Crystallography Open Database

Result : There are 30 entries in the selection

You can download the COD numbers of the selection as a text file

You can download all files as a single ZIP archive

Searching journal of publication like 'ACS Catalysis' volume of publication is 12

COD ID: 4519296
CIF file Formula: - C42 H42 N2 Ni O5 P2 S -
Comments: Simon, Connor M.; Dudra, Samantha L.; McGuire, Ryan T.; Ferguson, Michael J.; Johnson, Erin R.; Stradiotto, Mark Identification of a Nitrenoid Reductive Elimination Pathway in Nickel-Catalyzed C–N Cross-Coupling ACS Catalysis 12(2) (2022) 1475-1480
Space group: P 1 21/n 1
Cell volume: 3932.9
Cell parameters: 11.9758; 27.1961; 12.687; 90; 107.865; 90;  

COD ID: 4519297
CIF file Formula: - C48 H51 N Ni O5 P2 S -
Comments: Simon, Connor M.; Dudra, Samantha L.; McGuire, Ryan T.; Ferguson, Michael J.; Johnson, Erin R.; Stradiotto, Mark Identification of a Nitrenoid Reductive Elimination Pathway in Nickel-Catalyzed C–N Cross-Coupling ACS Catalysis 12(2) (2022) 1475-1480
Space group: P -1
Cell volume: 2158.89
Cell parameters: 10.7191; 12.009; 18.2064; 82.6614; 76.5673; 71.5732;  

COD ID: 4519298
CIF file Formula: - C40 H40 B2 Cl3 Cu F8 N4 O2 -
Comments: Nishimura, Kazuki; Wang, Yanzhao; Ogura, Yoshihiro; Kumagai, Jun; Ishihara, Kazuaki A π–Cu(II)−π Complex as an Extremely Active Catalyst for Enantioselective α-Halogenation of N-Acyl-3,5-dimethylpyrazoles ACS Catalysis 12(2) (2022) 1012-1017
Space group: P 21 21 21
Cell volume: 4120.8
Cell parameters: 13.07; 14.339; 21.988; 90; 90; 90;  

COD ID: 4519299
CIF file Formula: - C41 H48 Cu F6 N4 O10 S2 -
Comments: Nishimura, Kazuki; Wang, Yanzhao; Ogura, Yoshihiro; Kumagai, Jun; Ishihara, Kazuaki A π–Cu(II)−π Complex as an Extremely Active Catalyst for Enantioselective α-Halogenation of N-Acyl-3,5-dimethylpyrazoles ACS Catalysis 12(2) (2022) 1012-1017
Space group: P 21 21 21
Cell volume: 4518.9
Cell parameters: 14.6616; 15.7092; 19.6198; 90; 90; 90;  

COD ID: 4519300
CIF file Formula: - C24 H21 N -
Comments: Rodriguez, Jessica; Vesseur, David; Tabey, Alexis; Mallet-Ladeira, Sonia; Miqueu, Karinne; Bourissou, Didier Au(I)/Au(III) Catalytic Allylation Involving π-Allyl Au(III) Complexes ACS Catalysis 12(2) (2022) 993-1003
Space group: C 1 2/c 1
Cell volume: 3594.9
Cell parameters: 24.644; 7.0908; 20.5784; 90; 91.432; 90;  

COD ID: 4519301
CIF file Formula: - C40 H38 N2 O8 S2 -
Comments: He, Qiyuan; Yamazaki, Ken; Ano, Yusuke; Chatani, Naoto Palladium-Catalyzed Site-Selective [5 + 1] Annulation of Aromatic Amides with Alkenes: Acceleration of β-Hydride Elimination by Maleic Anhydride from Palladacycle ACS Catalysis 12(2) (2022) 1595-1600
Space group: P 1 21/c 1
Cell volume: 3531.66
Cell parameters: 14.4266; 7.4071; 33.2757; 90; 96.682; 90;  

COD ID: 4519302
CIF file Formula: - C28 H37 N O3 -
Comments: Su, Yong-Liang; Liu, Geng-Xin; De Angelis, Luca; He, Ru; Al-Sayyed, Ammar; Schanze, Kirk S.; Hu, Wen-Hao; Qiu, Huang; Doyle, Michael P. Radical Cascade Multicomponent Minisci Reactions with Diazo Compounds ACS Catalysis 12(2) (2022) 1357-1363
Space group: C 1 2/c 1
Cell volume: 4898.04
Cell parameters: 27.2805; 9.5063; 18.9097; 90; 92.819; 90;  

COD ID: 4519303
CIF file Formula: - C25 H36 N O3 -
Comments: Su, Yong-Liang; Liu, Geng-Xin; De Angelis, Luca; He, Ru; Al-Sayyed, Ammar; Schanze, Kirk S.; Hu, Wen-Hao; Qiu, Huang; Doyle, Michael P. Radical Cascade Multicomponent Minisci Reactions with Diazo Compounds ACS Catalysis 12(2) (2022) 1357-1363
Space group: C 1 2/c 1
Cell volume: 4729.4
Cell parameters: 24.2586; 10.3745; 18.8315; 90; 93.703; 90;  

COD ID: 4519304
CIF file Formula: - C16 H15 N O -
Comments: Leclair, Alexandre; Wang, Qian; Zhu, Jieping Two-Carbon Ring Expansion of Cyclobutanols to Cyclohexenones Enabled by Indole Radical Cation Intermediate: Development and Application to a Total Synthesis of Uleine ACS Catalysis 12(2) (2022) 1209-1215
Space group: P -1
Cell volume: 596.74
Cell parameters: 4.86815; 8.4796; 15.0305; 75.423; 85.496; 84.466;  

COD ID: 4519341
CIF file Formula: - C21 H19 Fe N O6 -
Comments: Lv, Xiaokang; Xu, Jun; Sun, Cuiyun; Su, Fen; Cai, Yuanlin; Jin, Zhichao; Chi, Yonggui Robin Access to Planar Chiral Ferrocenes via N-Heterocyclic Carbene-Catalyzed Enantioselective Desymmetrization Reactions ACS Catalysis 12(4) (2022) 2706-2713
Space group: P 1 21 1
Cell volume: 916.51
Cell parameters: 7.6105; 8.0429; 15.2788; 90; 101.481; 90;  

COD ID: 4519342
CIF file Formula: - C16 H17 N3 O3 -
Comments: Wang, Chang-An; Rahman, Md. Mahbubur; Bisz, Elwira; Dziuk, Błażej; Szostak, Roman; Szostak, Michal Palladium-NHC (NHC = N-heterocyclic Carbene)-Catalyzed Suzuki–Miyaura Cross-Coupling of Alkyl Amides ACS Catalysis 12(4) (2022) 2426-2433
Space group: P 1 21/n 1
Cell volume: 3100.4
Cell parameters: 11.5366; 9.0589; 30.02; 90; 98.806; 90;  

COD ID: 4519343
CIF file Formula: - C55 H52 Br Co N2 P2 -
Comments: Jheng, Nai-Yuan; Ishizaka, Yusuke; Naganawa, Yuki; Minami, Yasunori; Sekiguchi, Akira; Iizuka, Kosuke; Nakajima, Yumiko Radical Hydrodehalogenation of Aryl Halides with H2 Catalyzed by a Phenanthroline-Based PNNP Cobalt(I) Complex ACS Catalysis 12(4) (2022) 2320-2329
Space group: P 1 21/c 1
Cell volume: 4571.9
Cell parameters: 10.276; 26.264; 17.399; 90; 103.191; 90;  

COD ID: 4519376
CIF file Formula: - C32 H36 F6 N3 P Pd S -
Comments: Alberoni, Chiara; D’Alterio, Massimo C.; Balducci, Gabriele; Immirzi, Barbara; Polentarutti, Maurizio; Pellecchia, Claudio; Milani, Barbara Tunable “In-Chain” and “At the End of the Branches” Methyl Acrylate Incorporation in the Polyolefin Skeleton through Pd(II) Catalysis ACS Catalysis 12(6) (2022) 3430-3443
Space group: C 1 c 1
Cell volume: 3190
Cell parameters: 20.3; 10.543; 15.816; 90; 109.54; 90;  

COD ID: 4519377
CIF file Formula: - C34.5 H41 Cl F6 N3 P Pd S -
Comments: Alberoni, Chiara; D’Alterio, Massimo C.; Balducci, Gabriele; Immirzi, Barbara; Polentarutti, Maurizio; Pellecchia, Claudio; Milani, Barbara Tunable “In-Chain” and “At the End of the Branches” Methyl Acrylate Incorporation in the Polyolefin Skeleton through Pd(II) Catalysis ACS Catalysis 12(6) (2022) 3430-3443
Space group: P 1 21/c 1
Cell volume: 7343
Cell parameters: 12.153; 28.037; 21.613; 90; 94.356; 90;  

COD ID: 4519378
CIF file Formula: - C19 H21 Bi F3 N -
Comments: Louis-Goff, Thomas; Trinh, Huu Vinh; Chen, Eileen; Rheingold, Arnold L.; Ehm, Christian; Hyvl, Jakub Stabilizing Effect of Pre-equilibria: A Trifluoromethyl Complex as a CF2 Reservoir in Catalytic Olefin Difluorocarbenation ACS Catalysis 12(6) (2022) 3719-3730
Space group: P 1 21/c 1
Cell volume: 1775.09
Cell parameters: 12.9594; 9.2852; 14.7567; 90; 91.483; 90;  

COD ID: 4519379
CIF file Formula: - C15 H14 Bi F3 -
Comments: Louis-Goff, Thomas; Trinh, Huu Vinh; Chen, Eileen; Rheingold, Arnold L.; Ehm, Christian; Hyvl, Jakub Stabilizing Effect of Pre-equilibria: A Trifluoromethyl Complex as a CF2 Reservoir in Catalytic Olefin Difluorocarbenation ACS Catalysis 12(6) (2022) 3719-3730
Space group: P b c a
Cell volume: 2861.8
Cell parameters: 17.435; 9.004; 18.23; 90; 90; 90;  

COD ID: 4519380
CIF file Formula: - C16 H14 Bi F3 -
Comments: Louis-Goff, Thomas; Trinh, Huu Vinh; Chen, Eileen; Rheingold, Arnold L.; Ehm, Christian; Hyvl, Jakub Stabilizing Effect of Pre-equilibria: A Trifluoromethyl Complex as a CF2 Reservoir in Catalytic Olefin Difluorocarbenation ACS Catalysis 12(6) (2022) 3719-3730
Space group: P b c a
Cell volume: 2862.3
Cell parameters: 9.7284; 9.7063; 30.3122; 90; 90; 90;  

COD ID: 4519381
CIF file Formula: - C23 H22 O -
Comments: Xue, Sijing; Cristòfol, Àlex; Limburg, Bart; Zeng, Qian; Kleij, Arjan W. Dual Cobalt/Organophotoredox Catalysis for Diastereo- and Regioselective 1,2-Difunctionalization of 1,3-Diene Surrogates Creating Quaternary Carbon Centers ACS Catalysis 12(6) (2022) 3651-3659
Space group: P 1 21/c 1
Cell volume: 1696.4
Cell parameters: 6.1078; 23.368; 12.0794; 90; 100.277; 90;  

COD ID: 4519382
CIF file Formula: - C20 H26 O2 -
Comments: Xue, Sijing; Cristòfol, Àlex; Limburg, Bart; Zeng, Qian; Kleij, Arjan W. Dual Cobalt/Organophotoredox Catalysis for Diastereo- and Regioselective 1,2-Difunctionalization of 1,3-Diene Surrogates Creating Quaternary Carbon Centers ACS Catalysis 12(6) (2022) 3651-3659
Space group: P -1
Cell volume: 1690.21
Cell parameters: 10.2627; 13.449; 14.5521; 115.316; 101.172; 101.362;  

COD ID: 4519383
CIF file Formula: - C33 H50 N3 Ni O5 P -
Comments: Takahashi, Kohei; Sakurazawa, Yuji; Iwai, Asaki; Iwasawa, Nobuharu Catalytic Synthesis of a Methylmalonate Salt from Ethylene and Carbon Dioxide through Photoinduced Activation and Photoredox-Catalyzed Reduction of Nickelalactones ACS Catalysis 12(7) (2022) 3776-3781
Space group: P 1 21/c 1
Cell volume: 3408
Cell parameters: 16.5365; 15.9821; 12.9995; 90; 97.271; 90;  

COD ID: 4519384
CIF file Formula: - C31 H49 Au F6 P Sb -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: P -1
Cell volume: 3325.2
Cell parameters: 8.7636; 13.6876; 28.412; 86.489; 89.678; 77.831;  

COD ID: 4519385
CIF file Formula: - C63 H81 Au F3 N2 O P Sb0.5 -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: P -1
Cell volume: 3594
Cell parameters: 15.519; 15.638; 17.4595; 68.369; 80.53; 65.864;  

COD ID: 4519386
CIF file Formula: - C46 H67 Au Cl P -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: P 21 21 21
Cell volume: 4344
Cell parameters: 12.6694; 18.1472; 18.894; 90; 90; 90;  

COD ID: 4519387
CIF file Formula: - C53 H82 Au Cl4 F6 P Sb -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: C 1 2/c 1
Cell volume: 11564.5
Cell parameters: 33.253; 13.3849; 26.02; 90; 93.079; 90;  

COD ID: 4519388
CIF file Formula: - C126 H159 Au2 F12 P2 Sb2 -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: P 1 21/n 1
Cell volume: 13096
Cell parameters: 13.714; 51.58; 18.755; 90; 99.2; 90;  

COD ID: 4519389
CIF file Formula: - C120 H165 Au3 Cl3 P3 -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: C 1 2/c 1
Cell volume: 24580
Cell parameters: 54.233; 14.371; 32.268; 90; 102.216; 90;  

COD ID: 4519390
CIF file Formula: - C32 H39 Au F6 P Sb -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: P 1 21/n 1
Cell volume: 3421.7
Cell parameters: 11.3949; 16.7262; 18.567; 90; 104.78; 90;  

COD ID: 4519391
CIF file Formula: - C66 H90 Au F6 N P Sb -
Comments: Navarro, Miquel; Alférez, Macarena G.; de Sousa, Morgane; Miranda-Pizarro, Juan; Campos, Jesús Dicoordinate Au(I)–Ethylene Complexes as Hydroamination Catalysts ACS Catalysis 12(7) (2022) 4227-4241
Space group: P -1
Cell volume: 3781
Cell parameters: 15.3509; 15.473; 19.0096; 95.2651; 103.141; 117.913;  

COD ID: 4519392
CIF file Formula: - C53 H59 Cl2 Co N4 O2 Zn -
Comments: de Vries, Folkert; Otten, Edwin Reversible On/Off Switching of Lactide Cyclopolymerization with a Redox-Active Formazanate Ligand ACS Catalysis 12(7) (2022) 4125-4130
Space group: P -1
Cell volume: 2468.27
Cell parameters: 10.7552; 11.5789; 21.0514; 103.464; 93.118; 103.01;  

COD ID: 4519393
CIF file Formula: - C59 H52 N8 O2 Zn2 -
Comments: de Vries, Folkert; Otten, Edwin Reversible On/Off Switching of Lactide Cyclopolymerization with a Redox-Active Formazanate Ligand ACS Catalysis 12(7) (2022) 4125-4130
Space group: P -1
Cell volume: 1248.34
Cell parameters: 9.1508; 10.8692; 14.2352; 80.73; 73.248; 67.252;  


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