Crystallography Open Database

Result: there are 163 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching journal of publication like 'ACS Catalysis' volume of publication is 7

Left arrow Left arrow First | Left arrow Previous 100 | of 2 | Next 100 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
4513994 CIFC46 H52 Cu2 N10P 21 21 2115.431; 16.964; 23.348
90; 90; 90
6112Trose, Michael; Lazreg, Faïma; Chang, Tao; Nahra, Fady; Cordes, David B.; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.
Neutral Dinuclear Copper(I)-NHC Complexes: Synthesis and Application in the Hydrosilylation of Ketones
ACS Catalysis, 2017, 7, 238
4513999 CIFC25 H39 Cl F3 Ir N O3 P SP 1 21/c 18.1455; 16.5588; 20.962
90; 94.132; 90
2820Celaje, Jeff Joseph A.; Zhang, Xingyue; Zhang, Forrest; Kam, Lisa; Herron, Jessica R.; Williams, Travis J.
A Base and Solvent-Free Ruthenium-Catalyzed Alkylation of Amines
ACS Catalysis, 2017, 7, 1136
4514008 CIFC17 H24 N O3 SP 1 21 19.0973; 8.2011; 22.9008
90; 99.357; 90
1685.85Feng, Jian-Jun; Zhang, Junliang
Rhodium-Catalyzed Stereoselective Intramolecular Tandem Reaction of Vinyloxiranes with Alkynes: Atom- and Step-Economical Synthesis of Multifunctional Mono-, Bi-, and Tricyclic Compounds
ACS Catalysis, 2017, 7, 1533
4514010 CIFC54 H46 Al F15 N3 O ReP -112.546; 14.078; 17.037
67.591; 72.379; 69.555
2556.2Lambic, Nikola S.; Sommer, Roger D.; Ison, Elon A.
Tuning Catalytic Activity in the Hydrogenation of Unactivated Olefins with Transition-Metal Oxos as the Lewis Base Component of Frustrated Lewis Pairs
ACS Catalysis, 2017, 7, 1170
4514011 CIFC37.5 H47 Cl N3 O ReP 1 21/n 115.6648; 13.4862; 17.082
90; 105.914; 90
3470.4Lambic, Nikola S.; Sommer, Roger D.; Ison, Elon A.
Tuning Catalytic Activity in the Hydrogenation of Unactivated Olefins with Transition-Metal Oxos as the Lewis Base Component of Frustrated Lewis Pairs
ACS Catalysis, 2017, 7, 1170
4514012 CIFC28 H27 N3 O8 S2C 1 c 116.946; 13.855; 12.2464
90; 100.543; 90
2826.8Rivinoja, Daniel J.; Gee, Yi Sing; Gardiner, Michael G.; Ryan, John H.; Hyland, Christopher J. T.
The Diastereoselective Synthesis of Pyrroloindolines by Pd-Catalyzed Dearomative Cycloaddition of 1-Tosyl-2-vinylaziridine to 3-Nitroindoles
ACS Catalysis, 2017, 7, 1053
4514013 CIFC25 H24 O3P 21 21 216.72474; 16.401; 17.4977
90; 90; 90
1929.86James, Jinju; Guiry, Patrick J.
Highly Enantioselective Construction of Sterically Hindered α-Allyl-α-Aryl Lactones via Palladium-Catalyzed Decarboxylative Asymmetric Allylic Alkylation
ACS Catalysis, 2017, 7, 1397
4514014 CIFC16 H13 Au Cl5 N O2P -18.2785; 8.9703; 14.5673
76.336; 87.282; 65.557
955.4Tomás-Mendivil, Eder; Heinrich, Clément F.; Ortuno, Jean-Claude; Starck, Jérôme; Michelet, Véronique
Gold-Catalyzed Access to 1H-Isochromenes: Reaction Development and Mechanistic Insight
ACS Catalysis, 2017, 7, 380
4514015 CIFC17 H19 F3 I N O3C 1 2/c 147.1143; 4.86847; 16.0241
90; 97.7446; 90
3641.99Shen, Yangyang; Cornella, Josep; Juliá-Hernández, Francisco; Martin, Ruben
Visible-Light-Promoted Atom Transfer Radical Cyclization of Unactivated Alkyl Iodides
ACS Catalysis, 2017, 7, 409
4514016 CIFC46 H56 Cu2 N10P 1 21/c 111.3017; 13.5088; 14.966
90; 108.686; 90
2164.5Trose, Michael; Lazreg, Faïma; Chang, Tao; Nahra, Fady; Cordes, David B.; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.
Neutral Dinuclear Copper(I)-NHC Complexes: Synthesis and Application in the Hydrosilylation of Ketones
ACS Catalysis, 2017, 7, 238
4514017 CIFC35 H54 Cl2 Cu2 N10I 41/a20.4817; 20.4817; 21.6349
90; 90; 90
9075.8Trose, Michael; Lazreg, Faïma; Chang, Tao; Nahra, Fady; Cordes, David B.; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.
Neutral Dinuclear Copper(I)-NHC Complexes: Synthesis and Application in the Hydrosilylation of Ketones
ACS Catalysis, 2017, 7, 238
4514023 CIFC78 H65 Cl F6 P5 Pd3 SbP 1 21/c 115.3747; 16.9302; 27.578
90; 93.07; 90
7168.2Fu, Fangyu; Xiang, Ji; Cheng, Hao; Cheng, Longjiu; Chong, Hanbao; Wang, Shuxin; Li, Peng; Wei, Shiqiang; Zhu, Manzhou; Li, Yadong
A Robust and Efficient Pd3 Cluster Catalyst for the Suzuki Reaction and Its Odd Mechanism
ACS Catalysis, 2017, 7, 1860
4514024 CIFC94 H118 Ge2 N2 O Si2C 1 2/c 124.283; 21.152; 17.759
90; 114.38; 90
8308Hadlington, Terrance J.; Kefalidis, Christos E.; Maron, Laurent; Jones, Cameron
Efficient Reduction of Carbon Dioxide to Methanol Equivalents Catalyzed by Two-Coordinate Amido‒Germanium(II) and −Tin(II) Hydride Complexes
ACS Catalysis, 2017, 7, 1853
4514025 CIFC52 H69 B N O3.5 Si SnP -110.1191; 12.9066; 18.7646
88.763; 86.92; 85.612
2439.63Hadlington, Terrance J.; Kefalidis, Christos E.; Maron, Laurent; Jones, Cameron
Efficient Reduction of Carbon Dioxide to Methanol Equivalents Catalyzed by Two-Coordinate Amido‒Germanium(II) and −Tin(II) Hydride Complexes
ACS Catalysis, 2017, 7, 1853
4514026 CIFC45 H53 N O2 Si SnP -19.99; 11.36; 18.89
86.59; 85.63; 67.69
1976.4Hadlington, Terrance J.; Kefalidis, Christos E.; Maron, Laurent; Jones, Cameron
Efficient Reduction of Carbon Dioxide to Methanol Equivalents Catalyzed by Two-Coordinate Amido‒Germanium(II) and −Tin(II) Hydride Complexes
ACS Catalysis, 2017, 7, 1853
4514027 CIFC15 H23 N3 O3P b c a16.5344; 9.4279; 20.9981
90; 90; 90
3273.3Bai, He-Yuan; Ma, Zhi-Gang; Yi, Min; Lin, Jun-Bing; Zhang, Shu-Yu
Palladium-Catalyzed Direct Intermolecular Amination of Unactivated Methylene C(sp3)‒H Bonds with Azodiformates via Bidentate-Chelation Assistance
ACS Catalysis, 2017, 7, 2042
4514028 CIFC56.25 H50.5 F12 N10 O4.75 P2 Ru2C 1 2/c 123.6464; 24.1857; 24.249
90; 116.899; 90
12367.7Odrobina, Jann; Scholz, Julius; Pannwitz, Andrea; Francàs, Laia; Dechert, Sebastian; Llobet, Antoni; Jooss, Christian; Meyer, Franc
Backbone Immobilization of the Bis(bipyridyl)pyrazolate Diruthenium Catalyst for Electrochemical Water Oxidation
ACS Catalysis, 2017, 7, 2116
4514029 CIFC61 H60 F12 N10 O7 P2 Ru2C 1 2/c 118.7376; 22.1944; 15.7519
90; 90.788; 90
6550.1Odrobina, Jann; Scholz, Julius; Pannwitz, Andrea; Francàs, Laia; Dechert, Sebastian; Llobet, Antoni; Jooss, Christian; Meyer, Franc
Backbone Immobilization of the Bis(bipyridyl)pyrazolate Diruthenium Catalyst for Electrochemical Water Oxidation
ACS Catalysis, 2017, 7, 2116
4514030 CIFC42 H36 F2 Fe Ni P2 SP -111.2326; 11.336; 16.1197
78.107; 72.51; 67.279
1796.3Kalvet, Indrek; Guo, Qianqian; Tizzard, Graham J.; Schoenebeck, Franziska
When Weaker Can Be Tougher: The Role of Oxidation State (I) in P- vs N-Ligand-Derived Ni-Catalyzed Trifluoromethylthiolation of Aryl Halides.
ACS catalysis, 2017, 7, 2126-2132
4514031 CIFC40 H34 Fe I2 Ni P2P -18.9532; 10.0303; 20.4331
91.917; 99.127; 94.971
1802.83Kalvet, Indrek; Guo, Qianqian; Tizzard, Graham J.; Schoenebeck, Franziska
When Weaker Can Be Tougher: The Role of Oxidation State (I) in P- vs N-Ligand-Derived Ni-Catalyzed Trifluoromethylthiolation of Aryl Halides.
ACS catalysis, 2017, 7, 2126-2132
4514037 CIFC54.5 H45 Ag4 Cl5 O10P 1 21/n 111.2473; 18.5148; 26.3786
90; 97.2988; 90
5448.6Zhou, Zhen; He, Cheng; Yang, Lu; Wang, Yefei; Liu, Tao; Duan, Chunying
Alkyne Activation by a Porous Silver Coordination Polymer for Heterogeneous Catalysis of Carbon Dioxide Cycloaddition
ACS Catalysis, 2017, 7, 2248
4514038 CIFC15 H12 Ag2 O6C 1 2/c 126.064; 19.397; 11.0996
90; 97.166; 90
5567.7Zhou, Zhen; He, Cheng; Yang, Lu; Wang, Yefei; Liu, Tao; Duan, Chunying
Alkyne Activation by a Porous Silver Coordination Polymer for Heterogeneous Catalysis of Carbon Dioxide Cycloaddition
ACS Catalysis, 2017, 7, 2248
4514040 CIFC24 H18 Cl6 N O5 VP 1 21 17.20833; 12.3392; 14.6278
90; 93.647; 90
1298.44Miceli, Claudia; Rintjema, Jeroen; Martin, Eddy; Escudero-Adán, Eduardo C.; Zonta, Cristiano; Licini, Giulia; Kleij, Arjan W.
Vanadium(V) Catalysts with High Activity for the Coupling of Epoxides and CO2: Characterization of a Putative Catalytic Intermediate
ACS Catalysis, 2017, 7, 2367
4514041 CIFC24 H17 Cl7 N O5 VP 1 21/c 17.1728; 13.0626; 28.541
90; 96.136; 90
2658.8Miceli, Claudia; Rintjema, Jeroen; Martin, Eddy; Escudero-Adán, Eduardo C.; Zonta, Cristiano; Licini, Giulia; Kleij, Arjan W.
Vanadium(V) Catalysts with High Activity for the Coupling of Epoxides and CO2: Characterization of a Putative Catalytic Intermediate
ACS Catalysis, 2017, 7, 2367
4514051 CIFC44 H30 F5 N2 PP 1 21 112.37; 45.6483; 12.6634
90; 97.6938; 90
7086.3Paioti, Paulo H. S.; Abboud, Khalil A.; Aponick, Aaron
Incorporation of Axial Chirality into Phosphino-Imidazoline Ligands for Enantioselective Catalysis
ACS Catalysis, 2017, 7, 2133
4514052 CIFC78 H65 Br0.69 Cl0.31 F6 P5 Pd3 SbP 1 21/c 115.3662; 16.9466; 27.676
90; 92.693; 90
7199Fu, Fangyu; Xiang, Ji; Cheng, Hao; Cheng, Longjiu; Chong, Hanbao; Wang, Shuxin; Li, Peng; Wei, Shiqiang; Zhu, Manzhou; Li, Yadong
A Robust and Efficient Pd3 Cluster Catalyst for the Suzuki Reaction and Its Odd Mechanism
ACS Catalysis, 2017, 7, 1860
4514053 CIFC50 H64 B Ge N O3 SiP -19.93; 14.88; 15.29
91; 91.6; 98.1
2235.3Hadlington, Terrance J.; Kefalidis, Christos E.; Maron, Laurent; Jones, Cameron
Efficient Reduction of Carbon Dioxide to Methanol Equivalents Catalyzed by Two-Coordinate Amido‒Germanium(II) and −Tin(II) Hydride Complexes
ACS Catalysis, 2017, 7, 1853
4514054 CIFC101 H134 Ge2 N2 O2 Si2C 1 2/c 131.052; 19.593; 17.8613
90; 105.933; 90
10449.4Hadlington, Terrance J.; Kefalidis, Christos E.; Maron, Laurent; Jones, Cameron
Efficient Reduction of Carbon Dioxide to Methanol Equivalents Catalyzed by Two-Coordinate Amido‒Germanium(II) and −Tin(II) Hydride Complexes
ACS Catalysis, 2017, 7, 1853
4514055 CIFC38 H36 N2 O5 S2P 21 21 2110.9061; 12.6404; 28.3159
90; 90; 90
3903.6Feng, Jian-Jun; Zhang, Junliang
Rhodium-Catalyzed Stereoselective Intramolecular Tandem Reaction of Vinyloxiranes with Alkynes: Atom- and Step-Economical Synthesis of Multifunctional Mono-, Bi-, and Tricyclic Compounds
ACS Catalysis, 2017, 7, 1533
4514056 CIFC17 H21 N O3 SP 21 21 218.1166; 13.77; 15.4267
90; 90; 90
1724.17Feng, Jian-Jun; Zhang, Junliang
Rhodium-Catalyzed Stereoselective Intramolecular Tandem Reaction of Vinyloxiranes with Alkynes: Atom- and Step-Economical Synthesis of Multifunctional Mono-, Bi-, and Tricyclic Compounds
ACS Catalysis, 2017, 7, 1533
4514057 CIFC25 H44 Mn N O3 P2P n a 2130.3732; 11.6836; 7.6516
90; 90; 90
2715.3Nguyen, Duc Hanh; Trivelli, Xavier; Capet, Frédéric; Paul, Jean-François; Dumeignil, Franck; Gauvin, Régis M.
Manganese Pincer Complexes for the Base-Free, Acceptorless Dehydrogenative Coupling of Alcohols to Esters: Development, Scope, and Understanding
ACS Catalysis, 2017, 7, 2022
4514058 CIFC18 H41 B Mn N O2 P2P b c a17.2037; 14.6522; 19.066
90; 90; 90
4806Nguyen, Duc Hanh; Trivelli, Xavier; Capet, Frédéric; Paul, Jean-François; Dumeignil, Franck; Gauvin, Régis M.
Manganese Pincer Complexes for the Base-Free, Acceptorless Dehydrogenative Coupling of Alcohols to Esters: Development, Scope, and Understanding
ACS Catalysis, 2017, 7, 2022
4514059 CIFC18 H38 Mn N O2 P2P 1 21/c 110.6335; 14.5777; 13.8441
90; 97.449; 90
2127.9Nguyen, Duc Hanh; Trivelli, Xavier; Capet, Frédéric; Paul, Jean-François; Dumeignil, Franck; Gauvin, Régis M.
Manganese Pincer Complexes for the Base-Free, Acceptorless Dehydrogenative Coupling of Alcohols to Esters: Development, Scope, and Understanding
ACS Catalysis, 2017, 7, 2022
4514060 CIFC40 H34 Br Fe Ni P2P -19.6075; 10.9191; 17.624
96.565; 105.405; 103.759
1699.9Kalvet, Indrek; Guo, Qianqian; Tizzard, Graham J.; Schoenebeck, Franziska
When Weaker Can Be Tougher: The Role of Oxidation State (I) in P- vs N-Ligand-Derived Ni-Catalyzed Trifluoromethylthiolation of Aryl Halides.
ACS catalysis, 2017, 7, 2126-2132
4514061 CIFC72 H64 Fe2 I2 Ni2 O P4C 1 2/c 123.6771; 13.9547; 19.1841
90; 90.394; 90
6338.4Kalvet, Indrek; Guo, Qianqian; Tizzard, Graham J.; Schoenebeck, Franziska
When Weaker Can Be Tougher: The Role of Oxidation State (I) in P- vs N-Ligand-Derived Ni-Catalyzed Trifluoromethylthiolation of Aryl Halides.
ACS catalysis, 2017, 7, 2126-2132
4514062 CIFC18 H17 N O2P -17.3719; 8.0356; 12.4786
82.255; 78.93; 86.099
718.16Wu, Xiaowei; Wang, Bao; Zhou, Shengbin; Zhou, Yu; Liu, Hong
Ruthenium-Catalyzed Redox-Neutral [4 + 1] Annulation of Benzamides and Propargyl Alcohols via C‒H Bond Activation
ACS Catalysis, 2017, 7, 2494
4514063 CIFC30 H64 Br2 P2 Pd2P 1 21/c 114.191; 14.4097; 18.8529
90; 90.638; 90
3855Hu, Huaiyuan; Qu, Fengrui; Gerlach, Deidra L.; Shaughnessy, Kevin H.
Mechanistic Study of the Role of Substrate Steric Effects and Aniline Inhibition on the Bis(trineopentylphosphine)palladium(0)-Catalyzed Arylation of Aniline Derivatives
ACS Catalysis, 2017, 7, 2516
4514064 CIFC48 H88 Br2 Cl4 P2 Pd2P -19.5914; 12.2401; 13.6152
114.515; 94.093; 92.143
1446.66Hu, Huaiyuan; Qu, Fengrui; Gerlach, Deidra L.; Shaughnessy, Kevin H.
Mechanistic Study of the Role of Substrate Steric Effects and Aniline Inhibition on the Bis(trineopentylphosphine)palladium(0)-Catalyzed Arylation of Aniline Derivatives
ACS Catalysis, 2017, 7, 2516
4514071 CIFC25 H19 Br N2 O2P 21 21 219.5611; 9.7674; 44.019
90; 90; 90
4110.8Wang, Shoulei; Izquierdo, Javier; Rodríguez-Escrich, Carles; Pericàs, Miquel A.
Asymmetric [4 + 2] Annulation Reactions Catalyzed by a Robust, Immobilized Isothiourea
ACS Catalysis, 2017, 7, 2780
4514072 CIFC24 H17 N O2 SP 21 21 216.2831; 10.506; 28.682
90; 90; 90
1893.3Wang, Shoulei; Izquierdo, Javier; Rodríguez-Escrich, Carles; Pericàs, Miquel A.
Asymmetric [4 + 2] Annulation Reactions Catalyzed by a Robust, Immobilized Isothiourea
ACS Catalysis, 2017, 7, 2780
4514080 CIFC38 H52 N2 O2 PdP 1 21/c 112.47076; 21.63215; 13.10657
90; 99.47; 90
3487.57Kim, Jaewoon; Hong, Soon Hyeok
Ligand-Promoted Direct C‒H Arylation of Simple Arenes: Evidence for a Cooperative Bimetallic Mechanism
ACS Catalysis, 2017, 7, 3336
4514083 CIFC28 H29 N O3P -16.3295; 12.336; 14.619
90.792; 95.813; 96.114
1128.8Esguerra, Kenneth Virgel N.; Lumb, Jean-Philip
A Bioinspired Catalytic Aerobic Functionalization of Phenols: Regioselective Construction of Aromatic C‒N and C‒O Bonds
ACS Catalysis, 2017, 7, 3477
4514084 CIFC33 H25 N O4P -19.7185; 15.9184; 15.9702
88.541; 87.598; 85.097
2458.84Esguerra, Kenneth Virgel N.; Lumb, Jean-Philip
A Bioinspired Catalytic Aerobic Functionalization of Phenols: Regioselective Construction of Aromatic C‒N and C‒O Bonds
ACS Catalysis, 2017, 7, 3477
4514085 CIFC34 H23 F2 N O5P 1 21 110.0098; 19.235; 13.3175
90; 91.572; 90
2563.2Esguerra, Kenneth Virgel N.; Lumb, Jean-Philip
A Bioinspired Catalytic Aerobic Functionalization of Phenols: Regioselective Construction of Aromatic C‒N and C‒O Bonds
ACS Catalysis, 2017, 7, 3477
4514090 CIFC25 H19 N O2P 1 21/c 14.88608; 39.9585; 9.27521
90; 91.1105; 90
1810.56Herlé, Bart; Holstein, Philipp M.; Echavarren, Antonio M.
Stereoselective cis-Vinylcyclopropanation via a Gold(I)-Catalyzed Retro-Buchner Reaction under Mild Conditions.
ACS catalysis, 2017, 7, 3668-3675
4514091 CIFC25 H19 N O2P -19.8574; 10.5363; 19.098
83.974; 85.964; 69.875
1850.88Herlé, Bart; Holstein, Philipp M.; Echavarren, Antonio M.
Stereoselective cis-Vinylcyclopropanation via a Gold(I)-Catalyzed Retro-Buchner Reaction under Mild Conditions.
ACS catalysis, 2017, 7, 3668-3675
4514096 CIFC12 H10 O5P 21 21 215.9658; 6.8587; 26.877
90; 90; 90
1099.74Ji, Jie; Lin, Lili; Tang, Qiong; Kang, Tengfei; Liu, Xiaohua; Feng, Xiaoming
Highly Efficient Asymmetric Synthesis of Chiral γ-Alkenyl Butenolides Catalyzed by Chiral N,N′-Dioxide‒Scandium(III) Complexes
ACS Catalysis, 2017, 7, 3763
4514100 CIFC60 H54 F18 N12 O4 P3 Ru2P -113.578; 13.579; 13.733
91.45; 100.63; 115.95
2222Fan, Ting; Duan, Lele; Huang, Ping; Chen, Hong; Daniel, Quentin; Ahlquist, Mårten S. G.; Sun, Licheng
The Ru-tpc Water Oxidation Catalyst and Beyond: Water Nucleophilic Attack Pathway versus Radical Coupling Pathway
ACS Catalysis, 2017, 7, 2956
4514101 CIFC21 H39 Cl2 Co N P2P -18.2698; 10.9458; 14.8705
98.19; 90.641; 110.333
1246.6Daw, Prosenjit; Chakraborty, Subrata; Leitus, Gregory; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David
Selective N-Formylation of Amines with H2 and CO2 Catalyzed by Cobalt Pincer Complexes
ACS Catalysis, 2017, 7, 2500
4514102 CIFC21 H39 Cl Co N P2P 1 21/c 114.2619; 8.3444; 19.9331
90; 96.477; 90
2357Daw, Prosenjit; Chakraborty, Subrata; Leitus, Gregory; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David
Selective N-Formylation of Amines with H2 and CO2 Catalyzed by Cobalt Pincer Complexes
ACS Catalysis, 2017, 7, 2500
4514103 CIFC50 H40 Cl N3 O P2 RuP n m a18.5484; 15.0463; 16.1704
90; 90; 90
4512.9Sarbajna, Abir; Dutta, Indranil; Daw, Prosenjit; Dinda, Shrabani; Rahaman, S. M. Wahidur; Sarkar, Abheek; Bera, Jitendra K.
Catalytic Conversion of Alcohols to Carboxylic Acid Salts and Hydrogen with Alkaline Water
ACS Catalysis, 2017, 7, 2786
4514104 CIFC54 H47 Cl5 N4 O P2 RuP 1 21/c 114.2935; 18.4185; 22.7313
90; 108.44; 90
5677.1Sarbajna, Abir; Dutta, Indranil; Daw, Prosenjit; Dinda, Shrabani; Rahaman, S. M. Wahidur; Sarkar, Abheek; Bera, Jitendra K.
Catalytic Conversion of Alcohols to Carboxylic Acid Salts and Hydrogen with Alkaline Water
ACS Catalysis, 2017, 7, 2786
4514105 CIFC59 H49 Cl5 N4 O2 P2 Ru2P -111.8324; 14.2246; 18.611
86.239; 84.443; 71.637
2956.9Sarbajna, Abir; Dutta, Indranil; Daw, Prosenjit; Dinda, Shrabani; Rahaman, S. M. Wahidur; Sarkar, Abheek; Bera, Jitendra K.
Catalytic Conversion of Alcohols to Carboxylic Acid Salts and Hydrogen with Alkaline Water
ACS Catalysis, 2017, 7, 2786
4514106 CIFC29 H20 F3 N5 O6 Ru SP -18.4166; 11.03; 16.025
84.085; 76.9; 69.246
1354.52Kagalwala, Husain N.; Tong, Lianpeng; Zong, Ruifa; Kohler, Lars; Ahlquist, Mårten S. G.; Fan, Ting; Gagnon, Kevin J.; Thummel, Randolph P.
Evidence for Oxidative Decay of a Ru-Bound Ligand during Catalyzed Water Oxidation
ACS Catalysis, 2017, 7, 2607
4514107 CIFC13 H15 N O4P 21 21 218.8677; 10.0871; 14.1044
90; 90; 90
1261.63Tukhvatshin, Rinat S.; Kucherenko, Alexander S.; Nelyubina, Yulia V.; Zlotin, Sergei G.
Tertiary Amine-Derived Ionic Liquid-Supported Squaramide as a Recyclable Organocatalyst for Noncovalent “On Water” Catalysis
ACS Catalysis, 2017, 7, 2981
4514108 CIFC13 H8 Br Mn N2 O5P b a m17.7576; 12.9229; 12.7518
90; 90; 90
2926.3Dubey, Abhishek; Nencini, Luca; Fayzullin, Robert R.; Nervi, Carlo; Khusnutdinova, Julia R.
Bio-Inspired Mn(I) Complexes for the Hydrogenation of CO2 to Formate and Formamide
ACS Catalysis, 2017, 7, 3864
4514109 CIFC15 H12 Br Mn N2 O5P 1 21/n 18.1795; 16.3907; 11.9305
90; 90.478; 90
1599.44Dubey, Abhishek; Nencini, Luca; Fayzullin, Robert R.; Nervi, Carlo; Khusnutdinova, Julia R.
Bio-Inspired Mn(I) Complexes for the Hydrogenation of CO2 to Formate and Formamide
ACS Catalysis, 2017, 7, 3864
4514110 CIFC13 H10 Br Mn N4 O3P 1 21/n 17.5829; 9.6475; 20.0238
90; 93.812; 90
1461.62Dubey, Abhishek; Nencini, Luca; Fayzullin, Robert R.; Nervi, Carlo; Khusnutdinova, Julia R.
Bio-Inspired Mn(I) Complexes for the Hydrogenation of CO2 to Formate and Formamide
ACS Catalysis, 2017, 7, 3864
4514111 CIFC16 H11 F3 Mn N3 O8 SP -18.9121; 12.7125; 17.6682
84.4838; 86.3815; 83.4002
1976.5Dubey, Abhishek; Nencini, Luca; Fayzullin, Robert R.; Nervi, Carlo; Khusnutdinova, Julia R.
Bio-Inspired Mn(I) Complexes for the Hydrogenation of CO2 to Formate and Formamide
ACS Catalysis, 2017, 7, 3864
4514112 CIFC18 H15 F3 Mn N3 O8 SP 1 21/c 18.19264; 11.4621; 23.0399
90; 92.2861; 90
2161.84Dubey, Abhishek; Nencini, Luca; Fayzullin, Robert R.; Nervi, Carlo; Khusnutdinova, Julia R.
Bio-Inspired Mn(I) Complexes for the Hydrogenation of CO2 to Formate and Formamide
ACS Catalysis, 2017, 7, 3864
4514115 CIFC44 H61 N O10 S SiP 1 21 19.04501; 9.77593; 25.19795
90; 92.5278; 90
2225.92Liao, Yuting; Zhou, Baixin; Xia, Yong; Liu, Xiaohua; Lin, Lili; Feng, Xiaoming
Asymmetric [3 + 2] Cycloaddition of 2,2′-Diester Aziridines To Synthesize Pyrrolidine Derivatives
ACS Catalysis, 2017, 7, 3934
4514118 CIFC20 H24 Cl N O2 SP 1 21/c 19.5931; 12.8055; 15.6673
90; 102.15; 90
1881.53Zhang, Hongwei; Muñiz, Kilian
Selective Piperidine Synthesis Exploiting Iodine-Catalyzed Csp3‒H Amination under Visible Light
ACS Catalysis, 2017, 7, 4122
4514119 CIFC19 H22 N2 O4 SP b c n16.4786; 7.779; 28.3488
90; 90; 90
3633.9Zhang, Hongwei; Muñiz, Kilian
Selective Piperidine Synthesis Exploiting Iodine-Catalyzed Csp3‒H Amination under Visible Light
ACS Catalysis, 2017, 7, 4122
4514120 CIFC25 H18P 1 21/c 113.316; 20.47; 6.2779
90; 101.369; 90
1677.6Yu, Liu-Zhu; Wei, Yin; Shi, Min
Synthesis of Polysubstituted Polycyclic Aromatic Hydrocarbons by Gold-Catalyzed Cyclization‒Oxidation of Alkylidenecyclopropane-Containing 1,5-Enynes
ACS Catalysis, 2017, 7, 4242
4514121 CIFC24 H17 Cl OP -19.3854; 9.6615; 11.064
87.814; 68.304; 85.999
929.8Yu, Liu-Zhu; Wei, Yin; Shi, Min
Synthesis of Polysubstituted Polycyclic Aromatic Hydrocarbons by Gold-Catalyzed Cyclization‒Oxidation of Alkylidenecyclopropane-Containing 1,5-Enynes
ACS Catalysis, 2017, 7, 4242
4514122 CIFC22 H16 SP -14.9712; 11.992; 27.578
79.676; 84.855; 78.156
1580.6Yu, Liu-Zhu; Wei, Yin; Shi, Min
Synthesis of Polysubstituted Polycyclic Aromatic Hydrocarbons by Gold-Catalyzed Cyclization‒Oxidation of Alkylidenecyclopropane-Containing 1,5-Enynes
ACS Catalysis, 2017, 7, 4242
4514136 CIFC19 H27 Cl N3 O P RuP b c a8.539; 15.0653; 32.9272
90; 90; 90
4235.84Li, Huaifeng; Wang, Yuan; Lai, Zhiping; Huang, Kuo-Wei
Selective Catalytic Hydrogenation of Arenols by a Well-Defined Complex of Ruthenium and Phosphorus‒Nitrogen PN3‒Pincer Ligand Containing a Phenanthroline Backbone
ACS Catalysis, 2017, 7, 4446
4514137 CIFC22 H31 Cl N3 O2 P RuP 1 21/c 18.4904; 16.3262; 17.4261
90; 97.79; 90
2393.24Li, Huaifeng; Wang, Yuan; Lai, Zhiping; Huang, Kuo-Wei
Selective Catalytic Hydrogenation of Arenols by a Well-Defined Complex of Ruthenium and Phosphorus‒Nitrogen PN3‒Pincer Ligand Containing a Phenanthroline Backbone
ACS Catalysis, 2017, 7, 4446
4514139 CIFC28 H28 N2 O6 SP 1 21 114.93; 11.5659; 15.258
90; 101.808; 90
2579Claraz, Aurélie; Serpier, Fabien; Darses, Sylvain
Organoboron Initiated Rh-Catalyzed Asymmetric Cascade Reactions: A Subtle Switch in Regioselectivity Leading to Chiral 3-Benzazepine Derivatives
ACS Catalysis, 2017, 7, 3410
4514140 CIFC42 H30 F6 N2 O4P 21 21 218.8643; 17.5771; 22.5359
90; 90; 90
3511.3Yang, Wenjun; Sun, Wei; Zhang, Cheng; Wang, Qijun; Guo, Zhenyan; Mao, Biming; Liao, Jianning; Guo, Hongchao
Lewis-Base-Catalyzed Asymmetric [3 + 3] Annulation Reaction of Morita‒Baylis‒Hillman Carbonates: Enantioselective Synthesis of Spirocyclohexenes
ACS Catalysis, 2017, 7, 3142
4514141 CIFC18 H18P 1 21 19.035; 5.7594; 13.277
90; 100.891; 90
678.4Herlé, Bart; Holstein, Philipp M.; Echavarren, Antonio M.
Stereoselective cis-Vinylcyclopropanation via a Gold(I)-Catalyzed Retro-Buchner Reaction under Mild Conditions.
ACS catalysis, 2017, 7, 3668-3675
4514142 CIFC21 H27 N O2 SP 1 21/n 111.6983; 13.0767; 13.6557
90; 114.637; 90
1898.82Zhang, Hongwei; Muñiz, Kilian
Selective Piperidine Synthesis Exploiting Iodine-Catalyzed Csp3‒H Amination under Visible Light
ACS Catalysis, 2017, 7, 4122
4514143 CIFC19 H21 N O2 SP 1 21/c 110.2375; 9.4009; 16.6135
90; 98.412; 90
1581.71Zhang, Hongwei; Muñiz, Kilian
Selective Piperidine Synthesis Exploiting Iodine-Catalyzed Csp3‒H Amination under Visible Light
ACS Catalysis, 2017, 7, 4122
4514154 CIFC16 H11 F5 N3 O7 VP -17.8153; 11.0933; 11.0932
78.955; 85.104; 77.783
921.55Gazi, Sarifuddin; Đokić, Miloš; Moeljadi, Adhitya Mangala Putra; Ganguly, Rakesh; Hirao, Hajime; Soo, Han Sen
Kinetics and DFT Studies of Photoredox Carbon‒Carbon Bond Cleavage Reactions by Molecular Vanadium Catalysts under Ambient Conditions
ACS Catalysis, 2017, 7, 4682
4514158 CIFC14 H13 Cl3 O4P 1 21 17.1346; 14.8376; 15.0064
90; 98.492; 90
1571.17Cruchter, Thomas; Medvedev, Michael G.; Shen, Xiaodong; Mietke, Thomas; Harms, Klaus; Marsch, Michael; Meggers, Eric
Asymmetric Nucleophilic Catalysis with an Octahedral Chiral-at-Metal Iridium(III) Complex
ACS Catalysis, 2017, 7, 5151
4514159 CIFC22 H38 Si2P 1 21/n 18.809; 15.299; 16.461
90; 93.573; 90
2214.1Chen, Jiazhen; Gao, Yanshan; Xiong, Shuoyan; Delferro, Massimiliano; Lohr, Tracy L.; Marks, Tobin J.
Metal and Counteranion Nuclearity Effects in Organoscandium-Catalyzed Isoprene Polymerization and Copolymerization
ACS Catalysis, 2017, 7, 5214
4514160 CIFC48 H100 O2 Sc2 Si6P 1 21/c 114.3075; 24.95; 17.0373
90; 98.009; 90
6022.5Chen, Jiazhen; Gao, Yanshan; Xiong, Shuoyan; Delferro, Massimiliano; Lohr, Tracy L.; Marks, Tobin J.
Metal and Counteranion Nuclearity Effects in Organoscandium-Catalyzed Isoprene Polymerization and Copolymerization
ACS Catalysis, 2017, 7, 5214
4514164 CIFC55 H44 Cl2 N2 O4C 1 2 122.1203; 7.6123; 16.3803
90; 127.077; 90
2200.58He, Congfa; Hou, Mengqing; Zhu, Zixi; Gu, Zhenhua
Enantioselective Synthesis of Indole-Based Biaryl Atropisomers via Palladium-Catalyzed Dynamic Kinetic Intramolecular C‒H Cyclization
ACS Catalysis, 2017, 7, 5316
4514166 CIFC9 H14 O4P -4 21 c12.8527; 12.8527; 10.7921
90; 90; 90
1782.77Laserna, Victor; Martin, Eddy; Escudero-Adán, Eduardo C.; Kleij, Arjan W.
Substrate-Triggered Stereoselective Preparation of Highly Substituted Organic Carbonates
ACS Catalysis, 2017, 7, 5478
4514167 CIFC7 H10 O4P 1 21/n 16.5169; 11.8049; 9.5214
90; 105.261; 90
706.66Laserna, Victor; Martin, Eddy; Escudero-Adán, Eduardo C.; Kleij, Arjan W.
Substrate-Triggered Stereoselective Preparation of Highly Substituted Organic Carbonates
ACS Catalysis, 2017, 7, 5478
4514168 CIFC7 H10 O4P 1 21/n 18.3814; 7.0296; 12.3499
90; 96.2862; 90
723.26Laserna, Victor; Martin, Eddy; Escudero-Adán, Eduardo C.; Kleij, Arjan W.
Substrate-Triggered Stereoselective Preparation of Highly Substituted Organic Carbonates
ACS Catalysis, 2017, 7, 5478
4514169 CIFC42 H29 Cl F6 N2 O3P 21 21 218.9232; 17.371; 23.537
90; 90; 90
3648.4Yang, Wenjun; Sun, Wei; Zhang, Cheng; Wang, Qijun; Guo, Zhenyan; Mao, Biming; Liao, Jianning; Guo, Hongchao
Lewis-Base-Catalyzed Asymmetric [3 + 3] Annulation Reaction of Morita‒Baylis‒Hillman Carbonates: Enantioselective Synthesis of Spirocyclohexenes
ACS Catalysis, 2017, 7, 3142
4514173 CIFC55.5 H71 O10.5 Rh2P 1 21/n 116.2948; 17.0253; 20.361
90; 103.07; 90
5502.3Chen, Po-An; Setthakarn, Krit; May, Jeremy A.
A Binaphthyl-Based Scaffold for a Chiral Dirhodium(II) Biscarboxylate Ligand with α-Quaternary Carbon Centers
ACS Catalysis, 2017, 7, 6155
4514183 CIFC46 H96 O2 Sc2 Si6P 1 21/n 118.2889; 18.1841; 18.6875
90; 111.842; 90
5768.7Chen, Jiazhen; Gao, Yanshan; Xiong, Shuoyan; Delferro, Massimiliano; Lohr, Tracy L.; Marks, Tobin J.
Metal and Counteranion Nuclearity Effects in Organoscandium-Catalyzed Isoprene Polymerization and Copolymerization
ACS Catalysis, 2017, 7, 5214
4514184 CIFC19 H12 Au Cl0.25 F6 N O4P 1 2/n 129.449; 4.6494; 29.503
90; 103.649; 90
3925.5Holmsen, Marte Sofie Martinsen; Nova, Ainara; Balcells, David; Langseth, Eirin; Øien-Ødegaard, Sigurd; Heyn, Richard H.; Tilset, Mats; Laurenczy, Gábor
trans-Mutation at Gold(III): A Mechanistic Study of a Catalytic Acetylene Functionalization via a Double Insertion Pathway
ACS Catalysis, 2017, 7, 5023
4514185 CIFC25 H21 O PP -19.8901; 10.4204; 12.056
68.572; 85.149; 69.897
1084.9Toda, Yasunori; Sakamoto, Tomoyuki; Komiyama, Yutaka; Kikuchi, Ayaka; Suga, Hiroyuki
A Phosphonium Ylide as an Ionic Nucleophilic Catalyst for Primary Hydroxyl Group Selective Acylation of Diols
ACS Catalysis, 2017, 7, 6150
4514187 CIFC22 H23 N OP b c a15.4176; 11.3505; 20.247
90; 90; 90
3543.2Li, Yang; Hu, Ming; Li, Jin-Heng
Silver-Catalyzed Intermolecular [3 + 2]/[5 + 2] Annulation of N-Arylpropiolamides with Vinyl Acids: Facile Synthesis of Fused 2H-Benzo[b]azepin-2-ones
ACS Catalysis, 2017, 7, 6757
4514188 CIFC18 H20 N2 O2P -16.3768; 10.567; 11.5596
108.484; 92.159; 106.084
703.06Mampuys, Pieter; Neumann, Helfried; Sergeyev, Sergey; Orru, Romano V. A.; Jiao, Haijun; Spannenberg, Anke; Maes, Bert U. W.; Beller, Matthias
Combining Isocyanides with Carbon Dioxide in Palladium-Catalyzed Heterocycle Synthesis: N3-Substituted Quinazoline-2,4(1H,3H)-diones via a Three-Component Reaction
ACS Catalysis, 2017, 7, 5549
4514189 CIFC16 H22 N2 O2P -110.3381; 12.1298; 12.7543
98.7084; 97.6979; 101.969
1523.79Mampuys, Pieter; Neumann, Helfried; Sergeyev, Sergey; Orru, Romano V. A.; Jiao, Haijun; Spannenberg, Anke; Maes, Bert U. W.; Beller, Matthias
Combining Isocyanides with Carbon Dioxide in Palladium-Catalyzed Heterocycle Synthesis: N3-Substituted Quinazoline-2,4(1H,3H)-diones via a Three-Component Reaction
ACS Catalysis, 2017, 7, 5549
4514190 CIFC27 H52 Cl N O P4 WP 1 21/n 113.5317; 16.7932; 14.6934
90; 95.148; 90
3325.5Rudshteyn, Benjamin; Vibbert, Hunter B.; May, Richard; Wasserman, Eric; Warnke, Ingolf; Hopkins, Michael D.; Batista, Victor S.
Thermodynamic and Structural Factors That Influence the Redox Potentials of Tungsten‒Alkylidyne Complexes
ACS Catalysis, 2017, 7, 6134
4514193 CIFC37.21 H40.41 Cl2.41 Cu I N6P 21 21 2116.9652; 19.7318; 24.8974
90; 90; 90
8334.5Wan, Kai Y.; Sung, Molly M. H.; Lough, Alan J.; Morris, Robert H.
Half-Sandwich Ruthenium Catalyst Bearing an Enantiopure Primary Amine Tethered to an N-Heterocyclic Carbene for Ketone Hydrogenation
ACS Catalysis, 2017, 7, 6827
4514194 CIFC43 H43 Cl Ni P2P 1 21/n 112.3832; 17.1052; 17.3844
90; 106.111; 90
3537.7Mifleur, Alexis; Mérel, Delphine S.; Mortreux, André; Suisse, Isabelle; Capet, Frédéric; Trivelli, Xavier; Sauthier, Mathieu; Macgregor, Stuart A.
Deciphering the Mechanism of the Nickel-Catalyzed Hydroalkoxylation Reaction: A Combined Experimental and Computational Study
ACS Catalysis, 2017, 7, 6915
4514195 CIFC32 H35 Cl Ni P2P -110.3622; 11.0841; 13.1883
100.947; 102.623; 105.014
1377.98Mifleur, Alexis; Mérel, Delphine S.; Mortreux, André; Suisse, Isabelle; Capet, Frédéric; Trivelli, Xavier; Sauthier, Mathieu; Macgregor, Stuart A.
Deciphering the Mechanism of the Nickel-Catalyzed Hydroalkoxylation Reaction: A Combined Experimental and Computational Study
ACS Catalysis, 2017, 7, 6915
4514196 CIFC39 H52 Hf N2P -19.1605; 12.4145; 15.8667
91.003; 105.64; 97.611
1719.61Domski, Gregory J.; Eagan, James M.; De Rosa, Claudio; Di Girolamo, Rocco; LaPointe, Anne M.; Lobkovsky, Emil B.; Talarico, Giovanni; Coates, Geoffrey W.
Combined Experimental and Theoretical Approach for Living and Isoselective Propylene Polymerization
ACS Catalysis, 2017, 7, 6930
4514197 CIFC28 H36 Hf N2P 1 21/n 110.3324; 14.8323; 16.0844
90; 97.923; 90
2441.5Domski, Gregory J.; Eagan, James M.; De Rosa, Claudio; Di Girolamo, Rocco; LaPointe, Anne M.; Lobkovsky, Emil B.; Talarico, Giovanni; Coates, Geoffrey W.
Combined Experimental and Theoretical Approach for Living and Isoselective Propylene Polymerization
ACS Catalysis, 2017, 7, 6930
4514198 CIFC33 H40 Hf N2P -111.0762; 11.953; 12.8362
79.555; 66.82; 67.872
1446.09Domski, Gregory J.; Eagan, James M.; De Rosa, Claudio; Di Girolamo, Rocco; LaPointe, Anne M.; Lobkovsky, Emil B.; Talarico, Giovanni; Coates, Geoffrey W.
Combined Experimental and Theoretical Approach for Living and Isoselective Propylene Polymerization
ACS Catalysis, 2017, 7, 6930
4514199 CIFC32 H38 Hf N2P -19.6947; 12.8143; 22.3108
91.516; 95.983; 93.882
2748.7Domski, Gregory J.; Eagan, James M.; De Rosa, Claudio; Di Girolamo, Rocco; LaPointe, Anne M.; Lobkovsky, Emil B.; Talarico, Giovanni; Coates, Geoffrey W.
Combined Experimental and Theoretical Approach for Living and Isoselective Propylene Polymerization
ACS Catalysis, 2017, 7, 6930
4514200 CIFC32 H36 Hf N2P -19.3898; 10.7845; 13.8529
87.005; 78.576; 86.78
1371.63Domski, Gregory J.; Eagan, James M.; De Rosa, Claudio; Di Girolamo, Rocco; LaPointe, Anne M.; Lobkovsky, Emil B.; Talarico, Giovanni; Coates, Geoffrey W.
Combined Experimental and Theoretical Approach for Living and Isoselective Propylene Polymerization
ACS Catalysis, 2017, 7, 6930
4514201 CIFC30 H30 Br N3 O4P 21 21 218.2547; 11.7633; 28.9888
90; 90; 90
2814.89Jiang, Fei; Zhao, Dan; Yang, Xue; Yuan, Fu-Ru; Mei, Guang-Jian; Shi, Feng
Catalyst-Controlled Chemoselective and Enantioselective Reactions of Tryptophols with Isatin-Derived Imines
ACS Catalysis, 2017, 7, 6984
4514202 CIFC30 H30 Cl N3 O4P -19.6201; 10.3131; 14.6525
78.547; 72.894; 89.686
1359.6Jiang, Fei; Zhao, Dan; Yang, Xue; Yuan, Fu-Ru; Mei, Guang-Jian; Shi, Feng
Catalyst-Controlled Chemoselective and Enantioselective Reactions of Tryptophols with Isatin-Derived Imines
ACS Catalysis, 2017, 7, 6984

Left arrow Left arrow First | Left arrow Previous 100 | of 2 | Next 100 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!