Crystallography Open Database

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Searching journal of publication like 'ACS catalysis' volume of publication is 8

COD ID: 4514298
CIF file Formula: - C34.67 H38.67 Cl0.67 N1.33 Ni0.67 P0.67 -
Comments: Nazari, S. Hadi; Bourdeau, Jefferson E.; Talley, Michael R.; Valdivia-Berroeta, Gabriel A.; Smith, Stacey J.; Michaelis, David J. Nickel-Catalyzed Suzuki Cross Couplings with Unprotected Allylic Alcohols Enabled by Bidentate N-Heterocyclic Carbene (NHC)/Phosphine Ligands ACS Catalysis 8(1) (2017) 86
Space group: P 1 21/n 1
Cell volume: 4431.1
Cell parameters: 13.1807; 21.777; 15.5892; 90; 97.999; 90;  

COD ID: 4514299
CIF file Formula: - C18 H18 O2 S2 -
Comments: Lanzi, Matteo; Cañeque, Tatiana; Marchiò, Luciano; Maggi, Raimondo; Bigi, Franca; Malacria, Max; Maestri, Giovanni Alternative Routes to Tricyclic Cyclohexenes with Trinuclear Palladium Complexes ACS Catalysis 8(1) (2017) 144
Space group: C 1 2/c 1
Cell volume: 3140.9
Cell parameters: 18.468; 5.7696; 29.486; 90; 91.375; 90;  

COD ID: 4514300
CIF file Formula: - C29 H29 N O3 S -
Comments: Lanzi, Matteo; Cañeque, Tatiana; Marchiò, Luciano; Maggi, Raimondo; Bigi, Franca; Malacria, Max; Maestri, Giovanni Alternative Routes to Tricyclic Cyclohexenes with Trinuclear Palladium Complexes ACS Catalysis 8(1) (2017) 144
Space group: C 1 2/c 1
Cell volume: 4880.3
Cell parameters: 19.9655; 9.2515; 27.268; 90; 104.314; 90;  

COD ID: 4514301
CIF file Formula: - C121 H176 O12 P2 Sc2 -
Comments: Xu, Pengfei; Xu, Xin Homoleptic Rare-Earth Aryloxide Based Lewis Pairs for Polymerization of Conjugated Polar Alkenes ACS Catalysis 8(1) (2017) 198
Space group: P 1 21/n 1
Cell volume: 5668.3
Cell parameters: 17.6216; 14.3906; 22.3619; 90; 91.6518; 90;  

COD ID: 4514302
CIF file Formula: - C60 H86 O5 P Sc -
Comments: Xu, Pengfei; Xu, Xin Homoleptic Rare-Earth Aryloxide Based Lewis Pairs for Polymerization of Conjugated Polar Alkenes ACS Catalysis 8(1) (2017) 198
Space group: P 1 21/c 1
Cell volume: 5636.1
Cell parameters: 13.4046; 15.1609; 28.5176; 90; 103.471; 90;  

COD ID: 4514315
CIF file Formula: - C30 H28 N2 O2 S -
Comments: Hatano, Manabu; Mochizuki, Takuya; Nishikawa, Keisuke; Ishihara, Kazuaki Enantioselective Aza-Friedel‒Crafts Reaction of Indoles with Ketimines Catalyzed by Chiral Potassium Binaphthyldisulfonates ACS Catalysis 8(1) (2017) 349
Space group: P 1
Cell volume: 1236.4
Cell parameters: 9.528; 10.803; 12.452; 94.682; 100.658; 98.889;  

COD ID: 4514316
CIF file Formula: - C60 H48 Ca O10 S2 -
Comments: Hatano, Manabu; Mochizuki, Takuya; Nishikawa, Keisuke; Ishihara, Kazuaki Enantioselective Aza-Friedel‒Crafts Reaction of Indoles with Ketimines Catalyzed by Chiral Potassium Binaphthyldisulfonates ACS Catalysis 8(1) (2017) 349
Space group: P 1 21 1
Cell volume: 2983
Cell parameters: 15.348; 11.244; 17.721; 90; 102.716; 90;  

COD ID: 4514318
CIF file Formula: - C92 H76 Cl4 O10 Rh2 -
Comments: Liao, Kuangbiao; Liu, Wenbin; Niemeyer, Zachary L.; Ren, Zhi; Bacsa, John; Musaev, Djamaladdin G.; Sigman, Mathew S.; Davies, Huw M. L. Site-Selective Carbene-Induced C‒H Functionalization Catalyzed by Dirhodium Tetrakis(triarylcyclopropanecarboxylate) Complexes ACS Catalysis 8(1) (2017) 678
Space group: P 21 21 21
Cell volume: 8119.9
Cell parameters: 15.5416; 22.2438; 23.488; 90; 90; 90;  

COD ID: 4514319
CIF file Formula: - C124 H114 O11 Rh2 -
Comments: Liao, Kuangbiao; Liu, Wenbin; Niemeyer, Zachary L.; Ren, Zhi; Bacsa, John; Musaev, Djamaladdin G.; Sigman, Mathew S.; Davies, Huw M. L. Site-Selective Carbene-Induced C‒H Functionalization Catalyzed by Dirhodium Tetrakis(triarylcyclopropanecarboxylate) Complexes ACS Catalysis 8(1) (2017) 678
Space group: P 1 21 1
Cell volume: 5348
Cell parameters: 11.764; 17.436; 26.079; 90; 91.389; 90;  

COD ID: 4514320
CIF file Formula: - C18 H43.6 Ca I2 N6 O6.8 -
Comments: Longwitz, Lars; Steinbauer, Johannes; Spannenberg, Anke; Werner, Thomas Calcium-Based Catalytic System for the Synthesis of Bio-Derived Cyclic Carbonates under Mild Conditions ACS Catalysis 8(1) (2017) 665
Space group: P 1 21/c 1
Cell volume: 3225.58
Cell parameters: 12.5906; 22.4298; 11.671; 90; 101.86; 90;  

COD ID: 4514321
CIF file Formula: - C18 H39 Ca I2 N3 O7 -
Comments: Longwitz, Lars; Steinbauer, Johannes; Spannenberg, Anke; Werner, Thomas Calcium-Based Catalytic System for the Synthesis of Bio-Derived Cyclic Carbonates under Mild Conditions ACS Catalysis 8(1) (2017) 665
Space group: P 1 21/n 1
Cell volume: 1389.53
Cell parameters: 10.6093; 7.3183; 18.0196; 90; 96.6981; 90;  

COD ID: 4514324
CIF file Formula: - C18 H17 F O2 -
Comments: Mixdorf, Jason C.; Sorlin, Alexandre M.; Zhang, Qi; Nguyen, Hien M. Asymmetric Synthesis of Allylic Fluorides via Fluorination of Racemic Allylic Trichloroacetimidates Catalyzed by a Chiral Diene-Iridium Complex ACS Catalysis 8(2) (2017) 790
Space group: P 1 21 1
Cell volume: 1438.28
Cell parameters: 5.7745; 15.6042; 16.0104; 90; 94.458; 90;  

COD ID: 4514325
CIF file Formula: - C40 H32 Cl2 F4 Ir2 -
Comments: Mixdorf, Jason C.; Sorlin, Alexandre M.; Zhang, Qi; Nguyen, Hien M. Asymmetric Synthesis of Allylic Fluorides via Fluorination of Racemic Allylic Trichloroacetimidates Catalyzed by a Chiral Diene-Iridium Complex ACS Catalysis 8(2) (2017) 790
Space group: P 21 21 2
Cell volume: 3261.8
Cell parameters: 20.627; 10.6003; 14.9178; 90; 90; 90;  

COD ID: 4514326
CIF file Formula: - C17 H13 Br F2 O2 -
Comments: Mixdorf, Jason C.; Sorlin, Alexandre M.; Zhang, Qi; Nguyen, Hien M. Asymmetric Synthesis of Allylic Fluorides via Fluorination of Racemic Allylic Trichloroacetimidates Catalyzed by a Chiral Diene-Iridium Complex ACS Catalysis 8(2) (2017) 790
Space group: P 1 21 1
Cell volume: 3056.1
Cell parameters: 18.1462; 7.5224; 22.412; 90; 92.604; 90;  

COD ID: 4514327
CIF file Formula: - C14 H18 F N O2 S -
Comments: Mixdorf, Jason C.; Sorlin, Alexandre M.; Zhang, Qi; Nguyen, Hien M. Asymmetric Synthesis of Allylic Fluorides via Fluorination of Racemic Allylic Trichloroacetimidates Catalyzed by a Chiral Diene-Iridium Complex ACS Catalysis 8(2) (2017) 790
Space group: P 1 21 1
Cell volume: 715.64
Cell parameters: 6.1963; 13.8442; 8.5199; 90; 101.713; 90;  

COD ID: 4514328
CIF file Formula: - C22 H27 F O2 -
Comments: Mixdorf, Jason C.; Sorlin, Alexandre M.; Zhang, Qi; Nguyen, Hien M. Asymmetric Synthesis of Allylic Fluorides via Fluorination of Racemic Allylic Trichloroacetimidates Catalyzed by a Chiral Diene-Iridium Complex ACS Catalysis 8(2) (2017) 790
Space group: P 21 21 21
Cell volume: 1811.6
Cell parameters: 5.9526; 9.1966; 33.092; 90; 90; 90;  

COD ID: 4514336
CIF file Formula: - C34 H33 Br N4 O2 -
Comments: Korvorapun, Korkit; Kaplaneris, Nikolaos; Rogge, Torben; Warratz, Svenja; Stückl, A. Claudia; Ackermann, Lutz Sequential meta-/ortho-C‒H Functionalizations by One-Pot Ruthenium(II/III) Catalysis ACS Catalysis 8(2) (2018) 886
Space group: P -1
Cell volume: 1445
Cell parameters: 8.4938; 10.8107; 16.6719; 104.927; 95.326; 99.344;  

COD ID: 4514337
CIF file Formula: - C21 H27 N3 O -
Comments: Korvorapun, Korkit; Kaplaneris, Nikolaos; Rogge, Torben; Warratz, Svenja; Stückl, A. Claudia; Ackermann, Lutz Sequential meta-/ortho-C‒H Functionalizations by One-Pot Ruthenium(II/III) Catalysis ACS Catalysis 8(2) (2018) 886
Space group: P -1
Cell volume: 1863.12
Cell parameters: 10.1934; 10.7135; 17.2661; 89.316; 85.141; 82.592;  

COD ID: 4514338
CIF file Formula: - C23 H21 N3 O3 -
Comments: Korvorapun, Korkit; Kaplaneris, Nikolaos; Rogge, Torben; Warratz, Svenja; Stückl, A. Claudia; Ackermann, Lutz Sequential meta-/ortho-C‒H Functionalizations by One-Pot Ruthenium(II/III) Catalysis ACS Catalysis 8(2) (2018) 886
Space group: P 21 21 21
Cell volume: 1985
Cell parameters: 6.2748; 13.137; 24.081; 90; 90; 90;  

COD ID: 4514339
CIF file Formula: - C17 H21 N3 O -
Comments: Korvorapun, Korkit; Kaplaneris, Nikolaos; Rogge, Torben; Warratz, Svenja; Stückl, A. Claudia; Ackermann, Lutz Sequential meta-/ortho-C‒H Functionalizations by One-Pot Ruthenium(II/III) Catalysis ACS Catalysis 8(2) (2018) 886
Space group: P 1 21/n 1
Cell volume: 1487.53
Cell parameters: 10.0808; 9.7488; 15.9224; 90; 108.079; 90;  

COD ID: 4514340
CIF file Formula: - C17 H19 N3 O2 -
Comments: Korvorapun, Korkit; Kaplaneris, Nikolaos; Rogge, Torben; Warratz, Svenja; Stückl, A. Claudia; Ackermann, Lutz Sequential meta-/ortho-C‒H Functionalizations by One-Pot Ruthenium(II/III) Catalysis ACS Catalysis 8(2) (2018) 886
Space group: P 1 21/n 1
Cell volume: 1497.7
Cell parameters: 10.0431; 9.7828; 15.4733; 90; 99.887; 90;  

COD ID: 4514341
CIF file Formula: - C25 H21 F N2 O7 Se -
Comments: See, Jie Yang; Yang, Hui; Zhao, Yu; Wong, Ming Wah; Ke, Zhihai; Yeung, Ying-Yeung Desymmetrizing Enantio- and Diastereoselective Selenoetherification through Supramolecular Catalysis ACS Catalysis 8(2) (2018) 850
Space group: P 1 21 1
Cell volume: 1155.8
Cell parameters: 9.722; 6.1683; 19.747; 90; 102.561; 90;  

COD ID: 4514342
CIF file Formula: - C27 H39 O4.5 S0.5 Se -
Comments: See, Jie Yang; Yang, Hui; Zhao, Yu; Wong, Ming Wah; Ke, Zhihai; Yeung, Ying-Yeung Desymmetrizing Enantio- and Diastereoselective Selenoetherification through Supramolecular Catalysis ACS Catalysis 8(2) (2018) 850
Space group: P 1
Cell volume: 5341.6
Cell parameters: 12.1582; 19.1469; 23.6521; 80.268; 80.837; 84.148;  

COD ID: 4514343
CIF file Formula: - C18 H18 F2 O4 Se -
Comments: See, Jie Yang; Yang, Hui; Zhao, Yu; Wong, Ming Wah; Ke, Zhihai; Yeung, Ying-Yeung Desymmetrizing Enantio- and Diastereoselective Selenoetherification through Supramolecular Catalysis ACS Catalysis 8(2) (2018) 850
Space group: P 1 21 1
Cell volume: 2542.4
Cell parameters: 6.7417; 22.7327; 16.9277; 90; 101.477; 90;  

COD ID: 4514344
CIF file Formula: - C31 H50 B N2 P Ru -
Comments: Beguerie, Marion; Dinoi, Chiara; del Rosal, Iker; Faradji, Charly; Alcaraz, Gilles; Vendier, Laure; Sabo-Etienne, Sylviane Mechanistic Studies on the Catalytic Synthesis of BN Heterocycles (1H-2,1-Benzazaboroles) at Ruthenium ACS Catalysis 8(2) (2018) 939
Space group: P -1
Cell volume: 2963.7
Cell parameters: 9.9745; 14.6282; 21.2096; 103.406; 99.818; 90.008;  

COD ID: 4514345
CIF file Formula: - C59 H96 Mn N O4 P2 -
Comments: Kulkarni, Naveen V.; Brennessel, William W.; Jones, William D. Catalytic Upgrading of Ethanol to n-Butanol via Manganese-Mediated Guerbet Reaction ACS Catalysis 8(2) (2018) 997
Space group: P 1 21/m 1
Cell volume: 2623.2
Cell parameters: 12.513; 17.266; 12.709; 90; 107.182; 90;  

COD ID: 4514346
CIF file Formula: - C47.5 H72 Br Cl3 Mn N O2 P2 -
Comments: Kulkarni, Naveen V.; Brennessel, William W.; Jones, William D. Catalytic Upgrading of Ethanol to n-Butanol via Manganese-Mediated Guerbet Reaction ACS Catalysis 8(2) (2018) 997
Space group: P 1 21 1
Cell volume: 4557.8
Cell parameters: 16.074; 19.166; 16.17; 90; 113.805; 90;  

COD ID: 4514350
CIF file Formula: - C46 H38 F12 Fe2 N10 O15 S4 -
Comments: Kottrup, Konstantin G.; D'Agostini, Silvia; van Langevelde, Phebe H.; Siegler, Maxime A.; Hetterscheid, Dennis G. H. Catalytic Activity of an Iron-Based Water Oxidation Catalyst: Substrate Effects of Graphitic Electrodes. ACS catalysis 8(2) (2018) 1052-1061
Space group: P -1
Cell volume: 2769.26
Cell parameters: 11.9405; 12.2853; 20.3054; 103.183; 102.56; 98.477;  

COD ID: 4514351
CIF file Formula: - C20 H26 O6 -
Comments: Verrier, Charlie; Alandini, Nurtalya; Pezzetta, Cristofer; Moliterno, Mauro; Buzzetti, Luca; Hepburn, Hamish B.; Vega-Peñaloza, Alberto; Silvi, Mattia; Melchiorre, Paolo Direct Stereoselective Installation of Alkyl Fragments at the β-Carbon of Enals via Excited Iminium Ion Catalysis ACS Catalysis 8(2) (2018) 1062
Space group: P 1 21 1
Cell volume: 3848.9
Cell parameters: 20.0688; 9.57471; 21.8114; 90; 113.315; 90;  

COD ID: 4514352
CIF file Formula: - C31 H27 Fe N3 O S4 -
Comments: Das, Uttam K.; Higman, Carolyn S.; Gabidullin, Bulat; Hein, Jason E.; Baker, R. Tom Efficient and Selective Iron-Complex-Catalyzed Hydroboration of Aldehydes ACS Catalysis 8(2) (2018) 1076
Space group: P -1
Cell volume: 3021.9
Cell parameters: 11.0218; 16.5594; 17.2264; 76.1184; 89.3326; 82.0211;  

COD ID: 4514353
CIF file Formula: - C32 H32 Fe N2 O S4 -
Comments: Das, Uttam K.; Higman, Carolyn S.; Gabidullin, Bulat; Hein, Jason E.; Baker, R. Tom Efficient and Selective Iron-Complex-Catalyzed Hydroboration of Aldehydes ACS Catalysis 8(2) (2018) 1076
Space group: P -1
Cell volume: 1484.95
Cell parameters: 10.4477; 12.8949; 13.2739; 64.316; 67.177; 79.099;  

COD ID: 4514354
CIF file Formula: - C33 H36 Fe N3 O3 P S4 -
Comments: Das, Uttam K.; Higman, Carolyn S.; Gabidullin, Bulat; Hein, Jason E.; Baker, R. Tom Efficient and Selective Iron-Complex-Catalyzed Hydroboration of Aldehydes ACS Catalysis 8(2) (2018) 1076
Space group: P n a 21
Cell volume: 3426.42
Cell parameters: 28.2857; 7.9962; 15.1492; 90; 90; 90;  

COD ID: 4514356
CIF file Formula: - C18 H37 Cl4 Cr Li N2 O2 P -
Comments: Kwon, Doo-Hyun; Fuller, Jack T.; Kilgore, Uriah J.; Sydora, Orson L.; Bischof, Steven M.; Ess, Daniel H. Computational Transition-State Design Provides Experimentally Verified Cr(P,N) Catalysts for Control of Ethylene Trimerization and Tetramerization ACS Catalysis 8(2) (2018) 1138
Space group: P 1 21/c 1
Cell volume: 2578.9
Cell parameters: 10.0101; 19.2905; 14.2617; 90; 110.537; 90;  

COD ID: 4514357
CIF file Formula: - C30 H27 Br N2 O -
Comments: Arokianathar, Jude N.; Frost, Aileen B.; Slawin, Alexandra M. Z.; Stead, Darren; Smith, Andrew D. Isothiourea-Catalyzed Enantioselective Addition of 4-Nitrophenyl Esters to Iminium Ions ACS Catalysis 8(2) (2018) 1153
Space group: P b c a
Cell volume: 4878.76
Cell parameters: 9.92477; 18.1707; 27.0531; 90; 90; 90;  

COD ID: 4514358
CIF file Formula: - C30 H27.67 Br N2 O1.33 -
Comments: Arokianathar, Jude N.; Frost, Aileen B.; Slawin, Alexandra M. Z.; Stead, Darren; Smith, Andrew D. Isothiourea-Catalyzed Enantioselective Addition of 4-Nitrophenyl Esters to Iminium Ions ACS Catalysis 8(2) (2018) 1153
Space group: P -1
Cell volume: 4452.5
Cell parameters: 14.476; 17.657; 18.147; 81.051; 77.873; 82.012;  

COD ID: 4514359
CIF file Formula: - C94 H68 Br4 Cl4 N4 Ni2 -
Comments: Pei, Lixia; Liu, Fengshou; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis of Polyethylenes with Controlled Branching with α-Diimine Nickel Catalysts and Revisiting Formation of Long-Chain Branching ACS Catalysis 8(2) (2018) 1104
Space group: P 1 21/n 1
Cell volume: 3978.6
Cell parameters: 11.4354; 18.923; 18.566; 90; 97.981; 90;  

COD ID: 4514360
CIF file Formula: - C52 H44 Br2 Cl8 N2 Ni -
Comments: Pei, Lixia; Liu, Fengshou; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis of Polyethylenes with Controlled Branching with α-Diimine Nickel Catalysts and Revisiting Formation of Long-Chain Branching ACS Catalysis 8(2) (2018) 1104
Space group: I b a 2
Cell volume: 5999
Cell parameters: 24.752; 10.97; 22.093; 90; 90; 90;  

COD ID: 4514361
CIF file Formula: - C38 H36 Br2 N2 Ni -
Comments: Pei, Lixia; Liu, Fengshou; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis of Polyethylenes with Controlled Branching with α-Diimine Nickel Catalysts and Revisiting Formation of Long-Chain Branching ACS Catalysis 8(2) (2018) 1104
Space group: P 1 21/c 1
Cell volume: 3355
Cell parameters: 13.579; 14.443; 18.148; 90; 109.503; 90;  

COD ID: 4514363
CIF file Formula: - C23 H47 Fe N2 O3 P2 -
Comments: Jayarathne, Upul; Hazari, Nilay; Bernskoetter, Wesley H. Selective Iron-Catalyzed N-Formylation of Amines using Dihydrogen and Carbon Dioxide ACS Catalysis 8(2) (2018) 1338
Space group: P 1 21/c 1
Cell volume: 5458.2
Cell parameters: 16.336; 12.2113; 27.367; 90; 91.146; 90;  

COD ID: 4514364
CIF file Formula: - C19 H39 Fe N O2 P2 -
Comments: Jayarathne, Upul; Hazari, Nilay; Bernskoetter, Wesley H. Selective Iron-Catalyzed N-Formylation of Amines using Dihydrogen and Carbon Dioxide ACS Catalysis 8(2) (2018) 1338
Space group: P 1 21/c 1
Cell volume: 4486.7
Cell parameters: 19.086; 16.908; 15.109; 90; 113.043; 90;  

COD ID: 4514365
CIF file Formula: - C21 H40 F6 Fe Li N O8 P2 S2 -
Comments: Jayarathne, Upul; Hazari, Nilay; Bernskoetter, Wesley H. Selective Iron-Catalyzed N-Formylation of Amines using Dihydrogen and Carbon Dioxide ACS Catalysis 8(2) (2018) 1338
Space group: P 1 21/n 1
Cell volume: 3176
Cell parameters: 8.6289; 29.4056; 13.2362; 90; 108.974; 90;  

COD ID: 4514366
CIF file Formula: - C78 H94 Ag4 F9 N24 O22 S6 -
Comments: Chang, Zhiduo; Jing, Xu; He, Cheng; Liu, Xin; Duan, Chunying Silver Clusters as Robust Nodes and π‒Activation Sites for the Construction of Heterogeneous Catalysts for the Cycloaddition of Propargylamines ACS Catalysis 8(2) (2018) 1384
Space group: P 21 3
Cell volume: 43680
Cell parameters: 35.2177; 35.2177; 35.2177; 90; 90; 90;  

COD ID: 4514367
CIF file Formula: - C150 H164 Ag8 F9 N53 O25 S12 -
Comments: Chang, Zhiduo; Jing, Xu; He, Cheng; Liu, Xin; Duan, Chunying Silver Clusters as Robust Nodes and π‒Activation Sites for the Construction of Heterogeneous Catalysts for the Cycloaddition of Propargylamines ACS Catalysis 8(2) (2018) 1384
Space group: P 21 3
Cell volume: 43580.8
Cell parameters: 35.191; 35.191; 35.191; 90; 90; 90;  

COD ID: 4514368
CIF file Formula: - C120 H162 Ag8 F0 N60 O18 S13 -
Comments: Chang, Zhiduo; Jing, Xu; He, Cheng; Liu, Xin; Duan, Chunying Silver Clusters as Robust Nodes and π‒Activation Sites for the Construction of Heterogeneous Catalysts for the Cycloaddition of Propargylamines ACS Catalysis 8(2) (2018) 1384
Space group: P a -3
Cell volume: 46017
Cell parameters: 35.835; 35.835; 35.835; 90; 90; 90;  

COD ID: 4514369
CIF file Formula: - C16 H15 Cl O2 -
Comments: Gollapelli, Krishna Kumar; Donikela, Sangeetha; Manjula, Nemali; Chegondi, Rambabu Rhodium-Catalyzed Highly Regio- and Enantioselective Reductive Cyclization of Alkyne-Tethered Cyclohexadienones ACS Catalysis 8(2) (2018) 1440
Space group: P 21 21 21
Cell volume: 1340.7
Cell parameters: 6.78; 10.4553; 18.9129; 90; 90; 90;  

COD ID: 4514377
CIF file Formula: - C45 H38 Ni O P2 -
Comments: Zhang, Xin; Tutkowski, Brandon; Oliver, Allen; Helquist, Paul; Wiest, Olaf Mechanistic Study of the Nickel-Catalyzed α,β-Coupling of Saturated Ketones ACS Catalysis 8(3) (2018) 1740
Space group: P -1
Cell volume: 1773.5
Cell parameters: 9.418; 10.2752; 18.5554; 94.536; 92.905; 96.975;  

COD ID: 4514380
CIF file Formula: - C21 H21 N O3 -
Comments: Kuppusamy, Ramajayam; Santhoshkumar, Rajagopal; Boobalan, Ramadoss; Wu, Hsin-Ru; Cheng, Chien-Hong Synthesis of 1,2-Dihydroquinolines by Co(III)-Catalyzed [3 + 3] Annulation of Anilides with Benzylallenes ACS Catalysis 8(3) (2018) 1880
Space group: P 1 21/c 1
Cell volume: 1699.28
Cell parameters: 13.6373; 15.8546; 8.1178; 90; 104.499; 90;  

COD ID: 4514381
CIF file Formula: - C20 H20 Cl N O4 -
Comments: Esteban, Francisco; Cieślik, Wioleta; Arpa, Enrique M.; Guerrero-Corella, Andrea; Díaz-Tendero, Sergio; Perles, Josefina; Fernández-Salas, José A; Fraile, Alberto; Alemán, José Intramolecular Hydrogen Bond Activation: Thiourea-Organocatalyzed Enantioselective 1,3-Dipolar Cycloaddition of Salicylaldehyde-Derived Azomethine Ylides with Nitroalkenes. ACS catalysis 8(3) (2018) 1884-1890
Space group: P 21 21 21
Cell volume: 1844.6
Cell parameters: 9.027; 10.076; 20.28; 90; 90; 90;  

COD ID: 4514382
CIF file Formula: - C20 H19 N O4 -
Comments: Esteban, Francisco; Cieślik, Wioleta; Arpa, Enrique M.; Guerrero-Corella, Andrea; Díaz-Tendero, Sergio; Perles, Josefina; Fernández-Salas, José A; Fraile, Alberto; Alemán, José Intramolecular Hydrogen Bond Activation: Thiourea-Organocatalyzed Enantioselective 1,3-Dipolar Cycloaddition of Salicylaldehyde-Derived Azomethine Ylides with Nitroalkenes. ACS catalysis 8(3) (2018) 1884-1890
Space group: P 1 21 1
Cell volume: 859.68
Cell parameters: 8.8134; 9.1977; 10.6394; 90; 94.6009; 90;  

COD ID: 4514383
CIF file Formula: - C18 H17 Br N2 O5 -
Comments: Esteban, Francisco; Cieślik, Wioleta; Arpa, Enrique M.; Guerrero-Corella, Andrea; Díaz-Tendero, Sergio; Perles, Josefina; Fernández-Salas, José A; Fraile, Alberto; Alemán, José Intramolecular Hydrogen Bond Activation: Thiourea-Organocatalyzed Enantioselective 1,3-Dipolar Cycloaddition of Salicylaldehyde-Derived Azomethine Ylides with Nitroalkenes. ACS catalysis 8(3) (2018) 1884-1890
Space group: P 21 21 2
Cell volume: 1837
Cell parameters: 13.9676; 23.8405; 5.5166; 90; 90; 90;  

COD ID: 4514384
CIF file Formula: - C24 H29 N2 O3 Rh S -
Comments: Ran, You; Yang, Yudong; You, Huansha; You, Jingsong RhCl3-Catalyzed Oxidative C‒H/C‒H Cross-Coupling of (Hetero)aromatic Sulfonamides with (Hetero)arenes ACS Catalysis 8(3) (2018) 1796
Space group: P 1 21/n 1
Cell volume: 2403.26
Cell parameters: 9.8164; 14.358; 17.0526; 90; 90.736; 90;  

COD ID: 4514387
CIF file Formula: - C26 H24 Br N O -
Comments: Huang, Jian-Qiang; Liu, Wei; Zheng, Bao-Hui; Liu, Xiu Yan; Yang, Zhen; Ding, Chang-Hua; Li, Hao; Peng, Qian; Hou, Xue-Long Pd-Catalyzed Asymmetric Cyclopropanation Reaction of Acyclic Amides with Allyl and Polyenyl Carbonates. Experimental and Computational Studies for the Origin of Cyclopropane Formation ACS Catalysis 8(3) (2018) 1964
Space group: P 1 21 1
Cell volume: 1116
Cell parameters: 11.693; 6.314; 15.57; 90; 103.875; 90;  

COD ID: 4514388
CIF file Formula: - C23 H22 F6 N3 P Pd -
Comments: Huang, Jian-Qiang; Liu, Wei; Zheng, Bao-Hui; Liu, Xiu Yan; Yang, Zhen; Ding, Chang-Hua; Li, Hao; Peng, Qian; Hou, Xue-Long Pd-Catalyzed Asymmetric Cyclopropanation Reaction of Acyclic Amides with Allyl and Polyenyl Carbonates. Experimental and Computational Studies for the Origin of Cyclopropane Formation ACS Catalysis 8(3) (2018) 1964
Space group: P 1 21/n 1
Cell volume: 2263.8
Cell parameters: 11.7229; 13.9765; 13.8227; 90; 91.721; 90;  

COD ID: 4514394
CIF file Formula: - C24 H33 Ir N2 O6 -
Comments: Yuan, Hongmei; Brennessel, William W.; Jones, William D. Effect of Carboxylate Ligands on Alkane Dehydrogenation with (dmPhebox)Ir Complexes ACS Catalysis 8(3) (2018) 2326
Space group: P 1 21/n 1
Cell volume: 7202.5
Cell parameters: 14.1793; 34.531; 16.0684; 90; 113.726; 90;  

COD ID: 4514395
CIF file Formula: - C28 H43 Ir N2 O7 -
Comments: Yuan, Hongmei; Brennessel, William W.; Jones, William D. Effect of Carboxylate Ligands on Alkane Dehydrogenation with (dmPhebox)Ir Complexes ACS Catalysis 8(3) (2018) 2326
Space group: P 1 21/c 1
Cell volume: 3076.1
Cell parameters: 17.9996; 11.5553; 15.0325; 90; 100.311; 90;  

COD ID: 4514396
CIF file Formula: - C34 H39 Ir N2 O7 -
Comments: Yuan, Hongmei; Brennessel, William W.; Jones, William D. Effect of Carboxylate Ligands on Alkane Dehydrogenation with (dmPhebox)Ir Complexes ACS Catalysis 8(3) (2018) 2326
Space group: P -1
Cell volume: 1574.4
Cell parameters: 10.4412; 11.3139; 13.9001; 75.379; 83.373; 84.494;  

COD ID: 4514397
CIF file Formula: - C28 H39 Ir N2 O7 -
Comments: Yuan, Hongmei; Brennessel, William W.; Jones, William D. Effect of Carboxylate Ligands on Alkane Dehydrogenation with (dmPhebox)Ir Complexes ACS Catalysis 8(3) (2018) 2326
Space group: P 1 21/c 1
Cell volume: 5624.2
Cell parameters: 12.1132; 39.536; 11.7754; 90; 94.196; 90;  

COD ID: 4514398
CIF file Formula: - C87 H190 N3 O38 P Si3 Ti W9 -
Comments: Zhang, Teng; Mazaud, Louis; Chamoreau, Lise-Marie; Paris, Céline; Proust, Anna; Guillemot, Geoffroy Unveiling the Active Surface Sites in Heterogeneous Titanium-Based Silicalite Epoxidation Catalysts: Input of Silanol-Functionalized Polyoxotungstates as Soluble Analogues ACS Catalysis 8(3) (2018) 2330
Space group: P b c a
Cell volume: 24746
Cell parameters: 20.2301; 28.431; 43.025; 90; 90; 90;  

COD ID: 4514400
CIF file Formula: - C27 H18 O2 -
Comments: Mondal, Atanu; Hazra, Raju; Grover, Jagdeep; Raghu, Moluguri; Ramasastry, S. S. V. Organophosphine-Catalyzed Intramolecular Hydroacylation of Activated Alkynes ACS Catalysis 8(4) (2018) 2748
Space group: P 1 21/c 1
Cell volume: 1900.99
Cell parameters: 17.4516; 7.5513; 15.134; 90; 107.604; 90;  

COD ID: 4514401
CIF file Formula: - C61 H51 Cl3 F6 N3 P3 Ru -
Comments: Paul, Bhaskar; Shee, Sujan; Panja, Dibyajyoti; Chakrabarti, Kaushik; Kundu, Sabuj Direct Synthesis of N,N-Dimethylated and β-Methyl N,N-Dimethylated Amines from Nitriles Using Methanol: Experimental and Computational Studies ACS Catalysis 8(4) (2018) 2890
Space group: P 1 21/c 1
Cell volume: 5294.9
Cell parameters: 10.0272; 23.326; 22.7595; 90; 95.922; 90;  

COD ID: 4515514
CIF file Formula: - C25 H38 B N O6 S -
Comments: Kim-Lee, Shin-Ho; Alonso, Inés; Mauleón, Pablo; Arrayás, Ramón Gómez; Carretero, Juan C. Rationalizing the Role of NaOtBu in Copper-Catalyzed Carboboration of Alkynes: Assembly of Allylic All-Carbon Quaternary Stereocenters ACS Catalysis 8(10) (2018) 8993
Space group: P -1
Cell volume: 1318.18
Cell parameters: 11.446; 11.5967; 12.3843; 112.094; 115.7; 93.978;  

COD ID: 4515515
CIF file Formula: - C21 H22 F N O4 -
Comments: Park, Hojoon; Chekshin, Nikita; Shen, Peng-Xiang; Yu, Jin-Quan Ligand-Enabled, Palladium-Catalyzed β-C(sp<sup>3</sup>)-H Arylation of Weinreb Amides. ACS catalysis 8(10) (2018) 9292-9297
Space group: P 1 21/c 1
Cell volume: 3609.3
Cell parameters: 27.4465; 6.4873; 22.0138; 90; 112.954; 90;  

COD ID: 4515516
CIF file Formula: - C41 H51 Co K N6 O11 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 21 21 21
Cell volume: 4459.7
Cell parameters: 11.0919; 18.3376; 21.9261; 90; 90; 90;  

COD ID: 4515517
CIF file Formula: - C45 H36 K Mn N7 O3 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/n 1
Cell volume: 4093.1
Cell parameters: 11.7651; 21.2221; 16.4682; 90; 95.468; 90;  

COD ID: 4515518
CIF file Formula: - C45 H48 N4 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P -1
Cell volume: 1813.7
Cell parameters: 9.1381; 12.0237; 17.8361; 96.278; 90.36; 111.214;  

COD ID: 4515519
CIF file Formula: - C50 H55 K Mn N4 O2 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/n 1
Cell volume: 4383.4
Cell parameters: 11.527; 13.729; 27.724; 90; 92.471; 90;  

COD ID: 4515520
CIF file Formula: - C53 H47.5 F9 K Mn N4.5 O6.5 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/n 1
Cell volume: 4994.5
Cell parameters: 12.3883; 18.995; 21.656; 90; 101.457; 90;  

COD ID: 4515521
CIF file Formula: - C48 H39 F9 N4 O6 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/c 1
Cell volume: 4484
Cell parameters: 19.36; 10.0615; 29.486; 90; 128.675; 90;  

COD ID: 4515522
CIF file Formula: - C88 H131 K Mn N4 O7 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P -1
Cell volume: 4244.6
Cell parameters: 13.4244; 15.4608; 21.041; 92.203; 93.474; 102.805;  

COD ID: 4515523
CIF file Formula: - C54 H45 F18 K Mn N4 O3 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P -1
Cell volume: 2817.9
Cell parameters: 12.729; 14.584; 16.701; 112.045; 92.891; 99.02;  

COD ID: 4515524
CIF file Formula: - C148 H198 Cl0 K4 Mn4 N20 O19 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P -1
Cell volume: 3783.1
Cell parameters: 12.421; 13.222; 24.754; 89.65; 77.831; 72.506;  

COD ID: 4515525
CIF file Formula: - C64.75 H86 K Mn N4 O4 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P -1
Cell volume: 3055
Cell parameters: 11.719; 12.417; 21.77; 91.221; 100.827; 100.424;  

COD ID: 4515526
CIF file Formula: - C58 H71 K Mn N4 O4 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/n 1
Cell volume: 5247.1
Cell parameters: 12.4818; 21.792; 20.039; 90; 105.708; 90;  

COD ID: 4515527
CIF file Formula: - C32 H29 F9 K Mn N6 O5 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: C 1 c 1
Cell volume: 3788
Cell parameters: 18.3717; 10.8662; 19.0286; 90; 94.307; 90;  

COD ID: 4515528
CIF file Formula: - C41 H51 Fe K N6 O11 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 21 21 21
Cell volume: 4487.5
Cell parameters: 11.1683; 18.406; 21.83; 90; 90; 90;  

COD ID: 4515529
CIF file Formula: - C56 H61 Cl6 K Mn N4 O5 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/n 1
Cell volume: 5617
Cell parameters: 11.391; 20.1796; 24.488; 90; 93.742; 90;  

COD ID: 4515530
CIF file Formula: - C28 H18 Co F9 K N6 O3 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/c 1
Cell volume: 3126.4
Cell parameters: 10.696; 18.855; 15.813; 90; 101.378; 90;  

COD ID: 4515531
CIF file Formula: - C86 H118 K2 Mn2 N8 O17 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: C 1 2/c 1
Cell volume: 9009.8
Cell parameters: 18.8633; 21.7465; 22.5199; 90; 102.759; 90;  

COD ID: 4515532
CIF file Formula: - C36 H39 F9 K N7 Ni O6 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/n 1
Cell volume: 4274
Cell parameters: 9.133; 29.15; 16.125; 90; 95.392; 90;  

COD ID: 4515533
CIF file Formula: - C28 H18 F9 K Mn N6 O3 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P 1 21/c 1
Cell volume: 3097
Cell parameters: 10.661; 18.766; 15.752; 90; 100.699; 90;  

COD ID: 4515534
CIF file Formula: - C78 H105 K2 Mn2 N11 O9 -
Comments: Bagchi, Vivek; Kalra, Anshika; Das, Purak; Paraskevopoulou, Patrina; Gorla, Saidulu; Ai, Lin; Wang, Qiuwen; Mohapatra, Sudip; Choudhury, Amitava; Sun, Zhicheng; Cundari, Thomas R.; Stavropoulos, Pericles Comparative Nitrene-Transfer Chemistry to Olefinic Substrates Mediated by a Library of Anionic Mn(II) Triphenylamido-Amine Reagents and M(II) Congeners (M = Fe, Co, Ni) Favoring Aromatic over Aliphatic Alkenes ACS Catalysis 8(10) (2018) 9183
Space group: P -1
Cell volume: 3977
Cell parameters: 11.759; 13.541; 26.426; 86.003; 80.023; 73.719;  

COD ID: 4515535
CIF file Formula: - C15 H13 N O2 -
Comments: Liu, Chengwei; Li, Guangchen; Shi, Shicheng; Meng, Guangrong; Lalancette, Roger; Szostak, Roman; Szostak, Michal Acyl and Decarbonylative Suzuki Coupling of N-Acetyl Amides: Electronic Tuning of Twisted, Acyclic Amides in Catalytic Carbon‒Nitrogen Bond Cleavage ACS Catalysis 8(10) (2018) 9131
Space group: P 1 21/c 1
Cell volume: 1244.08
Cell parameters: 5.8829; 8.228; 25.846; 90; 96.056; 90;  

COD ID: 4515536
CIF file Formula: - C30 H27 N2 O4 P -
Comments: Meyer, Tjark H.; Oliveira, João C. A.; Sau, Samaresh Chandra; Ang, Nate W. J.; Ackermann, Lutz Electrooxidative Allene Annulations by Mild Cobalt-Catalyzed C‒H Activation ACS Catalysis 8(10) (2018) 9140
Space group: P 1 21/c 1
Cell volume: 2492.5
Cell parameters: 12.148; 10.6001; 19.4764; 90; 96.366; 90;  

COD ID: 4515537
CIF file Formula: - C25 H20 Cl N O2 -
Comments: Dong, Kuiyong; Pei, Chao; Zeng, Qian; Wei, Hanlin; Doyle, Michael P.; Xu, Xinfang Selective C(sp3)‒H Bond Insertion in Carbene/Alkyne Metathesis Reactions. Enantioselective Construction of Dihydroindoles ACS Catalysis 8(10) (2018) 9543
Space group: P 21 21 21
Cell volume: 2023.43
Cell parameters: 6.1285; 10.8042; 30.5592; 90; 90; 90;  

COD ID: 4515538
CIF file Formula: - C25 H20 Br N O2 -
Comments: Dong, Kuiyong; Pei, Chao; Zeng, Qian; Wei, Hanlin; Doyle, Michael P.; Xu, Xinfang Selective C(sp3)‒H Bond Insertion in Carbene/Alkyne Metathesis Reactions. Enantioselective Construction of Dihydroindoles ACS Catalysis 8(10) (2018) 9543
Space group: P 1 21 1
Cell volume: 1016.23
Cell parameters: 13.288; 5.6; 14.983; 90; 114.29; 90;  

COD ID: 4515539
CIF file Formula: - C88 H44 Mo0.96 O32 S1.92 Zr6 -
Comments: Noh, Hyunho; Kung, Chung-Wei; Otake, Ken-ichi; Peters, Aaron W.; Li, Zhanyong; Liao, Yijun; Gong, Xinyi; Farha, Omar K.; Hupp, Joseph T. Redox-Mediator-Assisted Electrocatalytic Hydrogen Evolution from Water by a Molybdenum Sulfide-Functionalized Metal‒Organic Framework ACS Catalysis 8(10) (2018) 9848
Space group: P 6/m m m
Cell volume: 22074
Cell parameters: 39.254; 39.254; 16.542; 90; 90; 120;  

COD ID: 4515540
CIF file Formula: - C88 H44 Mo2.24 O36.88 Zr6 -
Comments: Noh, Hyunho; Kung, Chung-Wei; Otake, Ken-ichi; Peters, Aaron W.; Li, Zhanyong; Liao, Yijun; Gong, Xinyi; Farha, Omar K.; Hupp, Joseph T. Redox-Mediator-Assisted Electrocatalytic Hydrogen Evolution from Water by a Molybdenum Sulfide-Functionalized Metal‒Organic Framework ACS Catalysis 8(10) (2018) 9848
Space group: P 6/m m m
Cell volume: 22115.1
Cell parameters: 39.4657; 39.4657; 16.3953; 90; 90; 120;  

COD ID: 4515541
CIF file Formula: - C28 H26 N4 O7 -
Comments: Wang, Jilan; Li, Yongjia; Sun, Jun; Wang, Hongling; Jin, Zhichao; Chi, Yonggui Robin Carbene-Catalyzed Enantioselective Addition of Benzylic Carbon to Unsaturated Acyl Azolium for Rapid Synthesis of Pyrrolo[3,2-c]quinolines ACS Catalysis 8(10) (2018) 9859
Space group: P 21 21 21
Cell volume: 2559.23
Cell parameters: 9.0462; 11.8256; 23.9232; 90; 90; 90;  

COD ID: 4515542
CIF file Formula: - C14 H21 Ge N O3 -
Comments: Song, Hai-Jie; Jiang, Wei-Tao; Zhou, Qiao-Lan; Xu, Meng-Yu; Xiao, Bin Structure-Modified Germatranes for Pd-Catalyzed Biaryl Synthesis ACS Catalysis 8(10) (2018) 9287
Space group: P b c a
Cell volume: 2905.81
Cell parameters: 13.7717; 11.1518; 18.9206; 90; 90; 90;  

COD ID: 4515543
CIF file Formula: - C14 H20 Cl Ge N O3 -
Comments: Song, Hai-Jie; Jiang, Wei-Tao; Zhou, Qiao-Lan; Xu, Meng-Yu; Xiao, Bin Structure-Modified Germatranes for Pd-Catalyzed Biaryl Synthesis ACS Catalysis 8(10) (2018) 9287
Space group: P 1 21/n 1
Cell volume: 3245.18
Cell parameters: 14.8342; 13.3798; 16.4653; 90; 96.777; 90;  

COD ID: 4515544
CIF file Formula: - C54 H60 N2 -
Comments: Noto, Naoki; Tanaka, Yuya; Koike, Takashi; Akita, Munetaka Strongly Reducing (Diarylamino)anthracene Catalyst for Metal-Free Visible-Light Photocatalytic Fluoroalkylation ACS Catalysis 8(10) (2018) 9408
Space group: P -1
Cell volume: 1073.8
Cell parameters: 8.3369; 9.3962; 14.592; 100.111; 103.43; 98.334;  

COD ID: 4515545
CIF file Formula: - C12 H14 F3 N O -
Comments: Noto, Naoki; Tanaka, Yuya; Koike, Takashi; Akita, Munetaka Strongly Reducing (Diarylamino)anthracene Catalyst for Metal-Free Visible-Light Photocatalytic Fluoroalkylation ACS Catalysis 8(10) (2018) 9408
Space group: P c a 21
Cell volume: 1225.7
Cell parameters: 8.8458; 14.526; 9.5388; 90; 90; 90;  

COD ID: 4515546
CIF file Formula: - C28 H23 N S -
Comments: Chen, Min-Hsien; Hsieh, Jen-Chieh; Lee, Yi-Hsien; Cheng, Chien-Hong Controlled Synthesis of Enantioselective 1-Aminoindenes via Cobalt-Catalyzed [3 + 2] Annulation Reaction ACS Catalysis 8(10) (2018) 9364
Space group: P 1
Cell volume: 1051.13
Cell parameters: 10.1611; 10.3192; 12.2146; 73.14; 71.609; 61.296;  

COD ID: 4515547
CIF file Formula: - C28 H23 N S -
Comments: Chen, Min-Hsien; Hsieh, Jen-Chieh; Lee, Yi-Hsien; Cheng, Chien-Hong Controlled Synthesis of Enantioselective 1-Aminoindenes via Cobalt-Catalyzed [3 + 2] Annulation Reaction ACS Catalysis 8(10) (2018) 9364
Space group: P 1
Cell volume: 1049.43
Cell parameters: 10.082; 10.316; 12.247; 73.57; 71.546; 61.603;  

COD ID: 4515548
CIF file Formula: - C15 H14 N2 O3 -
Comments: Jadhav, Prakash D.; Lu, Xin; Liu, Rai-Shung Gold-Catalyzed [5+2]- and [5+1]-Annulations between Ynamides and 1,2-Benzisoxazoles with Ligand-Controlled Chemoselectivity ACS Catalysis 8(10) (2018) 9697
Space group: P 1 21/c 1
Cell volume: 1298.2
Cell parameters: 8.085; 16.9819; 10.0705; 90; 110.13; 90;  

COD ID: 4515549
CIF file Formula: - C23 H19 Cl N2 O3 S -
Comments: Jadhav, Prakash D.; Lu, Xin; Liu, Rai-Shung Gold-Catalyzed [5+2]- and [5+1]-Annulations between Ynamides and 1,2-Benzisoxazoles with Ligand-Controlled Chemoselectivity ACS Catalysis 8(10) (2018) 9697
Space group: P 1 21/c 1
Cell volume: 2043.6
Cell parameters: 7.0746; 19.195; 15.3264; 90; 100.918; 90;  

COD ID: 4515550
CIF file Formula: - C27 H22 N2 O3 S -
Comments: Jadhav, Prakash D.; Lu, Xin; Liu, Rai-Shung Gold-Catalyzed [5+2]- and [5+1]-Annulations between Ynamides and 1,2-Benzisoxazoles with Ligand-Controlled Chemoselectivity ACS Catalysis 8(10) (2018) 9697
Space group: P n a 21
Cell volume: 2288.3
Cell parameters: 33.95; 8.4972; 7.9321; 90; 90; 90;  

COD ID: 4515551
CIF file Formula: - C26 H24 N2 O5 S -
Comments: Jadhav, Prakash D.; Lu, Xin; Liu, Rai-Shung Gold-Catalyzed [5+2]- and [5+1]-Annulations between Ynamides and 1,2-Benzisoxazoles with Ligand-Controlled Chemoselectivity ACS Catalysis 8(10) (2018) 9697
Space group: P 1 21/c 1
Cell volume: 2586.2
Cell parameters: 12.008; 7.0368; 30.631; 90; 92.288; 90;  

COD ID: 4515552
CIF file Formula: - C28 H28 N2 O3 S -
Comments: Jadhav, Prakash D.; Lu, Xin; Liu, Rai-Shung Gold-Catalyzed [5+2]- and [5+1]-Annulations between Ynamides and 1,2-Benzisoxazoles with Ligand-Controlled Chemoselectivity ACS Catalysis 8(10) (2018) 9697
Space group: C 1 2/c 1
Cell volume: 4732.4
Cell parameters: 33.457; 7.1395; 20.377; 90; 103.524; 90;  

COD ID: 4515553
CIF file Formula: - C24 H22 Cl N3 O2 -
Comments: Liu, Bingxian; Li, Jie; Hu, Panjie; Zhou, Xukai; Bai, Dachang; Li, Xingwei Divergent Annulative C‒C Coupling of Indoles Initiated by Manganese-Catalyzed C‒H Activation ACS Catalysis 8(10) (2018) 9463
Space group: P -1
Cell volume: 1045.71
Cell parameters: 9.5004; 11.278; 11.5979; 104.256; 109.363; 106.026;  

COD ID: 4515554
CIF file Formula: - C23 H25 N O2 -
Comments: Huang, Liang-Zhu; Xuan, Zi; Jeon, Hyun Ji; Du, Zhen-Ting; Kim, Ju Hyun; Lee, Sang-gi Asymmetric Rh(II)/Pd(0) Relay Catalysis: Synthesis of α-Quaternary Chiral β-Lactams through Enantioselective C‒H Insertion/Diastereoselective Allylation of Diazoamides ACS Catalysis 8(8) (2018) 7340
Space group: P 1 21 1
Cell volume: 967.17
Cell parameters: 9.356; 10.7541; 9.6715; 90; 96.3296; 90;  

COD ID: 4515555
CIF file Formula: - C11 H17 B Cl N O -
Comments: Yang, Ji-Min; Zhao, Yu-Tao; Li, Zi-Qi; Gu, Xue-Song; Zhu, Shou-Fei; Zhou, Qi-Lin Gold-Catalyzed Oxidative Coupling of Terminal Alkynes and Borane Adducts: Efficient Synthesis of α-Boryl Ketones ACS Catalysis 8(8) (2018) 7351
Space group: P n a 21
Cell volume: 1216.4
Cell parameters: 19.738; 5.4134; 11.384; 90; 90; 90;  

COD ID: 4515556
CIF file Formula: - C62 H42 O6 Ru2 -
Comments: Gusev, Dmitry G.; Spasyuk, Denis M. Revised Mechanisms for Aldehyde Disproportionation and the Related Reactions of the Shvo Catalyst ACS Catalysis 8(8) (2018) 6851
Space group: P -1
Cell volume: 4720.16
Cell parameters: 12.7987; 15.0974; 25.8586; 104.39; 95.12; 100;  

COD ID: 4515557
CIF file Formula: - C31 H22 O3 Ru -
Comments: Gusev, Dmitry G.; Spasyuk, Denis M. Revised Mechanisms for Aldehyde Disproportionation and the Related Reactions of the Shvo Catalyst ACS Catalysis 8(8) (2018) 6851
Space group: P 1 21/n 1
Cell volume: 2426.02
Cell parameters: 15.7952; 7.4857; 20.8655; 90; 100.47; 90;  

COD ID: 4515558
CIF file Formula: - C57 H75 Cl3 Fe3 N6 -
Comments: Ferreira, Ricardo B.; Cook, Brian J.; Knight, Brian J.; Catalano, Vincent J.; García-Serres, Ricardo; Murray, Leslie J. Catalytic Silylation of Dinitrogen by a Family of Triiron Complexes. ACS catalysis 8(8) (2018) 7208-7212
Space group: P -1
Cell volume: 2649.46
Cell parameters: 12.6922; 13.0313; 16.647; 76.0639; 84.1498; 84.0536;  

COD ID: 4515559
CIF file Formula: - C21 H18 Mn N5 O4 -
Comments: Liu, Tingting; Wang, Liandi; Wu, Kaikai; Yu, Zhengkun Manganese-Catalyzed β-Alkylation of Secondary Alcohols with Primary Alcohols under Phosphine-Free Conditions ACS Catalysis 8(8) (2018) 7201
Space group: P 1 21/c 1
Cell volume: 2167.87
Cell parameters: 13.4325; 11.7346; 13.7646; 90; 92.32; 90;  

COD ID: 4515560
CIF file Formula: - C21 H26 N2 O -
Comments: Fernández, David F.; Rodrigues, Catarina A. B.; Calvelo, Martín; Gulías, Moisés; Mascareñas, José L.; López, Fernando Iridium(I)-Catalyzed Intramolecular Cycloisomerization of Enynes: Scope and Mechanistic Course ACS Catalysis 8(8) (2018) 7397
Space group: P 1 21/c 1
Cell volume: 1751.66
Cell parameters: 17.2156; 7.3295; 13.8834; 90; 90.807; 90;  

COD ID: 4515561
CIF file Formula: - C22 H23 N O2 -
Comments: Fernández, David F.; Rodrigues, Catarina A. B.; Calvelo, Martín; Gulías, Moisés; Mascareñas, José L.; López, Fernando Iridium(I)-Catalyzed Intramolecular Cycloisomerization of Enynes: Scope and Mechanistic Course ACS Catalysis 8(8) (2018) 7397
Space group: P 1 21/c 1
Cell volume: 1801.6
Cell parameters: 12.2561; 9.8925; 15.8384; 90; 110.254; 90;  

COD ID: 4515562
CIF file Formula: - C37 H46 Cu N3 -
Comments: Nakamura, Kimiaki; Hara, Reina; Sunada, Yusuke; Nishikata, Takashi Radical-Organometallic Hybrid Reaction System Enabling Couplings between Tertiary-Alkyl Groups and 1-Alkenyl Groups ACS Catalysis 8(8) (2018) 6791
Space group: P 1 21/n 1
Cell volume: 3379.7
Cell parameters: 12.411; 12.765; 21.416; 90; 95.043; 90;  

COD ID: 4515563
CIF file Formula: - C26 H24 Cu N4 O7 S2 -
Comments: Hardouin Duparc, Valérie; Bano, Guillaume L.; Schaper, Frank Chan‒Evans‒Lam Couplings with Copper Iminoarylsulfonate Complexes: Scope and Mechanism ACS Catalysis 8(8) (2018) 7308
Space group: P b c a
Cell volume: 5140.96
Cell parameters: 17.7588; 13.939; 20.7682; 90; 90; 90;  

COD ID: 4515564
CIF file Formula: - C14 H13 Cu F3 N2 O7 S2 -
Comments: Hardouin Duparc, Valérie; Bano, Guillaume L.; Schaper, Frank Chan‒Evans‒Lam Couplings with Copper Iminoarylsulfonate Complexes: Scope and Mechanism ACS Catalysis 8(8) (2018) 7308
Space group: P -1
Cell volume: 892.77
Cell parameters: 7.9814; 11.0894; 11.102; 96.461; 100.176; 110.007;  

COD ID: 4515565
CIF file Formula: - C14 H14 O3 -
Comments: Teng, Shenghan; Tessensohn, Malcolm E.; Webster, Richard D.; Zhou, Jianrong Steve Palladium-Catalyzed Intermolecular Heck-Type Reaction of Epoxides ACS Catalysis 8(8) (2018) 7439
Space group: P c a 21
Cell volume: 1096.2
Cell parameters: 11.7373; 4.431; 21.078; 90; 90; 90;  

COD ID: 4515566
CIF file Formula: - C14 H14 O3 -
Comments: Teng, Shenghan; Tessensohn, Malcolm E.; Webster, Richard D.; Zhou, Jianrong Steve Palladium-Catalyzed Intermolecular Heck-Type Reaction of Epoxides ACS Catalysis 8(8) (2018) 7439
Space group: P c c n
Cell volume: 2185.2
Cell parameters: 6.6399; 17.0733; 19.2759; 90; 90; 90;  

COD ID: 4515567
CIF file Formula: - C15 H18 O2 -
Comments: Teng, Shenghan; Tessensohn, Malcolm E.; Webster, Richard D.; Zhou, Jianrong Steve Palladium-Catalyzed Intermolecular Heck-Type Reaction of Epoxides ACS Catalysis 8(8) (2018) 7439
Space group: P 1 21/c 1
Cell volume: 1224.62
Cell parameters: 14.435; 5.4011; 16.2501; 90; 104.851; 90;  

COD ID: 4515568
CIF file Formula: - C15 H20 O2 -
Comments: Teng, Shenghan; Tessensohn, Malcolm E.; Webster, Richard D.; Zhou, Jianrong Steve Palladium-Catalyzed Intermolecular Heck-Type Reaction of Epoxides ACS Catalysis 8(8) (2018) 7439
Space group: P 1 21 1
Cell volume: 634.72
Cell parameters: 9.1834; 5.2643; 13.7823; 90; 107.711; 90;  

COD ID: 4515569
CIF file Formula: - C42 H70 Ce N7 O8 -
Comments: Shirase, Satoru; Shinohara, Koichi; Tsurugi, Hayato; Mashima, Kazushi Oxidation of Alcohols to Carbonyl Compounds Catalyzed by Oxo-Bridged Dinuclear Cerium Complexes with Pentadentate Schiff-Base Ligands under a Dioxygen Atmosphere ACS Catalysis 8(8) (2018) 6939
Space group: P -1
Cell volume: 2381.4
Cell parameters: 10.5305; 11.181; 20.761; 101.915; 91.944; 94.462;  

COD ID: 4515570
CIF file Formula: - C32 H51 Ce N6 O8 -
Comments: Shirase, Satoru; Shinohara, Koichi; Tsurugi, Hayato; Mashima, Kazushi Oxidation of Alcohols to Carbonyl Compounds Catalyzed by Oxo-Bridged Dinuclear Cerium Complexes with Pentadentate Schiff-Base Ligands under a Dioxygen Atmosphere ACS Catalysis 8(8) (2018) 6939
Space group: P -1
Cell volume: 3639.9
Cell parameters: 11.5006; 17.4646; 20.0865; 67.599; 80.635; 78.648;  

COD ID: 4515571
CIF file Formula: - C49 H66 Ce2 N11 O17 -
Comments: Shirase, Satoru; Shinohara, Koichi; Tsurugi, Hayato; Mashima, Kazushi Oxidation of Alcohols to Carbonyl Compounds Catalyzed by Oxo-Bridged Dinuclear Cerium Complexes with Pentadentate Schiff-Base Ligands under a Dioxygen Atmosphere ACS Catalysis 8(8) (2018) 6939
Space group: C 1 2/c 1
Cell volume: 5547.4
Cell parameters: 22.935; 19.6202; 13.5095; 90; 114.142; 90;  

COD ID: 4515572
CIF file Formula: - C124 H174 Ce4 N21 O32 -
Comments: Shirase, Satoru; Shinohara, Koichi; Tsurugi, Hayato; Mashima, Kazushi Oxidation of Alcohols to Carbonyl Compounds Catalyzed by Oxo-Bridged Dinuclear Cerium Complexes with Pentadentate Schiff-Base Ligands under a Dioxygen Atmosphere ACS Catalysis 8(8) (2018) 6939
Space group: C 1 2/c 1
Cell volume: 7064
Cell parameters: 15.263; 27.226; 17.096; 90; 96.089; 90;  

COD ID: 4515573
CIF file Formula: - C68 H102 Ce2 N8 O11 -
Comments: Shirase, Satoru; Shinohara, Koichi; Tsurugi, Hayato; Mashima, Kazushi Oxidation of Alcohols to Carbonyl Compounds Catalyzed by Oxo-Bridged Dinuclear Cerium Complexes with Pentadentate Schiff-Base Ligands under a Dioxygen Atmosphere ACS Catalysis 8(8) (2018) 6939
Space group: C 1 2/c 1
Cell volume: 7129.7
Cell parameters: 27.711; 19.4594; 15.5984; 90; 122.044; 90;  

COD ID: 4515574
CIF file Formula: - C34 H30 N2 O4 -
Comments: Usui, Kenji; Haines, Brandon E.; Musaev, Djamaladdin G.; Sarpong, Richmond Understanding Regiodivergence in a Pd(II)-Mediated Site-Selective C‒H Alkynylation ACS Catalysis 8(5) (2018) 4516
Space group: P 1 21/c 1
Cell volume: 2741.5
Cell parameters: 13.746; 11.435; 18.615; 90; 110.457; 90;  

COD ID: 4515575
CIF file Formula: - C25 H25 N3 O Pd -
Comments: Usui, Kenji; Haines, Brandon E.; Musaev, Djamaladdin G.; Sarpong, Richmond Understanding Regiodivergence in a Pd(II)-Mediated Site-Selective C‒H Alkynylation ACS Catalysis 8(5) (2018) 4516
Space group: P 1 21/n 1
Cell volume: 2113.72
Cell parameters: 12.551; 9.9456; 17.6307; 90; 106.171; 90;  

COD ID: 4515576
CIF file Formula: - C19 H17 Cl O -
Comments: Teng, Huai-Long; Ma, Yuanhong; Zhan, Gu; Nishiura, Masayoshi; Hou, Zhaomin Asymmetric C(sp)‒H Addition of Terminal Alkynes to Cyclopropenes by a Chiral Gadolinium Catalyst ACS Catalysis 8(5) (2018) 4705
Space group: P 21 21 21
Cell volume: 1565.1
Cell parameters: 5.612; 7.5305; 37.033; 90; 90; 90;  

COD ID: 4515577
CIF file Formula: - C21 H49 N O3 P2 Ru -
Comments: Nguyen, Duc Hanh; Trivelli, Xavier; Capet, Frédéric; Swesi, Youssef; Favre-Réguillon, Alain; Vanoye, Laurent; Dumeignil, Franck; Gauvin, Régis M. Deeper Mechanistic Insight into Ru Pincer-Mediated Acceptorless Dehydrogenative Coupling of Alcohols: Exchanges, Intermediates, and Deactivation Species ACS Catalysis 8(5) (2018) 4719
Space group: P 1 21/n 1
Cell volume: 2711.4
Cell parameters: 13.2573; 13.3386; 15.3535; 90; 92.948; 90;  

COD ID: 4515578
CIF file Formula: - C51 H125 N3 O10 P6 Ru3 -
Comments: Nguyen, Duc Hanh; Trivelli, Xavier; Capet, Frédéric; Swesi, Youssef; Favre-Réguillon, Alain; Vanoye, Laurent; Dumeignil, Franck; Gauvin, Régis M. Deeper Mechanistic Insight into Ru Pincer-Mediated Acceptorless Dehydrogenative Coupling of Alcohols: Exchanges, Intermediates, and Deactivation Species ACS Catalysis 8(5) (2018) 4719
Space group: P -1
Cell volume: 3496
Cell parameters: 15.1793; 16.5074; 16.664; 88.609; 71.881; 62.825;  

COD ID: 4515579
CIF file Formula: - C19 H41 N O3 P2 Ru -
Comments: Nguyen, Duc Hanh; Trivelli, Xavier; Capet, Frédéric; Swesi, Youssef; Favre-Réguillon, Alain; Vanoye, Laurent; Dumeignil, Franck; Gauvin, Régis M. Deeper Mechanistic Insight into Ru Pincer-Mediated Acceptorless Dehydrogenative Coupling of Alcohols: Exchanges, Intermediates, and Deactivation Species ACS Catalysis 8(5) (2018) 4719
Space group: P b c a
Cell volume: 4741.8
Cell parameters: 14.17; 15.3918; 21.741; 90; 90; 90;  

COD ID: 4515580
CIF file Formula: - C19 H35 Cl2 Mn N P2 -
Comments: Brzozowska, Aleksandra; Azofra, Luis Miguel; Zubar, Viktoriia; Atodiresei, Iuliana; Cavallo, Luigi; Rueping, Magnus; El-Sepelgy, Osama Highly Chemo- and Stereoselective Transfer Semihydrogenation of Alkynes Catalyzed by a Stable, Well-Defined Manganese(II) Complex ACS Catalysis 8(5) (2018) 4103
Space group: P 1 21/c 1
Cell volume: 2368.8
Cell parameters: 12.4393; 11.9755; 15.9077; 90; 91.637; 90;  

COD ID: 4515581
CIF file Formula: - C7 H9 Co O5 P -
Comments: Cai, Zhong-Sheng; Shi, Yi; Bao, Song-Song; Shen, Yang; Xia, Xing-Hua; Zheng, Li-Min Bioinspired Engineering of Cobalt-Phosphonate Nanosheets for Robust Hydrogen Evolution Reaction ACS Catalysis 8(5) (2018) 3895
Space group: P 1 21/n 1
Cell volume: 889.39
Cell parameters: 4.8553; 32.281; 5.6773; 90; 91.788; 90;  

COD ID: 4515582
CIF file Formula: - C25 H40 N3 O2 P2 Re -
Comments: Glatz, Mathias; Stöger, Berthold; Himmelbauer, Daniel; Veiros, Luis F.; Kirchner, Karl Chemoselective Hydrogenation of Aldehydes under Mild, Base-Free Conditions: Manganese Outperforms Rhenium. ACS catalysis 8(5) (2018) 4009-4016
Space group: P 21 21 21
Cell volume: 2889.7
Cell parameters: 10.1881; 13.7426; 20.6392; 90; 90; 90;  

COD ID: 4515583
CIF file Formula: - C72 H87 B N3 O2 Y -
Comments: Yu, Xiaying; You, Qing; Zhou, Xigeng; Zhang, Lixin Isoprene Regioblock Copolymerization: Switching the Regioselectivity by the in Situ Ancillary Ligand Transmetalation of Active Yttrium Species ACS Catalysis 8(5) (2018) 4465
Space group: P 1 21/n 1
Cell volume: 6964
Cell parameters: 12.047; 17.64; 32.956; 90; 96.116; 90;  

COD ID: 4515584
CIF file Formula: - C12 H6 In0.54 N O2.25 -
Comments: Leng, Fucheng; Liu, Hang; Ding, Meili; Lin, Qi-Pu; Jiang, Hai-Long Boosting Photocatalytic Hydrogen Production of Porphyrinic MOFs: The Metal Location in Metalloporphyrin Matters ACS Catalysis 8(5) (2018) 4583
Space group: C m m m
Cell volume: 3981.2
Cell parameters: 7.0996; 33.5115; 16.7335; 90; 90; 90;  

COD ID: 4515585
CIF file Formula: - C12 H6 In0.75 N O2.73 -
Comments: Leng, Fucheng; Liu, Hang; Ding, Meili; Lin, Qi-Pu; Jiang, Hai-Long Boosting Photocatalytic Hydrogen Production of Porphyrinic MOFs: The Metal Location in Metalloporphyrin Matters ACS Catalysis 8(5) (2018) 4583
Space group: C m m m
Cell volume: 3972.57
Cell parameters: 7.125; 33.622; 16.583; 90; 90; 90;  

COD ID: 4515586
CIF file Formula: - C48 H24 In2 N4 Ni O10 -
Comments: Leng, Fucheng; Liu, Hang; Ding, Meili; Lin, Qi-Pu; Jiang, Hai-Long Boosting Photocatalytic Hydrogen Production of Porphyrinic MOFs: The Metal Location in Metalloporphyrin Matters ACS Catalysis 8(5) (2018) 4583
Space group: C m m m
Cell volume: 3923.7
Cell parameters: 7.0725; 33.2883; 16.666; 90; 90; 90;  

COD ID: 4515587
CIF file Formula: - C26 H28 F6 Mn N4 O6 S2 -
Comments: Du, Junyi; Miao, Chengxia; Xia, Chungu; Lee, Yong-Min; Nam, Wonwoo; Sun, Wei Mechanistic Insights into the Enantioselective Epoxidation of Olefins by Bioinspired Manganese Complexes: Role of Carboxylic Acid and Nature of Active Oxidant ACS Catalysis 8(5) (2018) 4528
Space group: P 43
Cell volume: 12339.6
Cell parameters: 18.28107; 18.28107; 36.923; 90; 90; 90;  

COD ID: 4515588
CIF file Formula: - C28 H24 B F12 P -
Comments: Boudjelel, Maxime; Sosa Carrizo, E. Daiann; Mallet−Ladeira, Sonia; Massou, Stéphane; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier Catalytic Dehydrogenation of (Di)Amine-Boranes with a Geometrically Constrained Phosphine-Borane Lewis Pair ACS Catalysis 8(5) (2018) 4459
Space group: P -1
Cell volume: 2859.7
Cell parameters: 13.414; 13.786; 18.1493; 101.69; 106.173; 109.985;  

COD ID: 4515589
CIF file Formula: - C28 H26 B F12 P -
Comments: Boudjelel, Maxime; Sosa Carrizo, E. Daiann; Mallet−Ladeira, Sonia; Massou, Stéphane; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier Catalytic Dehydrogenation of (Di)Amine-Boranes with a Geometrically Constrained Phosphine-Borane Lewis Pair ACS Catalysis 8(5) (2018) 4459
Space group: P 1 21/n 1
Cell volume: 2935
Cell parameters: 10.6496; 15.3406; 18.042; 90; 95.278; 90;  

COD ID: 4515590
CIF file Formula: - C28 H27 B2 F12 P -
Comments: Boudjelel, Maxime; Sosa Carrizo, E. Daiann; Mallet−Ladeira, Sonia; Massou, Stéphane; Miqueu, Karinne; Bouhadir, Ghenwa; Bourissou, Didier Catalytic Dehydrogenation of (Di)Amine-Boranes with a Geometrically Constrained Phosphine-Borane Lewis Pair ACS Catalysis 8(5) (2018) 4459
Space group: P -1
Cell volume: 1499.65
Cell parameters: 11.7104; 12.4425; 12.4488; 71.092; 69.578; 64.329;  

COD ID: 4515591
CIF file Formula: - C72 H94 Co2 N6 -
Comments: Lepori, Clément; Gómez-Orellana, Pablo; Ouharzoune, Allissa; Guillot, Régis; Lledós, Agusti; Ujaque, Gregori; Hannedouche, Jérôme Well-Defined β-Diketiminatocobalt(II) Complexes for Alkene Cyclohydroamination of Primary Amines ACS Catalysis 8(5) (2018) 4446
Space group: P 1 21/n 1
Cell volume: 3140.42
Cell parameters: 11.1904; 12.5885; 22.6178; 90; 99.722; 90;  

COD ID: 4515592
CIF file Formula: - C31 H48 Co N2 O Si -
Comments: Lepori, Clément; Gómez-Orellana, Pablo; Ouharzoune, Allissa; Guillot, Régis; Lledós, Agusti; Ujaque, Gregori; Hannedouche, Jérôme Well-Defined β-Diketiminatocobalt(II) Complexes for Alkene Cyclohydroamination of Primary Amines ACS Catalysis 8(5) (2018) 4446
Space group: P 1 21/n 1
Cell volume: 3110.83
Cell parameters: 17.0369; 10.7343; 17.0418; 90; 93.483; 90;  

COD ID: 4515593
CIF file Formula: - C31 H45 Cl2 Co Li N2 O2 -
Comments: Lepori, Clément; Gómez-Orellana, Pablo; Ouharzoune, Allissa; Guillot, Régis; Lledós, Agusti; Ujaque, Gregori; Hannedouche, Jérôme Well-Defined β-Diketiminatocobalt(II) Complexes for Alkene Cyclohydroamination of Primary Amines ACS Catalysis 8(5) (2018) 4446
Space group: P 41 21 2
Cell volume: 3178.53
Cell parameters: 12.0633; 12.0633; 21.8421; 90; 90; 90;  

COD ID: 4515594
CIF file Formula: - C39 H49 N3 O Si Zn -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: P 1 21/n 1
Cell volume: 3622.7
Cell parameters: 8.8505; 21.914; 19.0059; 90; 100.646; 90;  

COD ID: 4515595
CIF file Formula: - C22.5 H38.5 N3 Zn -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: P 1 21/c 1
Cell volume: 4770.9
Cell parameters: 14.8856; 21.731; 16.0804; 90; 113.482; 90;  

COD ID: 4515596
CIF file Formula: - C22 H35 N3 O2 Zn -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: P 1 21/c 1
Cell volume: 4611
Cell parameters: 23.041; 10.016; 22.532; 90; 117.531; 90;  

COD ID: 4515597
CIF file Formula: - C50 H86 N6 Zn2 -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: C 1 2/c 1
Cell volume: 6129.4
Cell parameters: 21.7365; 14.2049; 20.3579; 90; 102.81; 90;  

COD ID: 4515598
CIF file Formula: - C55 H93 N6 O4 Zn2 -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: P -1
Cell volume: 2896.9
Cell parameters: 12.7688; 13.881; 17.4955; 76.808; 73.779; 84.324;  

COD ID: 4515599
CIF file Formula: - C51 H86 N6 O2 Zn2 -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: P -1
Cell volume: 5362.53
Cell parameters: 16.1366; 16.5978; 23.3164; 98.9; 90.984; 119.052;  

COD ID: 4515600
CIF file Formula: - C60 H84 N4 O4 Zn2 -
Comments: Feng, Guoqin; Du, Chongyang; Xiang, Li; del Rosal, Iker; Li, Guangyu; Leng, Xuebing; Chen, Eugene Y.-X.; Maron, Laurent; Chen, Yaofeng Side Arm Twist on Zn-Catalyzed Hydrosilylative Reduction of CO2 to Formate and Methanol Equivalents with High Selectivity and Activity ACS Catalysis 8(5) (2018) 4710
Space group: P -1
Cell volume: 2900.6
Cell parameters: 13.4707; 14.5272; 16.2991; 88.145; 89.86; 65.496;  

COD ID: 4515601
CIF file Formula: - C10 H12 Fe N11 O -
Comments: Shen, Shou-Jie; Zhu, Cheng-Liang; Lu, Deng-Fu; Xu, Hao Iron-Catalyzed Direct Olefin Diazidation via Peroxyester Activation Promoted by Nitrogen-Based Ligands. ACS catalysis 8(5) (2018) 4473-4482
Space group: P 1 21/n 1
Cell volume: 1533
Cell parameters: 10.82; 12.675; 11.662; 90; 106.559; 90;  

COD ID: 4515602
CIF file Formula: - C44 H54 N4 Ni -
Comments: Rull, Silvia G.; Funes-Ardoiz, Ignacio; Maya, Celia; Maseras, Feliu; Fructos, Manuel R.; Belderrain, Tomás R.; Nicasio, M. Carmen Elucidating the Mechanism of Aryl Aminations Mediated by NHC-Supported Nickel Complexes: Evidence for a Nonradical Ni(0)/Ni(II) Pathway ACS Catalysis 8(5) (2018) 3733
Space group: P 21 21 21
Cell volume: 7666.3
Cell parameters: 10.1006; 18.0014; 42.163; 90; 90; 90;  

COD ID: 4515603
CIF file Formula: - C110 H136 Cl3 N9 Ni3 -
Comments: Rull, Silvia G.; Funes-Ardoiz, Ignacio; Maya, Celia; Maseras, Feliu; Fructos, Manuel R.; Belderrain, Tomás R.; Nicasio, M. Carmen Elucidating the Mechanism of Aryl Aminations Mediated by NHC-Supported Nickel Complexes: Evidence for a Nonradical Ni(0)/Ni(II) Pathway ACS Catalysis 8(5) (2018) 3733
Space group: P 1 21/c 1
Cell volume: 10027.7
Cell parameters: 26.6781; 16.5463; 22.7174; 90; 90.462; 90;  

COD ID: 4515604
CIF file Formula: - C64 H80 Cl2 N6 Ni2 -
Comments: Rull, Silvia G.; Funes-Ardoiz, Ignacio; Maya, Celia; Maseras, Feliu; Fructos, Manuel R.; Belderrain, Tomás R.; Nicasio, M. Carmen Elucidating the Mechanism of Aryl Aminations Mediated by NHC-Supported Nickel Complexes: Evidence for a Nonradical Ni(0)/Ni(II) Pathway ACS Catalysis 8(5) (2018) 3733
Space group: P 21 21 21
Cell volume: 6617
Cell parameters: 12.855; 21.217; 24.26; 90; 90; 90;  

COD ID: 4515605
CIF file Formula: - C43 H56 Cl N3 Ni -
Comments: Rull, Silvia G.; Funes-Ardoiz, Ignacio; Maya, Celia; Maseras, Feliu; Fructos, Manuel R.; Belderrain, Tomás R.; Nicasio, M. Carmen Elucidating the Mechanism of Aryl Aminations Mediated by NHC-Supported Nickel Complexes: Evidence for a Nonradical Ni(0)/Ni(II) Pathway ACS Catalysis 8(5) (2018) 3733
Space group: C 1 2/c 1
Cell volume: 8404.1
Cell parameters: 27.4949; 19.0191; 16.9558; 90; 108.589; 90;  

COD ID: 4515606
CIF file Formula: - C22 H37 Ir N P -
Comments: Cherepakhin, Valeriy; Williams, Travis J. Iridium Catalysts for Acceptorless Dehydrogenation of Alcohols to Carboxylic Acids: Scope and Mechanism. ACS catalysis 8(5) (2018) 3754-3763
Space group: P 21 21 21
Cell volume: 2100.6
Cell parameters: 10.5276; 10.7464; 18.567; 90; 90; 90;  

COD ID: 4515607
CIF file Formula: - C29 H48 Ir2 N2 O P2 -
Comments: Cherepakhin, Valeriy; Williams, Travis J. Iridium Catalysts for Acceptorless Dehydrogenation of Alcohols to Carboxylic Acids: Scope and Mechanism. ACS catalysis 8(5) (2018) 3754-3763
Space group: P 1 21/c 1
Cell volume: 3220.5
Cell parameters: 14.836; 15.464; 15.385; 90; 114.159; 90;  

COD ID: 4515608
CIF file Formula: - C34 H26 F6 N6 O9 P Ru2 -
Comments: Daniel, Quentin; Duan, Lele; Timmer, Brian J. J.; Chen, Hong; Luo, Xiaodan; Ambre, Ram; Wang, Ying; Zhang, Biaobiao; Zhang, Peili; Wang, Lei; Li, Fusheng; Sun, Junliang; Ahlquist, Mårten; Sun, Licheng Water Oxidation Initiated by In Situ Dimerization of the Molecular Ru(pdc) Catalyst ACS Catalysis 8(5) (2018) 4375
Space group: P 1 21/c 1
Cell volume: 3765.8
Cell parameters: 13.8587; 23.8714; 12.5805; 90; 115.201; 90;  

COD ID: 4515609
CIF file Formula: - C21 H23 Br N O -
Comments: Bai, Dachang; Xu, Teng; Ma, Chaorui; Zheng, Xin; Liu, Bingxian; Xie, Fang; Li, Xingwei Rh(III)-Catalyzed Mild Coupling of Nitrones and Azomethine Imines with Alkylidenecyclopropanes via C‒H Activation: Facile Access to Bridged Cycles ACS Catalysis 8(5) (2018) 4194
Space group: P -1
Cell volume: 909.36
Cell parameters: 8.6881; 9.8467; 11.0731; 94.586; 91.58; 105.361;  

COD ID: 4515610
CIF file Formula: - C8 H7 Cl O3 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P n a 21
Cell volume: 813.68
Cell parameters: 14.4042; 3.8522; 14.6641; 90; 90; 90;  

COD ID: 4515611
CIF file Formula: - C25 H25 Cl O4 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21 1
Cell volume: 1060.25
Cell parameters: 10.936; 6.5014; 14.9916; 90; 95.8987; 90;  

COD ID: 4515612
CIF file Formula: - C6 H3 Br Cl I O -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21 1
Cell volume: 431.77
Cell parameters: 7.2559; 4.5474; 13.321; 90; 100.781; 90;  

COD ID: 4515613
CIF file Formula: - C12 H8 Cl2 O2 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P b c n
Cell volume: 2172.17
Cell parameters: 6.3191; 15.8114; 21.7404; 90; 90; 90;  

COD ID: 4515614
CIF file Formula: - C8 H7 Cl O2 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21/c 1
Cell volume: 769.25
Cell parameters: 6.7838; 16.4432; 7.2539; 90; 108.069; 90;  

COD ID: 4515615
CIF file Formula: - C25 H21 Cl O3 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: C 1 2/c 1
Cell volume: 4220.76
Cell parameters: 13.6694; 14.6546; 21.7416; 90; 104.277; 90;  

COD ID: 4515616
CIF file Formula: - C8 H6 Br Cl O3 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21/c 1
Cell volume: 913.66
Cell parameters: 4.1058; 17.9301; 12.4296; 90; 93.138; 90;  

COD ID: 4515617
CIF file Formula: - C12 H8 F2 O Se -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P -1
Cell volume: 531.61
Cell parameters: 5.6425; 9.1159; 11.1839; 106.666; 102.943; 93.95;  

COD ID: 4515618
CIF file Formula: - C7 H4 Br Cl O2 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21/n 1
Cell volume: 1549.54
Cell parameters: 7.7896; 13.5178; 15.0171; 90; 101.499; 90;  

COD ID: 4515619
CIF file Formula: - C19 H17 Cl O3 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21 1
Cell volume: 812.26
Cell parameters: 9.6791; 7.1917; 12.2628; 90; 107.906; 90;  

COD ID: 4515620
CIF file Formula: - C12 H9 Cl O -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 1 21/n 1
Cell volume: 969.61
Cell parameters: 5.7829; 20.3532; 8.3091; 90; 97.502; 90;  

COD ID: 4515621
CIF file Formula: - C12 H16 B Cl O3 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: I -4
Cell volume: 2663.2
Cell parameters: 19.7094; 19.7094; 6.8557; 90; 90; 90;  

COD ID: 4515622
CIF file Formula: - C6 H4 Br Cl O -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: P 21 21 21
Cell volume: 685.9
Cell parameters: 5.2204; 11.214; 11.717; 90; 90; 90;  

COD ID: 4515623
CIF file Formula: - C12 H10 Br2 Cl2 O4 -
Comments: Xiong, Xiaodong; Yeung, Ying-Yeung Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications ACS Catalysis 8(5) (2018) 4033
Space group: C 1 2/c 1
Cell volume: 2792.9
Cell parameters: 32.7811; 3.926; 21.7084; 90; 91.5018; 90;  

COD ID: 4515624
CIF file Formula: - C48 H38 B Cl2 F27 Fe N4 O3 S -
Comments: Postils, Verònica; Rodríguez, Mònica; Sabenya, Gerard; Conde, Ana; Díaz-Requejo, M. Mar; Pérez, Pedro J.; Costas, Miquel; Solà, Miquel; Luis, Josep M. Mechanism of the Selective Fe-Catalyzed Arene Carbon‒Hydrogen Bond Functionalization ACS Catalysis 8(5) (2018) 4313
Space group: P -1
Cell volume: 2812.8
Cell parameters: 12.695; 13.3351; 17.1823; 102.363; 97.011; 92.487;  

COD ID: 4515625
CIF file Formula: - C26 H36 O4 S -
Comments: Yu, Fei-Le; Bai, Da-Chang; Liu, Xiu-Yan; Jiang, Yang-Jie; Ding, Chang-Hua; Hou, Xue-Long Pd-Catalyzed Allylic Alkylation of gem-Alkyl,Aryl-Disubstituted Allyl Reagents with Ketones: Diastereoselective Construction of Vicinal Tertiary and Quaternary Carbon Centers ACS Catalysis 8(4) (2018) 3317
Space group: P 1 21 1
Cell volume: 1191.6
Cell parameters: 9.0489; 8.4426; 15.648; 90; 94.577; 90;  

COD ID: 4515626
CIF file Formula: - C16 H20 O -
Comments: Yu, Fei-Le; Bai, Da-Chang; Liu, Xiu-Yan; Jiang, Yang-Jie; Ding, Chang-Hua; Hou, Xue-Long Pd-Catalyzed Allylic Alkylation of gem-Alkyl,Aryl-Disubstituted Allyl Reagents with Ketones: Diastereoselective Construction of Vicinal Tertiary and Quaternary Carbon Centers ACS Catalysis 8(4) (2018) 3317
Space group: P 1 21/c 1
Cell volume: 1288
Cell parameters: 8.6633; 8.4114; 17.9313; 90; 99.6888; 90;  

COD ID: 4515627
CIF file Formula: - C21 H21 N3 O3 S -
Comments: Guin, Srimanta; Deb, Arghya; Dolui, Pravas; Chakraborty, Souvik; Singh, Vikas Kumar; Maiti, Debabrata Promoting Highly Diastereoselective γ-C‒H Chalcogenation of α-Amino Acids and Aliphatic Carboxylic Acids ACS Catalysis 8(4) (2018) 2664
Space group: P -1
Cell volume: 972.24
Cell parameters: 6.3615; 10.4427; 15.1313; 85.229; 87.86; 76.106;  

COD ID: 4515628
CIF file Formula: - C16 H20 O5 -
Comments: Biosca, Maria; Margalef, Jèssica; Caldentey, Xisco; Besora, Maria; Rodríguez-Escrich, Carles; Saltó, Joan; Cambeiro, Xacobe C.; Maseras, Feliu; Pàmies, Oscar; Diéguez, Montserrat; Pericàs, Miquel A. Computationally Guided Design of a Readily Assembled Phosphite‒Thioether Ligand for a Broad Range of Pd-Catalyzed Asymmetric Allylic Substitutions ACS Catalysis 8(4) (2018) 3587
Space group: P 21 21 21
Cell volume: 1425.8
Cell parameters: 8.793; 10.1042; 16.0484; 90; 90; 90;  

COD ID: 4515629
CIF file Formula: - C13 H15 B F3 K -
Comments: Gao, De-Wei; Xiao, Yiyang; Liu, Mingyu; Liu, Zhen; Karunananda, Malkanthi K.; Chen, Jason S.; Engle, Keary M. Catalytic, Enantioselective Synthesis of Allenyl Boronates. ACS catalysis 8(4) (2018) 3650-3654
Space group: P 1
Cell volume: 1412.38
Cell parameters: 9.0823; 10.0446; 16.7815; 72.627; 75.846; 89.976;  

COD ID: 4515630
CIF file Formula: - C14 H13 N O4 -
Comments: Brandenberg, Oliver F.; Prier, Christopher K.; Chen, Kai; Knight, Anders M.; Wu, Zachary; Arnold, Frances H. Stereoselective Enzymatic Synthesis of Heteroatom-Substituted Cyclopropanes ACS Catalysis 8(4) (2018) 2629
Space group: P 21 21 21
Cell volume: 1202.98
Cell parameters: 6.6275; 8.0167; 22.6419; 90; 90; 90;  

COD ID: 4515631
CIF file Formula: - C70 H110 Cl2 Co2 N4 P4 -
Comments: Suzuki, Tatsuya; Fujimoto, Keisuke; Takemoto, Yoshiyuki; Wasada-Tsutsui, Yuko; Ozawa, Tomohiro; Inomata, Tomohiko; Fryzuk, Michael D.; Masuda, Hideki Efficient Catalytic Conversion of Dinitrogen to N(SiMe3)3 Using a Homogeneous Mononuclear Cobalt Complex ACS Catalysis 8(4) (2018) 3011
Space group: P 1 21/n 1
Cell volume: 3507.6
Cell parameters: 10.4784; 22.1575; 15.6461; 90; 105.074; 90;  

COD ID: 4515632
CIF file Formula: - C70 H110 Co2 N4 P4 -
Comments: Suzuki, Tatsuya; Fujimoto, Keisuke; Takemoto, Yoshiyuki; Wasada-Tsutsui, Yuko; Ozawa, Tomohiro; Inomata, Tomohiko; Fryzuk, Michael D.; Masuda, Hideki Efficient Catalytic Conversion of Dinitrogen to N(SiMe3)3 Using a Homogeneous Mononuclear Cobalt Complex ACS Catalysis 8(4) (2018) 3011
Space group: P 1 21/c 1
Cell volume: 3510.5
Cell parameters: 10.7673; 29.054; 12.6363; 90; 117.372; 90;  

COD ID: 4515633
CIF file Formula: - C23 H34 N6 O3 S -
Comments: Nicholls, Rachel L.; McManus, James A.; Rayner, Christopher M.; Morales-Serna, José A.; White, Andrew J. P.; Nguyen, Bao N. Guanidine-Catalyzed Reductive Amination of Carbon Dioxide with Silanes: Switching between Pathways and Suppressing Catalyst Deactivation ACS Catalysis 8(4) (2018) 3678
Space group: P 1 21 1
Cell volume: 1276.03
Cell parameters: 9.2161; 12.7576; 10.9094; 90; 95.835; 90;  

COD ID: 4515634
CIF file Formula: - C23 H16 O2 -
Comments: Mondal, Atanu; Hazra, Raju; Grover, Jagdeep; Raghu, Moluguri; Ramasastry, S. S. V. Organophosphine-Catalyzed Intramolecular Hydroacylation of Activated Alkynes ACS Catalysis 8(4) (2018) 2748
Space group: C 1 2/c 1
Cell volume: 3290.9
Cell parameters: 15.5099; 7.5217; 28.568; 90; 99.09; 90;  

COD ID: 4515635
CIF file Formula: - C15 H22 Br N O -
Comments: Liu, Ze-Shui; Qian, Guangyin; Gao, Qianwen; Wang, Peng; Cheng, Hong-Gang; Wei, Qiang; Liu, Qi; Zhou, Qianghui Palladium/Norbornene Cooperative Catalysis To Access Tetrahydronaphthalenes and Indanes with a Quaternary Center ACS Catalysis 8(6) (2018) 4783
Space group: P 1 21 1
Cell volume: 1458.88
Cell parameters: 7.5964; 16.0907; 12.1098; 90; 99.736; 90;  

COD ID: 4515636
CIF file Formula: - C29 H30 O5 -
Comments: Liu, Ze-Shui; Qian, Guangyin; Gao, Qianwen; Wang, Peng; Cheng, Hong-Gang; Wei, Qiang; Liu, Qi; Zhou, Qianghui Palladium/Norbornene Cooperative Catalysis To Access Tetrahydronaphthalenes and Indanes with a Quaternary Center ACS Catalysis 8(6) (2018) 4783
Space group: P 1 21/n 1
Cell volume: 2487
Cell parameters: 10.573; 16.555; 14.695; 90; 104.784; 90;  

COD ID: 4515637
CIF file Formula: - C13 H17 N O5 S -
Comments: Kishi, Kenta; Takizawa, Shinobu; Sasai, Hiroaki Phosphine-Catalyzed Dual Umpolung Domino Michael Reaction: Facile Synthesis of Hydroindole- and Hydrobenzofuran-2-Carboxylates ACS Catalysis 8(6) (2018) 5228
Space group: P 1 21/n 1
Cell volume: 1422.7
Cell parameters: 5.923; 16.864; 14.255; 90; 92.357; 90;  

COD ID: 4515638
CIF file Formula: - C37 H47 Mo N3 O -
Comments: Joannou, Matthew V.; Bezdek, Máté J.; Chirik, Paul J. Pyridine(diimine) Molybdenum-Catalyzed Hydrogenation of Arenes and Hindered Olefins: Insights into Precatalyst Activation and Deactivation Pathways ACS Catalysis 8(6) (2018) 5276
Space group: P 1 21/n 1
Cell volume: 3280.8
Cell parameters: 15.8128; 13.0267; 16.0929; 90; 98.231; 90;  

COD ID: 4515639
CIF file Formula: - C47 H60 Mo N5 O -
Comments: Joannou, Matthew V.; Bezdek, Máté J.; Chirik, Paul J. Pyridine(diimine) Molybdenum-Catalyzed Hydrogenation of Arenes and Hindered Olefins: Insights into Precatalyst Activation and Deactivation Pathways ACS Catalysis 8(6) (2018) 5276
Space group: F d d 2
Cell volume: 19317.7
Cell parameters: 32.0833; 33.7453; 17.8428; 90; 90; 90;  

COD ID: 4515640
CIF file Formula: - C41 H65 Mo N3 Si2 -
Comments: Joannou, Matthew V.; Bezdek, Máté J.; Chirik, Paul J. Pyridine(diimine) Molybdenum-Catalyzed Hydrogenation of Arenes and Hindered Olefins: Insights into Precatalyst Activation and Deactivation Pathways ACS Catalysis 8(6) (2018) 5276
Space group: P 1 21/c 1
Cell volume: 4153.65
Cell parameters: 11.264; 17.5505; 23.2268; 90; 115.23; 90;  

COD ID: 4515641
CIF file Formula: - C41 H50 Cl6 N P Pd -
Comments: Ding, Linlin; Sui, Xianwei; Gu, Zhenhua Enantioselective Synthesis of Biaryl Atropisomers via Pd/Norbornene-Catalyzed Three-Component Cross-Couplings ACS Catalysis 8(6) (2018) 5630
Space group: P 21 21 21
Cell volume: 4212.1
Cell parameters: 13.8095; 15.6122; 19.5369; 90; 90; 90;  

COD ID: 4515642
CIF file Formula: - C25.5 H15 Cl5 O3 -
Comments: Ding, Linlin; Sui, Xianwei; Gu, Zhenhua Enantioselective Synthesis of Biaryl Atropisomers via Pd/Norbornene-Catalyzed Three-Component Cross-Couplings ACS Catalysis 8(6) (2018) 5630
Space group: P 1 21 1
Cell volume: 7018.53
Cell parameters: 11.39996; 31.0942; 19.9369; 90; 96.7204; 90;  

COD ID: 4515643
CIF file Formula: - C29 H34 Cl N O5 -
Comments: Kuang, Xiao-Kang; Zhu, Jun; Zhou, Li; Wang, Lijia; Wang, Sunewang R.; Tang, Yong Synergetic Tandem Enantiomeric Enrichment in Catalytic Asymmetric Multi-Component Reactions (AMCRs): Highly Enantioselective Construction of Tetracyclic Indolines with Four Continuous Stereocenters ACS Catalysis 8(6) (2018) 4991
Space group: P 1 21 1
Cell volume: 1297.5
Cell parameters: 8.4142; 14.046; 11.3304; 90; 104.324; 90;  

COD ID: 4515644
CIF file Formula: - C21 H27 N O5 -
Comments: Kuang, Xiao-Kang; Zhu, Jun; Zhou, Li; Wang, Lijia; Wang, Sunewang R.; Tang, Yong Synergetic Tandem Enantiomeric Enrichment in Catalytic Asymmetric Multi-Component Reactions (AMCRs): Highly Enantioselective Construction of Tetracyclic Indolines with Four Continuous Stereocenters ACS Catalysis 8(6) (2018) 4991
Space group: P 1 21/c 1
Cell volume: 1957.6
Cell parameters: 12.432; 11.174; 14.1728; 90; 96.117; 90;  

COD ID: 4515645
CIF file Formula: - C21 H27 N O5 -
Comments: Kuang, Xiao-Kang; Zhu, Jun; Zhou, Li; Wang, Lijia; Wang, Sunewang R.; Tang, Yong Synergetic Tandem Enantiomeric Enrichment in Catalytic Asymmetric Multi-Component Reactions (AMCRs): Highly Enantioselective Construction of Tetracyclic Indolines with Four Continuous Stereocenters ACS Catalysis 8(6) (2018) 4991
Space group: P 1 21/c 1
Cell volume: 3959.3
Cell parameters: 8.3767; 12.1262; 39.035; 90; 93.093; 90;  

COD ID: 4515646
CIF file Formula: - C39 H38 Br N O Si2 -
Comments: Meng, Fei-Fan; Xie, Jia-Hao; Xu, Yun-He; Loh, Teck-Peng Catalytically Asymmetric Synthesis of 1,3-Bis(silyl)propenes via Copper-Catalyzed Double Proto-Silylations of Polar Enynes ACS Catalysis 8(6) (2018) 5306
Space group: P 21 21 21
Cell volume: 3332.5
Cell parameters: 9.6879; 9.8487; 34.927; 90; 90; 90;  

COD ID: 4515647
CIF file Formula: - C15 H21 N O2 S -
Comments: Liu, Ruzhang; Ge, Hua; Chen, Kuanwei; Xue, Huaiguo Selectivity in Olefin-Intervened Macrocyclic Ring-Closing Metathesis ACS Catalysis 8(6) (2018) 5574
Space group: P 1 21/c 1
Cell volume: 1439.33
Cell parameters: 16.125; 6.8205; 13.1663; 90; 96.287; 90;  

COD ID: 4515648
CIF file Formula: - C30 H42 N2 O4 S2 -
Comments: Liu, Ruzhang; Ge, Hua; Chen, Kuanwei; Xue, Huaiguo Selectivity in Olefin-Intervened Macrocyclic Ring-Closing Metathesis ACS Catalysis 8(6) (2018) 5574
Space group: P 1 21/n 1
Cell volume: 3028.2
Cell parameters: 19.6621; 8.3363; 19.9464; 90; 112.146; 90;  

COD ID: 4515649
CIF file Formula: - C30 H42 N2 O4 S2 -
Comments: Liu, Ruzhang; Ge, Hua; Chen, Kuanwei; Xue, Huaiguo Selectivity in Olefin-Intervened Macrocyclic Ring-Closing Metathesis ACS Catalysis 8(6) (2018) 5574
Space group: P n a 21
Cell volume: 3011.8
Cell parameters: 32.802; 8.4124; 10.9145; 90; 90; 90;  

COD ID: 4515650
CIF file Formula: - C13 H17 N O2 S -
Comments: Liu, Ruzhang; Ge, Hua; Chen, Kuanwei; Xue, Huaiguo Selectivity in Olefin-Intervened Macrocyclic Ring-Closing Metathesis ACS Catalysis 8(6) (2018) 5574
Space group: P 1 21/n 1
Cell volume: 1293
Cell parameters: 7.851; 10.524; 15.813; 90; 98.263; 90;  

COD ID: 4515651
CIF file Formula: - C16 H25 O2 P -
Comments: Smaligo, Andrew J.; Vardhineedi, Sriramurthy; Kwon, Ohyun Carvone-Derived P-Stereogenic Phosphines: Design, Synthesis, and Use in Allene-Imine [3 + 2] Annulation. ACS catalysis 8(6) (2018) 5188-5192
Space group: P 1 21 1
Cell volume: 768.8
Cell parameters: 8.589; 5.946; 15.333; 90; 100.966; 90;  

COD ID: 4515652
CIF file Formula: - C16 H23 O3 P -
Comments: Smaligo, Andrew J.; Vardhineedi, Sriramurthy; Kwon, Ohyun Carvone-Derived P-Stereogenic Phosphines: Design, Synthesis, and Use in Allene-Imine [3 + 2] Annulation. ACS catalysis 8(6) (2018) 5188-5192
Space group: P 1 21 1
Cell volume: 1549.67
Cell parameters: 10.2543; 10.9798; 13.7645; 90; 90.59; 90;  

COD ID: 4515653
CIF file Formula: - C25 H18 Cl F3 O2 S -
Comments: Maddox, Sean M.; Dawson, Gregory A.; Rochester, Nicholas C.; Ayonon, Arianna B.; Moore, Curtis E.; Rheingold, Arnold L.; Gustafson, Jeffrey L. Enantioselective Synthesis of Biaryl Atropisomers via the Addition of Thiophenols into Aryl-Naphthoquinones. ACS catalysis 8(6) (2018) 5443-5447
Space group: P 21 21 21
Cell volume: 2160.68
Cell parameters: 7.8069; 7.8369; 35.3156; 90; 90; 90;  

COD ID: 4515654
CIF file Formula: - C26 H21 F3 O2 S -
Comments: Maddox, Sean M.; Dawson, Gregory A.; Rochester, Nicholas C.; Ayonon, Arianna B.; Moore, Curtis E.; Rheingold, Arnold L.; Gustafson, Jeffrey L. Enantioselective Synthesis of Biaryl Atropisomers via the Addition of Thiophenols into Aryl-Naphthoquinones. ACS catalysis 8(6) (2018) 5443-5447
Space group: P 1 21 1
Cell volume: 1071.54
Cell parameters: 7.7702; 7.7862; 17.9926; 90; 100.144; 90;  

COD ID: 4515655
CIF file Formula: - C23.7 H15 Cl2.1 D0.7 F3 O4 S -
Comments: Maddox, Sean M.; Dawson, Gregory A.; Rochester, Nicholas C.; Ayonon, Arianna B.; Moore, Curtis E.; Rheingold, Arnold L.; Gustafson, Jeffrey L. Enantioselective Synthesis of Biaryl Atropisomers via the Addition of Thiophenols into Aryl-Naphthoquinones. ACS catalysis 8(6) (2018) 5443-5447
Space group: P 21 21 21
Cell volume: 2435.2
Cell parameters: 9.3182; 10.5061; 24.8751; 90; 90; 90;  

COD ID: 4515656
CIF file Formula: - C21 H20 N2 O3 -
Comments: Pang, Shuai; Yang, Xing; Cao, Ze-Hun; Zhang, Yu-Long; Zhao, Yan; Huang, Yi-Yong Intermolecular [2 + 2] Cycloaddition/Isomerization of Allenyl Imides and Unactivated Imines for the Synthesis of 1-Azadienes Catalyzed by a Ni(ClO4)2·6H2O Lewis Acid ACS Catalysis 8(6) (2018) 5193
Space group: P 1 21/n 1
Cell volume: 1881.1
Cell parameters: 13.218; 8.696; 16.546; 90; 98.483; 90;  

COD ID: 4515657
CIF file Formula: - C22 H22 N2 O4 -
Comments: Pang, Shuai; Yang, Xing; Cao, Ze-Hun; Zhang, Yu-Long; Zhao, Yan; Huang, Yi-Yong Intermolecular [2 + 2] Cycloaddition/Isomerization of Allenyl Imides and Unactivated Imines for the Synthesis of 1-Azadienes Catalyzed by a Ni(ClO4)2·6H2O Lewis Acid ACS Catalysis 8(6) (2018) 5193
Space group: P 1 21/n 1
Cell volume: 1870.7
Cell parameters: 10.559; 8.848; 20.03; 90; 91.424; 90;  

COD ID: 4515658
CIF file Formula: - C16 H21 Cl2 Fe N9 O2 -
Comments: Zhu, Cheng-Liang; Wang, Cheng; Qin, Qi-Xue; Yruegas, Sam; Martin, Caleb D.; Xu, Hao Iron(II)-Catalyzed Azidotrifluoromethylation of Olefins and N-Heterocycles for Expedient Vicinal Trifluoromethyl Amine Synthesis. ACS catalysis 8(6) (2018) 5032-5037
Space group: P n a 21
Cell volume: 2185.5
Cell parameters: 13.7551; 18.856; 8.4263; 90; 90; 90;  

COD ID: 4515659
CIF file Formula: - C15 H19 F3 N2 O4 S -
Comments: Zhu, Cheng-Liang; Wang, Cheng; Qin, Qi-Xue; Yruegas, Sam; Martin, Caleb D.; Xu, Hao Iron(II)-Catalyzed Azidotrifluoromethylation of Olefins and N-Heterocycles for Expedient Vicinal Trifluoromethyl Amine Synthesis. ACS catalysis 8(6) (2018) 5032-5037
Space group: P -1
Cell volume: 822.2
Cell parameters: 7.6537; 10.3038; 11.7; 69.471; 74.774; 75.983;  

COD ID: 4515660
CIF file Formula: - C18 H22 Cl3 F3 N2 O4 S -
Comments: Zhu, Cheng-Liang; Wang, Cheng; Qin, Qi-Xue; Yruegas, Sam; Martin, Caleb D.; Xu, Hao Iron(II)-Catalyzed Azidotrifluoromethylation of Olefins and N-Heterocycles for Expedient Vicinal Trifluoromethyl Amine Synthesis. ACS catalysis 8(6) (2018) 5032-5037
Space group: P 21 21 21
Cell volume: 2284.74
Cell parameters: 6.1287; 17.2349; 21.6302; 90; 90; 90;  

COD ID: 4515661
CIF file Formula: - C14 H22 F3 N O2 -
Comments: Zhu, Cheng-Liang; Wang, Cheng; Qin, Qi-Xue; Yruegas, Sam; Martin, Caleb D.; Xu, Hao Iron(II)-Catalyzed Azidotrifluoromethylation of Olefins and N-Heterocycles for Expedient Vicinal Trifluoromethyl Amine Synthesis. ACS catalysis 8(6) (2018) 5032-5037
Space group: P 1 21/c 1
Cell volume: 1514.75
Cell parameters: 11.8893; 5.2263; 24.518; 90; 96.137; 90;  

COD ID: 4515662
CIF file Formula: - C16 H26 F3 N O2 -
Comments: Zhu, Cheng-Liang; Wang, Cheng; Qin, Qi-Xue; Yruegas, Sam; Martin, Caleb D.; Xu, Hao Iron(II)-Catalyzed Azidotrifluoromethylation of Olefins and N-Heterocycles for Expedient Vicinal Trifluoromethyl Amine Synthesis. ACS catalysis 8(6) (2018) 5032-5037
Space group: P 21 21 21
Cell volume: 3586.05
Cell parameters: 11.579; 16.9733; 18.2465; 90; 90; 90;  

COD ID: 4515663
CIF file Formula: - C19 H25 F3 N2 O4 -
Comments: Zhu, Cheng-Liang; Wang, Cheng; Qin, Qi-Xue; Yruegas, Sam; Martin, Caleb D.; Xu, Hao Iron(II)-Catalyzed Azidotrifluoromethylation of Olefins and N-Heterocycles for Expedient Vicinal Trifluoromethyl Amine Synthesis. ACS catalysis 8(6) (2018) 5032-5037
Space group: P 1 21/c 1
Cell volume: 2047.82
Cell parameters: 14.9198; 13.8571; 9.9498; 90; 95.4351; 90;  

COD ID: 4515664
CIF file Formula: - C17 H39 As Co K2 Mo6 N O39.5 -
Comments: Hou, Yujiao; An, Haiyan; Zhang, Yumeng; Hu, Tao; Yang, Wei; Chang, Shenzhen Rapid Destruction of Two Types of Chemical Warfare Agent Simulants by Hybrid Polyoxomolybdates Modified by Carboxylic Acid Ligands ACS Catalysis 8(7) (2018) 6062
Space group: P -1
Cell volume: 2407
Cell parameters: 12.0872; 12.5682; 17.2255; 76.7; 74.058; 76.399;  

COD ID: 4515665
CIF file Formula: - C17 H44 As K2 Mo6 N Ni O42 -
Comments: Hou, Yujiao; An, Haiyan; Zhang, Yumeng; Hu, Tao; Yang, Wei; Chang, Shenzhen Rapid Destruction of Two Types of Chemical Warfare Agent Simulants by Hybrid Polyoxomolybdates Modified by Carboxylic Acid Ligands ACS Catalysis 8(7) (2018) 6062
Space group: P -1
Cell volume: 2370.12
Cell parameters: 11.9612; 12.5318; 17.1943; 76.499; 74.053; 76.535;  

COD ID: 4515666
CIF file Formula: - C17 H40 As K2 Mo6 N O41 Zn -
Comments: Hou, Yujiao; An, Haiyan; Zhang, Yumeng; Hu, Tao; Yang, Wei; Chang, Shenzhen Rapid Destruction of Two Types of Chemical Warfare Agent Simulants by Hybrid Polyoxomolybdates Modified by Carboxylic Acid Ligands ACS Catalysis 8(7) (2018) 6062
Space group: P -1
Cell volume: 2415.16
Cell parameters: 12.1425; 12.5739; 17.2226; 76.443; 74.062; 76.225;  

COD ID: 4515667
CIF file Formula: - C17 H39 As K2 Mn Mo6 N O40 -
Comments: Hou, Yujiao; An, Haiyan; Zhang, Yumeng; Hu, Tao; Yang, Wei; Chang, Shenzhen Rapid Destruction of Two Types of Chemical Warfare Agent Simulants by Hybrid Polyoxomolybdates Modified by Carboxylic Acid Ligands ACS Catalysis 8(7) (2018) 6062
Space group: P -1
Cell volume: 2445.2
Cell parameters: 12.2865; 12.6065; 17.2145; 76.319; 73.933; 76.064;  

COD ID: 4515668
CIF file Formula: - C18 H87 As2 Co0.5 K3 Mo12 N6 Na O77.5 -
Comments: Hou, Yujiao; An, Haiyan; Zhang, Yumeng; Hu, Tao; Yang, Wei; Chang, Shenzhen Rapid Destruction of Two Types of Chemical Warfare Agent Simulants by Hybrid Polyoxomolybdates Modified by Carboxylic Acid Ligands ACS Catalysis 8(7) (2018) 6062
Space group: P -1
Cell volume: 4681.8
Cell parameters: 16.1055; 18.5246; 19.0707; 75.701; 65.877; 64.845;  

COD ID: 4515669
CIF file Formula: - C21 H44 As Co0.5 K5 Mo6 O44.5 -
Comments: Hou, Yujiao; An, Haiyan; Zhang, Yumeng; Hu, Tao; Yang, Wei; Chang, Shenzhen Rapid Destruction of Two Types of Chemical Warfare Agent Simulants by Hybrid Polyoxomolybdates Modified by Carboxylic Acid Ligands ACS Catalysis 8(7) (2018) 6062
Space group: P -1
Cell volume: 2740.7
Cell parameters: 12.6575; 12.671; 18.5916; 105.723; 91.318; 106.19;  

COD ID: 4515670
CIF file Formula: - C47.5 H70 N2 Ni O8 -
Comments: Nett, Alex J.; Cañellas, Santiago; Higuchi, Yuki; Robo, Michael T.; Kochkodan, Jeanne M.; Haynes, 2nd, M Taylor; Kampf, Jeff W.; Montgomery, John Stable, Well-Defined Nickel(0) Catalysts for Catalytic C-C and C-N Bond Formation. ACS catalysis 8(7) (2018) 6606-6611
Space group: P -1
Cell volume: 10218.4
Cell parameters: 11.54858; 30.1957; 32.8403; 64.8392; 80.3426; 86.1838;  

COD ID: 4515671
CIF file Formula: - C97 H92 N2 Ni O8.5 -
Comments: Nett, Alex J.; Cañellas, Santiago; Higuchi, Yuki; Robo, Michael T.; Kochkodan, Jeanne M.; Haynes, 2nd, M Taylor; Kampf, Jeff W.; Montgomery, John Stable, Well-Defined Nickel(0) Catalysts for Catalytic C-C and C-N Bond Formation. ACS catalysis 8(7) (2018) 6606-6611
Space group: P -1
Cell volume: 3876.59
Cell parameters: 14.0561; 14.806; 22.1265; 93.854; 102.679; 118.29;  

COD ID: 4515672
CIF file Formula: - C27 H22 N2 O3 -
Comments: Rej, Supriya; Chatani, Naoto Rhodium(I)-Catalyzed C8-Alkylation of 1-Naphthylamide Derivatives with Alkenes through a Bidentate Picolinamide Chelation System ACS Catalysis 8(7) (2018) 6699
Space group: C 1 2/c 1
Cell volume: 4042.44
Cell parameters: 14.2005; 10.38306; 28.0529; 90; 102.226; 90;  

COD ID: 4515673
CIF file Formula: - C27 H36 I4 N2 S -
Comments: Horibe, Takahiro; Tsuji, Yasutaka; Ishihara, Kazuaki Thiourea‒I2 as Lewis Base‒Lewis Acid Cooperative Catalysts for Iodochlorination of Alkene with In Situ-Generated I‒Cl ACS Catalysis 8(7) (2018) 6362
Space group: P -1
Cell volume: 3375.9
Cell parameters: 10.6361; 16.8158; 19.6467; 91.7164; 105.424; 93.774;  

COD ID: 4515674
CIF file Formula: - C27 H36 Cl I3 N2 S -
Comments: Horibe, Takahiro; Tsuji, Yasutaka; Ishihara, Kazuaki Thiourea‒I2 as Lewis Base‒Lewis Acid Cooperative Catalysts for Iodochlorination of Alkene with In Situ-Generated I‒Cl ACS Catalysis 8(7) (2018) 6362
Space group: P 1 21/n 1
Cell volume: 3172.9
Cell parameters: 10.689; 18.743; 16.225; 90; 102.555; 90;  

COD ID: 4515675
CIF file Formula: - C17 H20 O7 -
Comments: Shu, Wei; Merino, Estíbaliz; Nevado, Cristina Visible Light Mediated, Redox Neutral Remote 1,6-Difunctionalizations of Alkenes ACS Catalysis 8(7) (2018) 6401
Space group: P c a 21
Cell volume: 3288.25
Cell parameters: 12.9176; 15.173; 16.7769; 90; 90; 90;  

COD ID: 4515676
CIF file Formula: - C27 H39 N2 Sc Si2 -
Comments: Li, Shihui; Liu, Dongtao; Wang, Zichuan; Cui, Dongmei Development of Group 3 Catalysts for Alternating Copolymerization of Ethylene and Styrene Derivatives ACS Catalysis 8(7) (2018) 6086
Space group: P 1 21/c 1
Cell volume: 2822.8
Cell parameters: 16.7493; 17.9477; 9.7237; 90; 105.053; 90;  

COD ID: 4515677
CIF file Formula: - C33 H41 N3 O3 -
Comments: Li, Zhenghua; Song, Liangliang; Van Meervelt, Luc; Tian, Guilong; Van der Eycken, Erik V. Cationic Gold(I)-Catalyzed Cascade Bicyclizations for Divergent Synthesis of (Spiro)polyheterocycles ACS Catalysis 8(7) (2018) 6388
Space group: P -1
Cell volume: 1444.35
Cell parameters: 11.5304; 11.8994; 12.6132; 107.862; 96.62; 114.133;  

COD ID: 4515678
CIF file Formula: - C21 H22 N2 O2 S -
Comments: Rigotti, Thomas; Casado-Sánchez, Antonio; Cabrera, Silvia; Pérez-Ruiz, Raúl; Liras, Marta; de la Peña O’Shea, Víctor A.; Alemán, José A Bifunctional Photoaminocatalyst for the Alkylation of Aldehydes: Design, Analysis, and Mechanistic Studies ACS Catalysis 8(7) (2018) 5928
Space group: P 21 21 21
Cell volume: 3769
Cell parameters: 9.2626; 11.273; 36.0958; 90; 90; 90;  

COD ID: 4515679
CIF file Formula: - C24 H20 N2 O2 S -
Comments: Rigotti, Thomas; Casado-Sánchez, Antonio; Cabrera, Silvia; Pérez-Ruiz, Raúl; Liras, Marta; de la Peña O’Shea, Víctor A.; Alemán, José A Bifunctional Photoaminocatalyst for the Alkylation of Aldehydes: Design, Analysis, and Mechanistic Studies ACS Catalysis 8(7) (2018) 5928
Space group: P 1 21 1
Cell volume: 2046.24
Cell parameters: 7.3859; 14.0495; 19.8207; 90; 95.797; 90;  

COD ID: 4515680
CIF file Formula: - C22 H17 N3 O2 -
Comments: Zhai, Shengxian; Qiu, Shuxian; Chen, Xiaoming; Tao, Cheng; Li, Yun; Cheng, Bin; Wang, Huifei; Zhai, Hongbin Trifunctionalization of Allenes via Cobalt-Catalyzed MHP-Assisted C‒H Bond Functionalization and Molecular Oxygen Activation ACS Catalysis 8(7) (2018) 6645
Space group: P 1 21/c 1
Cell volume: 1721.23
Cell parameters: 6.0252; 14.9032; 19.2088; 90; 93.713; 90;  

COD ID: 4515681
CIF file Formula: - C38 H22 Cl2 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: C 1 2/c 1
Cell volume: 2711.7
Cell parameters: 15.8675; 11.3225; 16.9255; 90; 116.905; 90;  

COD ID: 4515682
CIF file Formula: - C40 H26 Cl2 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: C 1 2/c 1
Cell volume: 2894.7
Cell parameters: 16.6618; 12.3936; 16.076; 90; 119.312; 90;  

COD ID: 4515683
CIF file Formula: - C45 H54 O -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P -1
Cell volume: 3817.17
Cell parameters: 13.048; 15.9745; 20.3351; 69.8393; 74.7061; 79.3386;  

COD ID: 4515684
CIF file Formula: - C115 H108 Cl2 F36 N6 O8 P2 Sb2 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 4 21 2
Cell volume: 24298.7
Cell parameters: 23.156; 23.156; 45.3164; 90; 90; 90;  

COD ID: 4515685
CIF file Formula: - C40 H28 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: C 1 2/c 1
Cell volume: 2640.4
Cell parameters: 24.6931; 9.8945; 11.3008; 90; 107.002; 90;  

COD ID: 4515686
CIF file Formula: - C57 H53 Au Cl F18 N3 O4 P Sb -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 21 21 21
Cell volume: 6314.9
Cell parameters: 11.625; 21.7951; 24.924; 90; 90; 90;  

COD ID: 4515687
CIF file Formula: - C85 H148 Au4 Cl4 F24 N4 O10 P4 S2 Sb4 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P -1
Cell volume: 2900.2
Cell parameters: 14.1224; 14.3201; 16.3265; 111.05; 108.05; 90.835;  

COD ID: 4515688
CIF file Formula: - C42 H50 Cl2 F6 N2 O4 P Sb -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 21 21 21
Cell volume: 4473.2
Cell parameters: 14.5593; 16.985; 18.089; 90; 90; 90;  

COD ID: 4515689
CIF file Formula: - C64 H59 Cl2 F18 N3 O4 P Sb -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 1 21 1
Cell volume: 6514.7
Cell parameters: 11.2724; 25.712; 22.718; 90; 98.349; 90;  

COD ID: 4515690
CIF file Formula: - C28 H18 Br2 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 21 21 21
Cell volume: 2092.09
Cell parameters: 6.7543; 9.853; 31.4363; 90; 90; 90;  

COD ID: 4515691
CIF file Formula: - C63 H59 Au Cl3 F18 N3 O4 P Sb -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 1 21 1
Cell volume: 3647.1
Cell parameters: 11.5608; 22.3675; 14.1582; 90; 95.008; 90;  

COD ID: 4515692
CIF file Formula: - C56 H48 Au Cl5 F18 N2 O4 P Sb -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 21 21 21
Cell volume: 6463.7
Cell parameters: 11.8911; 20.269; 26.818; 90; 90; 90;  

COD ID: 4515693
CIF file Formula: - C40 H25.94 Cl2.06 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P 1 21/c 1
Cell volume: 2907.1
Cell parameters: 17.9011; 8.3634; 19.4197; 90; 90.871; 90;  

COD ID: 4515694
CIF file Formula: - C21 H25 N3 -
Comments: Nicholls, Leo D. M.; Marx, Maximilian; Hartung, Thierry; González-Fernández, Elisa; Golz, Christopher; Alcarazo, Manuel TADDOL-Derived Cationic Phosphonites: Toward an Effective Enantioselective Synthesis of [6]Helicenes via Au-Catalyzed Alkyne Hydroarylation ACS Catalysis 8(7) (2018) 6079
Space group: P -1
Cell volume: 910.59
Cell parameters: 8.0652; 8.3219; 14.129; 77.347; 83.454; 80.93;  

COD ID: 4515695
CIF file Formula: - C23 H21 N O -
Comments: Li, Deng-Yuan; Liu, Shuo; Chen, Shuang; Wang, An; Zhu, Xiao-Ping; Liu, Pei-Nian Dual Role of Aryl Iodide in Cascade C‒H Arylation/Amination: Arylation Reagent and Cocatalyst for C‒N Formation ACS Catalysis 8(7) (2018) 6407
Space group: P -1
Cell volume: 1785
Cell parameters: 11.8311; 12.7714; 12.7734; 69.209; 81.613; 86.471;  

COD ID: 4515696
CIF file Formula: - C20 H26 N O4 Zn -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P 1 21/n 1
Cell volume: 1993.5
Cell parameters: 10.811; 16.451; 11.445; 90; 101.668; 90;  

COD ID: 4515697
CIF file Formula: - C28 H47 Ni O4 P -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P -1
Cell volume: 2798.7
Cell parameters: 10.2938; 16.839; 17.23; 73.123; 78.321; 87.036;  

COD ID: 4515698
CIF file Formula: - C13 H22 B N O2 -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P 1 21/n 1
Cell volume: 2789
Cell parameters: 7.204; 34.935; 11.091; 90; 92.218; 90;  

COD ID: 4515699
CIF file Formula: - C24 H32 N2 Ni O4 -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P -1
Cell volume: 585.9
Cell parameters: 7.96; 8.085; 9.656; 108.25; 93.812; 94.208;  

COD ID: 4515700
CIF file Formula: - C25 H41 Ni O4 P -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P -1
Cell volume: 1240.7
Cell parameters: 10.001; 10.415; 13.862; 76.659; 77.984; 62.798;  

COD ID: 4515701
CIF file Formula: - C22 H22 F6 N2 Ni O4 -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P -1
Cell volume: 590.7
Cell parameters: 6.3927; 8.606; 10.965; 86.398; 79.115; 86.957;  

COD ID: 4515702
CIF file Formula: - C24 H28 N2 Ni O8 -
Comments: Tamang, Sem Raj; Singh, Arpita; Unruh, Daniel K.; Findlater, Michael Nickel-Catalyzed Regioselective 1,4-Hydroboration of N-Heteroarenes ACS Catalysis 8(7) (2018) 6186
Space group: P -1
Cell volume: 619
Cell parameters: 6.736; 8.129; 11.969; 101.952; 99.095; 99.806;  

COD ID: 4515703
CIF file Formula: - C24 H20 N2 O6 Pd -
Comments: Hirano, Masafumi; Sano, Kosuke; Kanazawa, Yuki; Komine, Nobuyuki; Maeno, Zen; Mitsudome, Takato; Takaya, Hikaru Mechanistic Insights on Pd/Cu-Catalyzed Dehydrogenative Coupling of Dimethyl Phthalate ACS Catalysis 8(7) (2018) 5827
Space group: P -1
Cell volume: 1086.1
Cell parameters: 8.78; 10; 13.272; 101.969; 98.6857; 103.084;  

COD ID: 4515704
CIF file Formula: - C22 H17 I N2 O4 Pd -
Comments: Hirano, Masafumi; Sano, Kosuke; Kanazawa, Yuki; Komine, Nobuyuki; Maeno, Zen; Mitsudome, Takato; Takaya, Hikaru Mechanistic Insights on Pd/Cu-Catalyzed Dehydrogenative Coupling of Dimethyl Phthalate ACS Catalysis 8(7) (2018) 5827
Space group: P 1 21/c 1
Cell volume: 2135.4
Cell parameters: 7.939; 16.611; 16.219; 90; 93.262; 90;  

COD ID: 4515705
CIF file Formula: - C20 H18 O8 -
Comments: Hirano, Masafumi; Sano, Kosuke; Kanazawa, Yuki; Komine, Nobuyuki; Maeno, Zen; Mitsudome, Takato; Takaya, Hikaru Mechanistic Insights on Pd/Cu-Catalyzed Dehydrogenative Coupling of Dimethyl Phthalate ACS Catalysis 8(7) (2018) 5827
Space group: C 1 2/c 1
Cell volume: 1844
Cell parameters: 18.828; 8.059; 12.153; 90; 91.24; 90;  

COD ID: 4515706
CIF file Formula: - C21 H18 Br2 -
Comments: Su, Xiang; Chen, Bifeng; Wang, Shaohong; Chen, Hui; Chen, Chao Atom- and Step-Efficient Construction of Five-Membered Carbocycles with Alkenes and Alkynes Catalyzed by AgSbF6 ACS Catalysis 8(9) (2018) 7760
Space group: P 1 21/c 1
Cell volume: 1682.1
Cell parameters: 7.258; 18.732; 12.399; 90; 93.746; 90;  

COD ID: 4515707
CIF file Formula: - C17 H15 N O5 -
Comments: Li, Kaizhi; Jin, Zhichao; Chan, Wai-Lun; Lu, Yixin Enantioselective Construction of Bicyclic Pyran and Hydrindane Scaffolds via Intramolecular Rauhut‒Currier Reactions Catalyzed by Thiourea-Phosphines ACS Catalysis 8(9) (2018) 8810
Space group: C 1 2 1
Cell volume: 1521.62
Cell parameters: 21.4471; 6.4084; 12.069; 90; 113.464; 90;  

COD ID: 4515708
CIF file Formula: - C19 H17 Br O3 -
Comments: Li, Kaizhi; Jin, Zhichao; Chan, Wai-Lun; Lu, Yixin Enantioselective Construction of Bicyclic Pyran and Hydrindane Scaffolds via Intramolecular Rauhut‒Currier Reactions Catalyzed by Thiourea-Phosphines ACS Catalysis 8(9) (2018) 8810
Space group: P 21 21 21
Cell volume: 1662.14
Cell parameters: 8.8312; 11.2095; 16.7904; 90; 90; 90;  

COD ID: 4515709
CIF file Formula: - C17 H12 N2 O4 -
Comments: Chen, Fei; Lai, Sheng-Qiang; Zhu, Fei-Fei; Meng, Qiang; Jiang, Yu; Yu, Wei; Han, Bing Cu-Catalyzed Radical Cascade Annulations of Alkyne-Tethered N-Alkoxyamides with Air: Facile Access to Isoxazolidine/1,2-Oxazinane-Fused Isoquinolin-1(2H)-ones ACS Catalysis 8(9) (2018) 8925
Space group: P 1 21/c 1
Cell volume: 1383.26
Cell parameters: 6.8554; 18.0992; 11.1588; 90; 92.472; 90;  

COD ID: 4515710
CIF file Formula: - C18 H29 Cl Ir N O -
Comments: Tan, Guangying; You, Qiulin; You, Jingsong Iridium-Catalyzed Oxidative Heteroarylation of Arenes and Alkenes: Overcoming the Restriction to Specific Substrates ACS Catalysis 8(9) (2018) 8709
Space group: P -1
Cell volume: 987.94
Cell parameters: 8.6737; 8.7731; 13.6686; 78.458; 75.85; 88.359;  

COD ID: 4515711
CIF file Formula: - C32 H38 N2 O2 S2 -
Comments: Tan, Guangying; You, Qiulin; You, Jingsong Iridium-Catalyzed Oxidative Heteroarylation of Arenes and Alkenes: Overcoming the Restriction to Specific Substrates ACS Catalysis 8(9) (2018) 8709
Space group: P 1 21/n 1
Cell volume: 3085.19
Cell parameters: 12.5365; 14.4554; 17.4788; 90; 103.091; 90;  

COD ID: 4515712
CIF file Formula: - C30 H12.5 Al Cl F15.5 N -
Comments: Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao Switchable C‒H Silylation of Indoles Catalyzed by a Thermally Induced Frustrated Lewis Pair ACS Catalysis 8(9) (2018) 8765
Space group: P 1 21/c 1
Cell volume: 5678
Cell parameters: 10.307; 26.879; 20.89; 90; 101.156; 90;  

COD ID: 4515713
CIF file Formula: - C22 H21 N Si -
Comments: Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao Switchable C‒H Silylation of Indoles Catalyzed by a Thermally Induced Frustrated Lewis Pair ACS Catalysis 8(9) (2018) 8765
Space group: P -1
Cell volume: 882.58
Cell parameters: 9.3329; 10.0874; 11.22; 67.672; 88.245; 65.949;  

COD ID: 4515714
CIF file Formula: - C27 H14 Al F16 N4 -
Comments: Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao Switchable C‒H Silylation of Indoles Catalyzed by a Thermally Induced Frustrated Lewis Pair ACS Catalysis 8(9) (2018) 8765
Space group: P -1
Cell volume: 1339.9
Cell parameters: 10.4075; 10.6369; 13.0972; 79.781; 79.01; 71.612;  

COD ID: 4515715
CIF file Formula: - C27 H9 Al F15 N -
Comments: Han, Yuxi; Zhang, Sutao; He, Jianghua; Zhang, Yuetao Switchable C‒H Silylation of Indoles Catalyzed by a Thermally Induced Frustrated Lewis Pair ACS Catalysis 8(9) (2018) 8765
Space group: P 1 21 1
Cell volume: 1208.3
Cell parameters: 7.4782; 17.022; 9.979; 90; 107.975; 90;  

COD ID: 4515716
CIF file Formula: - C15 H11 F3 O2 S2 -
Comments: Li, Haoyu; Cheng, Zengrui; Tung, Chen-Ho; Xu, Zhenghu Atom Transfer Radical Addition to Alkynes and Enynes: A Versatile Gold/Photoredox Approach to Thio-Functionalized Vinylsulfones ACS Catalysis 8(9) (2018) 8237
Space group: P 1 21/c 1
Cell volume: 1510.6
Cell parameters: 11.7791; 5.8649; 21.894; 90; 92.863; 90;  

COD ID: 4515717
CIF file Formula: - C21 H20 F4 O3 S2 -
Comments: Li, Haoyu; Cheng, Zengrui; Tung, Chen-Ho; Xu, Zhenghu Atom Transfer Radical Addition to Alkynes and Enynes: A Versatile Gold/Photoredox Approach to Thio-Functionalized Vinylsulfones ACS Catalysis 8(9) (2018) 8237
Space group: P 1 21/c 1
Cell volume: 2139
Cell parameters: 10.219; 20.254; 10.852; 90; 107.747; 90;  

COD ID: 4515718
CIF file Formula: - C21 H36 Mn N O2 P2 -
Comments: Zou, You-Quan; Chakraborty, Subrata; Nerush, Alexander; Oren, Dror; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David Highly Selective, Efficient Deoxygenative Hydrogenation of Amides Catalyzed by a Manganese Pincer Complex via Metal-Ligand Cooperation. ACS catalysis 8(9) (2018) 8014-8019
Space group: C 1 2/c 1
Cell volume: 4484.04
Cell parameters: 18.6272; 10.623; 23.1001; 90; 101.192; 90;  

COD ID: 4515719
CIF file Formula: - C42 H68 Mn2 N4 O4 P4 -
Comments: Zou, You-Quan; Chakraborty, Subrata; Nerush, Alexander; Oren, Dror; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David Highly Selective, Efficient Deoxygenative Hydrogenation of Amides Catalyzed by a Manganese Pincer Complex via Metal-Ligand Cooperation. ACS catalysis 8(9) (2018) 8014-8019
Space group: P 1 21/c 1
Cell volume: 4587.26
Cell parameters: 11.6109; 18.5885; 21.5322; 90; 99.218; 90;  

COD ID: 4515720
CIF file Formula: - C29 H55 Fe N3 P2 Si2 -
Comments: Gorgas, Nikolaus; Stöger, Berthold; Veiros, Luis F.; Kirchner, Karl Iron(II) Bis(acetylide) Complexes as Key Intermediates in the Catalytic Hydrofunctionalization of Terminal Alkynes ACS Catalysis 8(9) (2018) 7973
Space group: P 1 21/c 1
Cell volume: 3513.3
Cell parameters: 12.7712; 19.068; 15.4049; 90; 110.526; 90;  

COD ID: 4515721
CIF file Formula: - C35 H67 Fe N3 P3 Si2 -
Comments: Gorgas, Nikolaus; Stöger, Berthold; Veiros, Luis F.; Kirchner, Karl Iron(II) Bis(acetylide) Complexes as Key Intermediates in the Catalytic Hydrofunctionalization of Terminal Alkynes ACS Catalysis 8(9) (2018) 7973
Space group: P -1
Cell volume: 2058.3
Cell parameters: 10.589; 12.811; 15.92; 92.93; 104.249; 99.001;  

COD ID: 4515722
CIF file Formula: - C31 H58 Fe N4 P2 Si2 -
Comments: Gorgas, Nikolaus; Stöger, Berthold; Veiros, Luis F.; Kirchner, Karl Iron(II) Bis(acetylide) Complexes as Key Intermediates in the Catalytic Hydrofunctionalization of Terminal Alkynes ACS Catalysis 8(9) (2018) 7973
Space group: P 1 21/c 1
Cell volume: 4274.1
Cell parameters: 16.778; 15.4527; 16.706; 90; 99.322; 90;  

COD ID: 4515723
CIF file Formula: - C40 H50 Fe N6 P2 -
Comments: Gorgas, Nikolaus; Stöger, Berthold; Veiros, Luis F.; Kirchner, Karl Iron(II) Bis(acetylide) Complexes as Key Intermediates in the Catalytic Hydrofunctionalization of Terminal Alkynes ACS Catalysis 8(9) (2018) 7973
Space group: P 1 21/n 1
Cell volume: 3683.5
Cell parameters: 18.6843; 11.1179; 18.9515; 90; 110.665; 90;  

COD ID: 4515724
CIF file Formula: - C39 H58 B Fe N5 O2 P2 -
Comments: Gorgas, Nikolaus; Stöger, Berthold; Veiros, Luis F.; Kirchner, Karl Iron(II) Bis(acetylide) Complexes as Key Intermediates in the Catalytic Hydrofunctionalization of Terminal Alkynes ACS Catalysis 8(9) (2018) 7973
Space group: P 1 21/c 1
Cell volume: 3981.5
Cell parameters: 18.764; 11.2867; 20.592; 90; 114.08; 90;  

COD ID: 4515725
CIF file Formula: - C22 H24 Cl N O Ru -
Comments: Zhang, Luoqiang; Zhu, Lei; Zhang, Yuming; Yang, Yudong; Wu, Yimin; Ma, Weixin; Lan, Yu; You, Jingsong Experimental and Theoretical Studies on Ru(II)-Catalyzed Oxidative C‒H/C‒H Coupling of Phenols with Aromatic Amides Using Air as Oxidant: Scope, Synthetic Applications, and Mechanistic Insights ACS Catalysis 8(9) (2018) 8324
Space group: P 1 21/n 1
Cell volume: 1933.3
Cell parameters: 11.6782; 8.2226; 20.44; 90; 99.939; 90;  

COD ID: 4515726
CIF file Formula: - C23 H24 N2 O2 -
Comments: Zhang, Luoqiang; Zhu, Lei; Zhang, Yuming; Yang, Yudong; Wu, Yimin; Ma, Weixin; Lan, Yu; You, Jingsong Experimental and Theoretical Studies on Ru(II)-Catalyzed Oxidative C‒H/C‒H Coupling of Phenols with Aromatic Amides Using Air as Oxidant: Scope, Synthetic Applications, and Mechanistic Insights ACS Catalysis 8(9) (2018) 8324
Space group: P 1 21/c 1
Cell volume: 1984
Cell parameters: 8.295; 11.086; 21.615; 90; 93.5; 90;  

COD ID: 4515727
CIF file Formula: - C33 H39 F6 N2 O2 Ru Sb -
Comments: Zhang, Luoqiang; Zhu, Lei; Zhang, Yuming; Yang, Yudong; Wu, Yimin; Ma, Weixin; Lan, Yu; You, Jingsong Experimental and Theoretical Studies on Ru(II)-Catalyzed Oxidative C‒H/C‒H Coupling of Phenols with Aromatic Amides Using Air as Oxidant: Scope, Synthetic Applications, and Mechanistic Insights ACS Catalysis 8(9) (2018) 8324
Space group: P 1 21/c 1
Cell volume: 3499.9
Cell parameters: 13.2275; 10.9193; 24.4944; 90; 98.3993; 90;  

COD ID: 4515728
CIF file Formula: - C47 H43 Br Mn N O4 P2 -
Comments: Daw, Prosenjit; Kumar, Amit; Espinosa-Jalapa, Noel Angel; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David Synthesis of Pyrazines and Quinoxalines via Acceptorless Dehydrogenative Coupling Routes Catalyzed by Manganese Pincer Complexes. ACS catalysis 8(9) (2018) 7734-7741
Space group: P -1
Cell volume: 1981.22
Cell parameters: 12.0659; 12.6901; 13.3087; 94.285; 102.738; 90.704;  

COD ID: 4515729
CIF file Formula: - C39 H31 B Mn N O2 P2 -
Comments: Daw, Prosenjit; Kumar, Amit; Espinosa-Jalapa, Noel Angel; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David Synthesis of Pyrazines and Quinoxalines via Acceptorless Dehydrogenative Coupling Routes Catalyzed by Manganese Pincer Complexes. ACS catalysis 8(9) (2018) 7734-7741
Space group: P -1
Cell volume: 1623.02
Cell parameters: 10.0379; 11.3687; 15.6568; 73.97; 77.542; 72.82;  

COD ID: 4515730
CIF file Formula: - C39 H31 Mn N2 O2 P2 -
Comments: Daw, Prosenjit; Kumar, Amit; Espinosa-Jalapa, Noel Angel; Diskin-Posner, Yael; Ben-David, Yehoshoa; Milstein, David Synthesis of Pyrazines and Quinoxalines via Acceptorless Dehydrogenative Coupling Routes Catalyzed by Manganese Pincer Complexes. ACS catalysis 8(9) (2018) 7734-7741
Space group: R -3 :H
Cell volume: 14591.3
Cell parameters: 37.5012; 37.5012; 11.98047; 90; 90; 120;  

COD ID: 4515731
CIF file Formula: - C20 H20 Br Cl2 N O Pt -
Comments: Shimbayashi, Takuya; Matsushita, Gaku; Nanya, Atsushi; Eguchi, Akira; Okamoto, Kazuhiro; Ohe, Kouichi Divergent Catalytic Approach from Cyclic Oxime Esters to Nitrogen-Containing Heterocycles with Group 9 Metal Catalysts ACS Catalysis 8(9) (2018) 7773
Space group: P 1 21/c 1
Cell volume: 2137.9
Cell parameters: 9.7404; 13.3126; 17.0002; 90; 104.115; 90;  

COD ID: 4515732
CIF file Formula: - C33 H41 Cl2 N Ru S -
Comments: Rozenberg, Illya; Eivgi, Or; Frenklah, Alexander; Butilkov, Danielle; Kozuch, Sebastian; Goldberg, Israel; Lemcoff, N. Gabriel Synthesis and Catalytic Properties of Sulfur-Chelated Ruthenium Benzylidenes Bearing a Cyclic (Alkyl)(amino)carbene Ligand ACS Catalysis 8(9) (2018) 8182
Space group: P 43
Cell volume: 3108.87
Cell parameters: 10.0186; 10.0186; 30.9734; 90; 90; 90;  

COD ID: 4515733
CIF file Formula: - C28 H36 Cl2 F3 N Ru S -
Comments: Rozenberg, Illya; Eivgi, Or; Frenklah, Alexander; Butilkov, Danielle; Kozuch, Sebastian; Goldberg, Israel; Lemcoff, N. Gabriel Synthesis and Catalytic Properties of Sulfur-Chelated Ruthenium Benzylidenes Bearing a Cyclic (Alkyl)(amino)carbene Ligand ACS Catalysis 8(9) (2018) 8182
Space group: P n a 21
Cell volume: 2835.1
Cell parameters: 16.3382; 16.5805; 10.4655; 90; 90; 90;  

COD ID: 4515734
CIF file Formula: - C26 H32 Cl2 F3 N Ru S -
Comments: Rozenberg, Illya; Eivgi, Or; Frenklah, Alexander; Butilkov, Danielle; Kozuch, Sebastian; Goldberg, Israel; Lemcoff, N. Gabriel Synthesis and Catalytic Properties of Sulfur-Chelated Ruthenium Benzylidenes Bearing a Cyclic (Alkyl)(amino)carbene Ligand ACS Catalysis 8(9) (2018) 8182
Space group: P -1
Cell volume: 2630.52
Cell parameters: 11.0669; 14.1689; 17.6536; 103.228; 94.276; 100.447;  

COD ID: 4515735
CIF file Formula: - C32 H39 Cl4 N Ru S -
Comments: Rozenberg, Illya; Eivgi, Or; Frenklah, Alexander; Butilkov, Danielle; Kozuch, Sebastian; Goldberg, Israel; Lemcoff, N. Gabriel Synthesis and Catalytic Properties of Sulfur-Chelated Ruthenium Benzylidenes Bearing a Cyclic (Alkyl)(amino)carbene Ligand ACS Catalysis 8(9) (2018) 8182
Space group: P c a 21
Cell volume: 3208
Cell parameters: 19.868; 9.2131; 17.5258; 90; 90; 90;  

COD ID: 4515736
CIF file Formula: - C43 H60 S Y2 -
Comments: Luo, Yong; Teng, Huai-Long; Xue, Can; Nishiura, Masayoshi; Hou, Zhaomin Yttrium-Catalyzed Regioselective α-C‒H Silylation of Methyl Sulfides with Hydrosilanes ACS Catalysis 8(9) (2018) 8027
Space group: P 1 21/n 1
Cell volume: 3899.3
Cell parameters: 12.6411; 16.3119; 19.7095; 90; 106.372; 90;  

COD ID: 4515737
CIF file Formula: - C25 H33 S Y -
Comments: Luo, Yong; Teng, Huai-Long; Xue, Can; Nishiura, Masayoshi; Hou, Zhaomin Yttrium-Catalyzed Regioselective α-C‒H Silylation of Methyl Sulfides with Hydrosilanes ACS Catalysis 8(9) (2018) 8027
Space group: P 1 21/c 1
Cell volume: 2305.3
Cell parameters: 16.796; 8.4624; 16.616; 90; 102.549; 90;  

COD ID: 4515738
CIF file Formula: - C50 H66 S2 Y2 -
Comments: Luo, Yong; Teng, Huai-Long; Xue, Can; Nishiura, Masayoshi; Hou, Zhaomin Yttrium-Catalyzed Regioselective α-C‒H Silylation of Methyl Sulfides with Hydrosilanes ACS Catalysis 8(9) (2018) 8027
Space group: P -1
Cell volume: 1103.18
Cell parameters: 10.343; 10.6225; 10.683; 94.507; 108.927; 92.924;  

COD ID: 4515739
CIF file Formula: - C20 H20 S Si -
Comments: Luo, Yong; Teng, Huai-Long; Xue, Can; Nishiura, Masayoshi; Hou, Zhaomin Yttrium-Catalyzed Regioselective α-C‒H Silylation of Methyl Sulfides with Hydrosilanes ACS Catalysis 8(9) (2018) 8027
Space group: P 1 21/n 1
Cell volume: 1786.7
Cell parameters: 9.7426; 9.7458; 18.818; 90; 90.465; 90;  

COD ID: 4515740
CIF file Formula: - C23 H23 N S Si -
Comments: Luo, Yong; Teng, Huai-Long; Xue, Can; Nishiura, Masayoshi; Hou, Zhaomin Yttrium-Catalyzed Regioselective α-C‒H Silylation of Methyl Sulfides with Hydrosilanes ACS Catalysis 8(9) (2018) 8027
Space group: P 1 21/n 1
Cell volume: 2018.6
Cell parameters: 10.304; 17.9385; 11.4674; 90; 107.757; 90;  

COD ID: 4515741
CIF file Formula: - C21 H25 Cl3 Ir N O3 -
Comments: Zhou, Gang; Aboo, Ahmed H.; Robertson, Craig M.; Liu, Ruixia; Li, Zhenhua; Luzyanin, Konstantin; Berry, Neil G.; Chen, Weiping; Xiao, Jianliang N,O- vs N,C-Chelation in Half-Sandwich Iridium Complexes: A Dramatic Effect on Enantioselectivity in Asymmetric Transfer Hydrogenation of Ketones ACS Catalysis 8(9) (2018) 8020
Space group: P 21 21 21
Cell volume: 2360.1
Cell parameters: 9.6875; 13.7823; 17.6769; 90; 90; 90;  

COD ID: 4515742
CIF file Formula: - C21 H25 Cl Ir N O3 -
Comments: Zhou, Gang; Aboo, Ahmed H.; Robertson, Craig M.; Liu, Ruixia; Li, Zhenhua; Luzyanin, Konstantin; Berry, Neil G.; Chen, Weiping; Xiao, Jianliang N,O- vs N,C-Chelation in Half-Sandwich Iridium Complexes: A Dramatic Effect on Enantioselectivity in Asymmetric Transfer Hydrogenation of Ketones ACS Catalysis 8(9) (2018) 8020
Space group: P 61
Cell volume: 3321.5
Cell parameters: 18.4094; 18.4094; 11.3169; 90; 90; 120;  

COD ID: 4515743
CIF file Formula: - C20 H24 Cl N O4 -
Comments: Schmid, Steven C.; Guzei, Ilia A.; Fernández, Israel; Schomaker, Jennifer M. Ring Expansion of Bicyclic Methyleneaziridines via Concerted, Near-Barrierless [2,3]-Stevens Rearrangements of Aziridinium Ylides. ACS catalysis 8(9) (2018) 7907-7914
Space group: P 1 21 1
Cell volume: 955.2
Cell parameters: 7.421; 16.048; 8.176; 90; 101.174; 90;  

COD ID: 4515744
CIF file Formula: - C29 H43 F6 N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P b c a
Cell volume: 6064.9
Cell parameters: 16.4612; 13.7221; 26.85; 90; 90; 90;  

COD ID: 4515745
CIF file Formula: - C30 H21 F18 N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: C 1 2/c 1
Cell volume: 6537.2
Cell parameters: 27.034; 8.1387; 29.826; 90; 95.017; 90;  

COD ID: 4515746
CIF file Formula: - C32 H24 Au Cl F18 N2 P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P 1 21/n 1
Cell volume: 3738.3
Cell parameters: 8.7962; 27.1915; 16.076; 90; 103.535; 90;  

COD ID: 4515747
CIF file Formula: - C27 H27 Cl2 F6 N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P -1
Cell volume: 1423.8
Cell parameters: 8.4844; 13.1717; 13.5679; 92.667; 105.963; 100.874;  

COD ID: 4515748
CIF file Formula: - C26 H37 Au Cl F6 N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P -1
Cell volume: 2994.6
Cell parameters: 10.6409; 16.737; 17.0626; 82.428; 84.084; 87.346;  

COD ID: 4515749
CIF file Formula: - C26 H37 F6 N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P 1 21/n 1
Cell volume: 2679.4
Cell parameters: 13.8885; 13.3919; 15.6069; 90; 112.626; 90;  

COD ID: 4515750
CIF file Formula: - C26 H29 Cl F6 Ir N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P 1 21/c 1
Cell volume: 2760.1
Cell parameters: 11.9033; 8.2433; 28.535; 90; 99.672; 90;  

COD ID: 4515751
CIF file Formula: - C26 H25 Au Cl F6 N P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P -1
Cell volume: 1383.43
Cell parameters: 10.004; 10.1489; 15.7193; 107.808; 92.182; 112.364;  

COD ID: 4515752
CIF file Formula: - C31.5 H24 Au Cl6 F18 N O2 P Sb -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P -1
Cell volume: 2165.1
Cell parameters: 8.9106; 12.9646; 19.744; 73.397; 82.399; 85.849;  

COD ID: 4515753
CIF file Formula: - C46 H40 O5 -
Comments: Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis ACS Catalysis 8(11) (2018) 10457
Space group: P -1
Cell volume: 1715.2
Cell parameters: 11.0227; 11.4514; 15.2564; 69.58; 76.609; 74.008;  


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