697; 90.004; 105.821
2763.17Liu, 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 CIFC32 H37 Ni O2 P SP -18.6245; 9.0612; 20.838
84.848; 88.901; 62.929
1443.8Liu, 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 CIFC34 H42 B Ni O3 PP 1 21/c 122.1829; 9.2102; 15.4936
90; 94.271; 90
3156.7Liu, 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 CIFC36 H44 B Ni O PP 1 21/n 18.8285; 20.3843; 17.3286
90; 95.23; 90
3105.5Liu, 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 CIFC28 H31 Ni PP -18.8889; 15.1597; 17.8889
91.217; 96.831; 90.693
2392.67Liu, 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 CIFC28 H30 Br Ni PP n a 2116.7529; 10.1199; 14.6061
90; 90; 90
2476.28Liu, 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 CIFC21 H31 B2 N O4P 1 21/c 115.588; 10.6978; 14.1186
90; 107.935; 90
2239.97Liu, 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 CIFC23 H21 Br N2 O3P 329.5332; 9.5332; 19.5349
90; 90; 120
1537.51Das, 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 CIFC14 H11 N O2 S2P 1 21/n 18.3903; 17.9634; 9.3448
90; 112.656; 90
1299.75Nguyen, 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 CIFC18 H10 Br2 N2 O2 SI 1 2/a 117.7962; 4.9199; 19.1526
90; 105.417; 90
1616.57Nguyen, 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 CIFC12 H11 N O2 SP 1 21/c 114.2892; 10.414; 7.4904
90; 103.95; 90
1081.76Nguyen, 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 CIFC18 H10 Cl2 N2 SI 1 2/c 118.9763; 13.5616; 24.1428
90; 95.348; 90
6186.1Nguyen, 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 CIFC10 H8 Cl N O2 SP 1 21/c 114.4698; 5.8318; 11.9918
90; 103.449; 90
984.18Nguyen, 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 CIFC17 H15 Cl N2 O4 SP 1 21/n 110.7209; 11.7327; 13.2944
90; 97.17; 90
1659.16Nguyen, 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 CIFC16 H13 N O2 SP 1 21/c 18.3782; 8.266; 20.0756
90; 97; 90
1379.96Nguyen, 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 CIFC18 H10 Cl2 N2 O2 SP 1 21/c 112.9582; 9.0843; 14.2001
90; 108.155; 90
1588.37Nguyen, 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 CIFC14 H13 N O2 SP 21 21 218.9497; 9.3068; 15.389
90; 90; 90
1281.8Nguyen, 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 CIFC16 H12 Cl N O2 SP 1 21/c 18.2088; 24.9454; 6.8433
90; 94.558; 90
1396.88Nguyen, 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 CIFC18 H12 N2 O2 SP -17.6361; 13.7285; 14.864
69.516; 85.244; 83.871
1449.62Nguyen, 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 CIFC17 H14 F N O4 SP -17.5118; 8.3229; 12.1237
84.045; 88.396; 77.487
735.96Nguyen, 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 CIFC22 H24 N2 O6 SP -17.8092; 9.7669; 14.5366
104.686; 101.315; 100.756
1018.49Nguyen, 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 CIFC22 H22 Cl N O2 SC 1 2/c 115.7798; 11.6418; 22.199
90; 106.677; 90
3906.54Nguyen, 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 CIFC18 H20 I2 N4 PdP 1 21/c 18.3065; 16.337; 7.6187
90; 99.14; 90
1020.8Chernyshev, 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 CIFC26 H36 Br4 Hg2 N4C 1 2/c 118.486; 9.2309; 20.682
90; 106.8; 90
3378.6Chernyshev, 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 CIFC18 H20 Hg2 I4 N4P 1 21/n 110.648; 20.021; 12.134
90; 95.49; 90
2574.9Chernyshev, 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 CIFC102.56 H52 F2 O34 Zr6P 6/m m m39.446; 39.446; 16.4166
90; 90; 120
22122Liu, 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 CIFC51 H53 Ni P2P 1 2/c 122.883; 9.2579; 21.1481
90; 115.533; 90
4042.6Charboneau, 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 CIFC17 H14 Cl N O4P 21 21 217.7672; 8.6398; 22.845
90; 90; 90
1533.1Dai, Yuanwei; Tian, Baotong; Chen, Huan; Zhang, Qiang
Palladium-Catalyzed Stereospecific C-Glycosylation of Glycals with Vinylogous Acceptors
ACS Catalysis, 2019, 9, 2909
4514736 CIFC22 H37 N3 O4 SiP 1 21 19.1154; 9.7854; 14.6304
90; 96.443; 90
1296.76Zhan, 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 CIFC89 H64 Al B2 F36 N O6 P4 Rh2P -114.5138; 18.5644; 21.462
104.385; 102.683; 107.545
5062.15Adams, 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 CIFC27 H36 Cl F Ni P2P 1 21/n 111.8371; 14.1571; 16.2044
90; 99.776; 90
2676.1Russell, 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 CIFC29 H42 F N Ni O3 P2 SP 1 21/m 18.6752; 12.5702; 14.4059
90; 101.795; 90
1537.78Russell, 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 CIFC32 H58 Co I N4 P2 ZrP n m a15.4307; 22.1735; 10.8845
90; 90; 90
3724.2Gramigna, 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 CIFC56 H92 Co2 I6 N4 P4 Zr2P -111.4073; 12.4796; 14.109
100.063; 97.493; 112.211
1787.87Gramigna, 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 CIFC45 H67 Co I N2 O P3 ZrP -19.9663; 10.4166; 23.1907
81.58; 83.529; 82.278
2349.34Gramigna, 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 CIFC35 H65 Co I N2 O P3 ZrC 1 2/c 138.6599; 12.0858; 18.3535
90; 103.833; 90
8326.7Gramigna, 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 CIFC45 H69 Co I N2 O P3 ZrP -112.2182; 13.374; 16.9003
70.756; 71.3; 74.862
2432.1Gramigna, 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 CIFC46 H64 Co I N2 O P2 ZrP -110.7474; 11.7734; 20.3607
77.69; 79.557; 69.802
2345.95Gramigna, 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 CIFC31 H38 B N3 O4P 1 21 16.5323; 24.418; 9.191
90; 104.387; 90
1420.04Liu, 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 CIFC17 H18 N2 O3 PdP 1 21/n 18.6104; 10.5955; 17.71
90; 99.051; 90
1595.59Liu, 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 CIFC30 H36 B N3 O3P 1 21 16.3743; 23.6017; 9.0486
90; 101.68; 90
1333.12Liu, 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 CIFC44 H40 N6 O10 Zn2P -18.7707; 11.7137; 13.5892
82.784; 81.615; 88.403
1370.2Markad, 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 CIFC42 H33 Cl F2 Ni P2C 1 2/c 130.115; 11.645; 20.4586
90; 102.223; 90
7012Stadler, Sonja M.; Göttker-Schnetmann, Inigo; Mecking, Stefan
Incorporation of Radicals during Ni(II)-Catalyzed Ethylene Insertion Polymerization
ACS Catalysis, 2019, 9, 2760
4514751 CIFC51 H58 F2 N Ni O2 PP b c a16.868; 20.0011; 26.7439
90; 90; 90
9022.8Stadler, Sonja M.; Göttker-Schnetmann, Inigo; Mecking, Stefan
Incorporation of Radicals during Ni(II)-Catalyzed Ethylene Insertion Polymerization
ACS Catalysis, 2019, 9, 2760
4514752 CIFC10 H9 Br O3P 1 21 14.7773; 16.685; 6.289
90; 104.66; 90
485Sawano, Takahiro; Yamamoto, Hisashi
Enantioselective Epoxidation of β,γ-Unsaturated Carboxylic Acids by a Cooperative Binuclear Titanium Complex
ACS Catalysis, 2019, 9, 3384
4514753 CIFC22 H19 Br N2 O2P 21 21 217.3331; 9.8564; 25.7259
90; 90; 90
1859.42Yang, 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 CIFC36 H32 Cl2 N4 O2P 1 21 111.3963; 10.25731; 13.268
90; 95.0958; 90
1544.84Yang, 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 CIFC22 H19 N O3 SP 1 21 117.546; 6.607; 17.993
90; 115.207; 90
1887.2Bai, 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 CIFC25 H24 N O3 SP 21 21 219.162; 10.694; 22.484
90; 90; 90
2203Bai, 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 CIFC29 H21 N O3 SP 21 21 216.556; 13.237; 25.625
90; 90; 90
2223.8Bai, 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 CIFC23 H21 N O5 SP 21 21 218.9405; 10.0639; 23.127
90; 90; 90
2080.9Bai, 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 CIFC18 H16 Br2 O2P -324.679; 24.679; 9.5417
90; 90; 120
5032.8Trost, 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 CIFC12.5 H16 Cl2 Co N1.5 OP 18.5586; 8.9303; 9.6822
76.723; 86.703; 85.126
717.08Wen, 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 CIFC16 H18 Cl2 Co N2 OP 1 21 19.7507; 13.413; 12.9181
90; 90.316; 90
1689.48Wen, 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 CIFC29.48 H29.66 Cl1.27 N O3C 1 2 125.1281; 6.268; 15.987
90; 99.524; 90
2483.29Trost, 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 CIFC22 H19 O PP 1 21 115.7797; 6.4246; 18.8309
90; 114.711; 90
1734.23Lu, 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 CIFC27 H26 F2 N O2 PP 1 21 110.6041; 11.5598; 19.577
90; 94.744; 90
2391.6Lu, 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 CIFC24 H21 O3 PP 21 21 219.561; 9.713; 20.717
90; 90; 90
1923.9Lu, 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 CIFC20 H27 N O6P 1 21 16.03; 19.3547; 9.0029
90; 102.453; 90
1026Sim, 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 CIFC15 H16 O2P 21 21 215.6039; 10.7509; 19.196
90; 90; 90
1156.5Zheng, 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 CIFC35 H51 F6 N3 O5 S2 ZnP 21 21 2113.6599; 14.2563; 20.5882
90; 90; 90
4009.34Procter, 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 CIFC37 H47 F6 N3 O4 S2 ZnP 1 21/c 119.3499; 20.6938; 20.4521
90; 105.975; 90
7873.2Procter, 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 CIFC26.67 H32.67 Cl2 F4 N2 O2.67 S1.33 Zn0.67P -110.0474; 16.5268; 16.5479
117.002; 106.69; 94.539
2273.4Procter, 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 CIFC47 H56 N2 ZnP 1 21/c 119.3717; 16.9243; 27.5305
90; 101.738; 90
8837.2Procter, 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 CIFC35 H54 Cl2 N2 O1.5 ZnP 1 21/c 112.9149; 19.5194; 19.2829
90; 133.379; 90
3533.1Procter, 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 CIFC41 H52 N2 ZnP 1 21/c 120.3293; 9.7719; 18.4536
90; 106.688; 90
3511.5Procter, 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 CIFC43 H57 F6 N3 O6 S2 ZnP -111.9544; 13.4764; 15.7416
95.505; 100.925; 110.249
2299.96Procter, 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 CIFC19 H18 O2P 21 21 219.663; 9.7186; 31.0442
90; 90; 90
2915.39Yang, Junfeng; Sekiguchi, Yoshiya; Yoshikai, Naohiko
Cobalt-Catalyzed Enantioselective and Chemodivergent Addition of Cyclopropanols to Oxabicyclic Alkenes
ACS Catalysis, 2019, 9, 5638
4514776 CIFC27 H25 O3 P SP 21 21 213.6131; 35.785; 9.9738
90; 90; 90
4858.7Zhang, 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 CIFC46 H72 Dy F9 N4 O17 S3P 1 21 112.1386; 16.1932; 15.8018
90; 97.546; 90
3079.1Zhang, 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 CIFC51 H84 F9 N4 O18 Pr S3P 1 21 112.1823; 16.5445; 16.408
90; 101.368; 90
3242.2Zhang, 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 CIFC53 H82 F9 N4 O15 S3 TmP 21 21 2115.6161; 19.6361; 21.6999
90; 90; 90
6654Zhang, 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 CIFC44 H40 O P2P 21 21 219.9449; 17.1268; 19.9556
90; 90; 90
3398.92Batuecas, 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 CIFC17 H11 Cr F O5P 17.0791; 7.2172; 16.4881
85.775; 87.502; 64.437
757.81Batuecas, 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 CIFC43 H32 Cl2 N4 OP -111.209; 13.582; 13.728
60.753; 79.38; 76.89
1769.4Takamatsu, 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 CIFC31 H31 N O2 SP -110.628; 11.4207; 12.9524
65.936; 85.626; 72.954
1370.77Li, 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 CIFC28 H27 N O2 SP 1 21/c 114.0088; 9.652; 19.0811
90; 109.714; 90
2428.79Li, 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 CIFC15 H17 N O4P n a 219.7201; 26.2838; 5.4483
90; 90; 90
1391.94Wu, 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 CIFC16 H12 N2P n a 217.5559; 13.9087; 11.4271
90; 90; 90
1200.91Wu, 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 CIFC8 H6 NP 1 21/n 17.8048; 5.9454; 13.2408
90; 92.593; 90
613.78Wu, 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 CIFC11 H11 F3 O2P 41 21 27.262; 7.262; 41.516
90; 90; 90
2189.41Kerdphon, 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 CIFC18 H15 N O2P 21 21 218.98144; 9.10592; 35.9259
90; 90; 90
2938.17Li, 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 CIFC19 H17 N OP 1 21 19.3678; 6.9408; 11.2829
90; 93.95; 90
731.872Li, 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 CIFC25 H22 I O PP n a 2114.0443; 8.9519; 34.5515
90; 90; 90
4343.92Zhang, 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 CIFC40 H48 B2 Fe N12C 1 2/c 120.1074; 16.9145; 25.426
90; 108.024; 90
8223.2Isbill, 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 CIFC24 H31 Cl Ir N OP 1 21/n 18.81332; 15.7101; 17.1127
90; 102.781; 90
2310.68Chen, 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 CIFC32 H36 Ir N O2P -111.5179; 13.5428; 18.483
76.588; 87.879; 89.094
2802.44Chen, 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 CIFC19 H21 N O SP b c a10.7285; 17.9511; 18.0222
90; 90; 90
3470.87Chen, 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 CIFC22 H21 N O2P 21 21 217.1896; 13.9891; 17.894
90; 90; 90
1799.71Chen, 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 CIFC22 H23 N OP 4310.6545; 10.6545; 15.1128
90; 90; 90
1715.58Sahani, 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 CIFC20 H19 N OP 21 21 215.6073; 16.7309; 16.9207
90; 90; 90
1587.42Sahani, 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

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