Zobrazeno 1 - 10
of 131
pro vyhledávání: '"Charles Edwin Webster"'
Publikováno v:
Inorganics, Vol 10, Iss 6, p 69 (2022)
As the overall turnover-limiting step (TOLS) in the homogeneous conversion of N2O, the oxygen-atom transfer (OAT) from an N2O to an Ru-H complex to generate an N2 and Ru-OH complex has been comprehensively investigated by density functional theory (D
Externí odkaz:
https://doaj.org/article/07c1cb44816f460789ac22bd01d52804
Publikováno v:
Molecules, Vol 26, Iss 8, p 2310 (2021)
The correlation consistent Composite Approach for transition metals (ccCA-TM) and density functional theory (DFT) computations have been applied to investigate the fluxional mechanisms of cyclooctatetraene tricarbonyl chromium ((COT)Cr(CO)3) and 1,3,
Externí odkaz:
https://doaj.org/article/0add3e5877884585b15307b547332843
Autor:
Leigh Anna Hunt, Sanjit Das, Robert W. Lamb, Dinesh Nugegoda, Christine Curiac, Matthew T. Figgins, Ethan C. Lambert, Fengrui Qu, Nathan I. Hammer, Jared H. Delcamp, Charles Edwin Webster, Elizabeth T. Papish
Publikováno v:
ACS Catalysis. 13:5986-5999
Autor:
Akachukwu D. Obi, Lucas A. Freeman, Samuel J. Coates, Andrew J. H. Alexis, Nathan C. Frey, Diane A. Dickie, Charles Edwin Webster, Robert J. Gilliard
Publikováno v:
Organometallics. 41:3064-3072
Autor:
Chance M. Boudreaux, Dinesh Nugegoda, Wenzhi Yao, Nghia Le, Nathan C. Frey, Qing Li, Fengrui Qu, Matthias Zeller, Charles Edwin Webster, Jared H. Delcamp, Elizabeth T. Papish
Publikováno v:
ACS Catalysis. 12:8718-8728
Autor:
Ketki Eknath Shelar, Nghia Le, Karl M. Mukeba, Sriloy Dey, Behzad Farajidizaji, Sumudu Athukorale, Charles U. Pittman, Charles Edwin Webster, Bruno Donnadieu, Eugene Caldona, Dennis W. Smith
Publikováno v:
Materials Chemistry Frontiers. 6:1391-1404
Integration of polycyclic aromatic hydrocarbon (PAH) units into semi-fluorinated polymers affords high thermal stability and excellent processability for potential applications in optoelectronic, gas-separation, and advanced composites.
Autor:
Charles Edwin Webster, Nicholas A. Ward, Fengrui Qu, Olaitan E. Oladipupo, Jessica L. Gray, Robert W. Lamb, Matthew K. Thompson, Alexa R. DeRegnaucourt, Spenser R. Brown, Yifei Xu, Sherri A. McFarland, Colin G. Cameron, James Fletcher Hall, Marco Bonizzoni, Ambar B. Shrestha, Yonghyun Kim, Elizabeth T. Papish, Courtney M. Petersen
Publikováno v:
Photochem Photobiol
We report new ruthenium complexes bearing the lipophilic bathophenanthroline (BPhen) ligand and dihydroxybipyridine (dhbp) ligands which differ in the placement of the OH groups ([(BPhen)(2)Ru(n,n′-dhbp)]Cl(2) with n = 6 and 4 in 1(A) and 2(A), res
Autor:
Diem-Trang Pham, Qianyi Cheng, Thomas J. Summers, Nathan J. DeYonker, Dudley K. Kelso, Manuel A. Palma, Charles Edwin Webster
Publikováno v:
Biophys J
To accurately simulate the inner workings of an enzyme active site with quantum mechanics (QM), not only must the reactive species be included in the model but also important surrounding residues, solvent, or coenzymes involved in crafting the microe
Publikováno v:
Angewandte Chemie (International ed. in English). 61(43)
A combined synthetic and theoretical investigation of N-heterocyclic carbene (NHC) adducts of magnesium amidoboranes is presented, which involves a rare example of reversible migratory insertion within a normal valent s-block element. The reaction of
Autor:
Houston D. Cole, Charles Edwin Webster, Robert W. Lamb, Olaitan E. Oladipupo, Sherri A. McFarland, Seungjo Park, Fengrui Qu, Colin G. Cameron, Marco Bonizzoni, Jessica L. Gray, Elizabeth T. Papish, Yonghyun Kim, Yifei Xu
Publikováno v:
Inorg Chem
Ruthenium complexes bearing protic diimine ligands are cytotoxic to certain cancer cells upon irradiation with blue light. Previously reported complexes of the type [(N,N)(2)Ru(6,6’-dhbp)]Cl(2) with 6,6’-dhbp = 6,6’-dihydroxybipyridine and N,N