Kirkland JK - Search Results

1

Dinickel Catalyzed Vinylidene-Alkene Cyclization Reactions.

Steiman TJ, Kalb AE, Coombs JC, Kirkland JK, Torres H, Ess DH, Uyeda C. Steiman TJ, et al. Among authors: kirkland jk. ACS Catal. 2021 Dec 3;11(23):14408-14416. doi: 10.1021/acscatal.1c03350. Epub 2021 Nov 15. ACS Catal. 2021. PMID: 36237605 Free PMC article.

2

Experimental Demonstration and Density Functional Theory Mechanistic Analysis of Arene C-H Bond Oxidation and Product Protection by Osmium Tetroxide in a Strongly Basic/Nucleophilic Solvent.

Koppaka A, Kirkland JK, Periana RA, Ess DH. Koppaka A, et al. Among authors: kirkland jk. J Org Chem. 2022 Nov 4;87(21):13573-13582. doi: 10.1021/acs.joc.2c01159. Epub 2022 Oct 3. J Org Chem. 2022. PMID: 36191170

3

Dynamic-dependent selectivity in a bisphosphine iron spin crossover C-H insertion/π-coordination reaction.

Davenport MT, Kirkland JK, Ess DH. Davenport MT, et al. Among authors: kirkland jk. Chem Sci. 2023 Aug 21;14(35):9400-9408. doi: 10.1039/d3sc02078a. eCollection 2023 Sep 13. Chem Sci. 2023. PMID: 37712027 Free PMC article.

4

Machine Learning Models for Predicting Zirconocene Properties and Barriers.

Kirkland JK, Kumawat J, Shaban Tameh M, Tolman T, Lambert AC, Lief GR, Yang Q, Ess DH. Kirkland JK, et al. J Chem Inf Model. 2024 Feb 12;64(3):775-784. doi: 10.1021/acs.jcim.3c01575. Epub 2024 Jan 23. J Chem Inf Model. 2024. PMID: 38259142

5

Intramolecular Heteroatom and Styryl Diels-Alder Reactions, Asymmetric Cycloadditions of Chiral 3-Phenylallyl Maleic Esters.

Mpaata P, Miller CR, Bonsrah DK, Camp AB, Ballard KM, Angelie L, Kirkland J, Joy J, Hirschi WJ, Smith SJ, Ess DH, Andrus MB. Mpaata P, et al. J Org Chem. 2024 Mar 15;89(6):3883-3893. doi: 10.1021/acs.joc.3c02725. Epub 2024 Mar 5. J Org Chem. 2024. PMID: 38440874

6

Gas-Phase Ion Chemistry of Metalloporphyrin Anions with Molecular Oxygen: Probing the Influence of the Oxidation and Spin State of the Central Transition Metal by Experiment and Theory.

Archipov T, Kirkland JK, Vogiatzis KD, Steiner A, Niedner-Schatteburg G, Weis P, Fink K, Hampe O, Kappes MM. Archipov T, et al. Among authors: kirkland jk. J Phys Chem A. 2018 May 3;122(17):4357-4365. doi: 10.1021/acs.jpca.8b01715. Epub 2018 Apr 20. J Phys Chem A. 2018. PMID: 29630381

7

Nature of the Short Rh-Li Contact between Lithium and the Rhodium ω-Alkenyl Complex [Rh(CH₂CMe₂CH₂CH═CH₂)₂].

Liu S, Smith BA, Kirkland JK, Vogiatzis KD, Girolami GS. Liu S, et al. Among authors: kirkland jk. Inorg Chem. 2021 Jun 21;60(12):8790-8801. doi: 10.1021/acs.inorgchem.1c00737. Epub 2021 Jun 7. Inorg Chem. 2021. PMID: 34097392

8

Computational Approach to Molecular Catalysis by 3d Transition Metals: Challenges and Opportunities.

Vogiatzis KD, Polynski MV, Kirkland JK, Townsend J, Hashemi A, Liu C, Pidko EA. Vogiatzis KD, et al. Among authors: kirkland jk. Chem Rev. 2019 Feb 27;119(4):2453-2523. doi: 10.1021/acs.chemrev.8b00361. Epub 2018 Oct 30. Chem Rev. 2019. PMID: 30376310 Free PMC article.

9

Ligand field effects on the ground and excited states of reactive FeO²⁺ species.

Kirkland JK , Khan SN , Casale B , Miliordos E , Vogiatzis KD . Kirkland JK , et al. Phys Chem Chem Phys. 2018 Nov 21;20(45):28786-28795. doi: 10.1039/c8cp05372c. Phys Chem Chem Phys. 2018. PMID: 30418434

10

Redox states of dinitrogen coordinated to a molybdenum atom.

White MV, Kirkland JK, Vogiatzis KD. White MV, et al. Among authors: kirkland jk. J Chem Phys. 2021 Jun 14;154(22):224308. doi: 10.1063/5.0050596. J Chem Phys. 2021. PMID: 34241210

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