Showing results 1 to 60 of 265
1,2-CF bond activation of perfluoroarenes and alkylidene isomers of titanium. DFT analysis of the C-F bond activation pathway and rotation of the titanium alkylidene moiety Andino, Jose G.; Fan, Hongjun; Fout, Alison R.; Bailey, Brad C.; Baik, Mu-Hyun; Mindiola, Daniel J., JOURNAL OF ORGANOMETALLIC CHEMISTRY, v.696, no.25, pp.4138 - 4146, 2011-12 |
3,5-Diarylimidazo[1,2-a]pyridines as Color-Tunable Fluorophores Lee, Ju Young; Shim, Jae Yul; Kim, Hongki; Ko, Donguk; Baik, Mu-Hyun; Yoo, Eun Jeong, JOURNAL OF ORGANIC CHEMISTRY, v.82, no.8, pp.4352 - 4361, 2017-04 |
A Co2N2 diamond-core resting state of cobalt(I): A three-coordinate Co-I synthon invoking an unusual pincer-type rearrangement Fout, Alison R.; Basuli, Falguni; Fan, Hongjun; Tomaszewski, John.; Huffman, John C.; Baik, Mu-Hyun; Mindiola, Daniel J., ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.45, no.20, pp.3291 - 3295, 2006 |
A computational study of the mechanism of the [(salen)Cr + DMAP]-catalyzed formation of cyclic carbonates from CO2 and epoxide Adhikari, Debashis; Nguyen, SonBinh T.; Baik, Mu-Hyun, CHEMICAL COMMUNICATIONS, v.50, no.20, pp.2676 - 2678, 2014 |
A facile approach to a d(4) Ru=N: Moiety Walstrom, A; Pink, M; Yang, XF; Tomaszewski, J; Baik, Mu-Hyun; Caulton, KG, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.127, no.15, pp.5330 - 5331, 2005-04 |
A four-coordinate thionitrosyl complex of vanadium Tran, Ba L.; Thompson, Rick; Ghosh, Soumya; Gao, Xinfeng; Chen, Chun-Hsing; Baik, Mu-Hyun; Mindiola, Daniel J., CHEMICAL COMMUNICATIONS, v.49, no.27, pp.2768 - 2770, 2013 |
A new and selective cycle for dehydrogenation of linear and cyclic alkanes under mild conditions using a base metal Solowey, Douglas P.; Mane, Manoj V.; Kurogi, Takashi; Carroll, Patrick J.; Manor, Brian C.; Baik, Mu-Hyun; Mindiola, Daniel J., NATURE CHEMISTRY, v.9, no.11, pp.1126 - 1132, 2017-11 |
A non-classical hydrogen bond in the molybdenum arene complex [eta(6)-C6H5C6H3(Ph)OH]Mo(PMe3)(3): evidence that hydrogen bonding facilitates oxidative addition of the O-H bond Hascall, T; Baik, Mu-Hyun; Bridgewater, BA; Shin, JH; Churchill, DG; Friesner, RA; Parkin, G, CHEMICAL COMMUNICATIONS, no.22, pp.2644 - 2645, 2002-11 |
A Planar Three-Coordinate Vanadium(II) Complex and the Study of Terminal Vanadium Nitrides from N-2: A Kinetic or Thermodynamic Impediment to N-N Bond Cleavage? Tran, Ba L.; Pinter, Balazs; Nichols, Adam J.; Konopka, Felicia T.; Thompson, Rick; Chen, Chun-Hsing; Krzystek, J.; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.134, no.31, pp.13035 - 13045, 2012-08 |
A Redox Non-Innocent Ligand Controls the Life Time of a Reactive Quartet Excited State - An MCSCF Study of [Ni(H)(OH)](+) Dede, Yavuz; Zhang, Xinhao; Schlangen, Maria; Schwarz, Helmut; Baik, Mu-Hyun, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.131, no.35, pp.12634 - 12642, 2009-09 |
A Transient Vanadium(III) Neopentylidene Complex. Redox Chemistry and Reactivity of the V=(CHBu)-Bu-t Functionality Kilgore, Uriah J.; Sengelaub, Caitlin A.; Fan, Hongjun; Tomaszewski, John; Karty, Jonathan A.; Baik, Mu-Hyun; Mindiola, Daniel J., ORGANOMETALLICS, v.28, no.3, pp.843 - 852, 2009-02 |
A unique approach to metal-induced Bergman cyclization: Long-range enediyne activation by ligand-to-metal charge transfer Bhattacharyya, S; Pink, M; Baik, Mu-Hyun; Zaleski, JM, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.44, no.4, pp.592 - 595, 2005 |
Ab initio quantum calculation of the diabatic coupling matrix elements for the self-exchange redox couples M(Cp)(2)(0/+) (M = Fe, Co; Cp Cp = C5H5) Baik, Mu-Hyun; Crystal, JB; Friesner, RA, INORGANIC CHEMISTRY, v.41, no.23, pp.5926 - 5927, 2002-11 |
Activation of the Basal Plane in Two Dimensional Transition Metal Chalcogenide Nanostructures Han, Jae Hyo; Kim, Hong Ki; Baek, Bongkwan; Han, Jeonghee; Ahn, Hyun S.; Baik, Mu-Hyun; Cheon, Jinwoo, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.140, no.42, pp.13663 - 13671, 2018-10 |
Addition of Si-H and B-H Bonds and Redox Reactivity Involving Low-Coordinate Nitrido-Vanadium Complexes Thompson, Rick; Tran, Ba L.; Ghosh, Soumya; Chen, Chun-Hsing; Pink, Maren; Gao, Xinfeng; Carroll, Patrick J.; et al, INORGANIC CHEMISTRY, v.54, no.6, pp.3068 - 3077, 2015-03 |
Aldehyde Carboxylation: A Concise DFT Mechanistic Study and a Hypothetical Role of CO (2) in the Origin of Life Juhl, Martin; Kim, MyungJo; Lee, Hee-Yoon; Baik, Mu-Hyun; Lee, Ji-Woong, SYNLETT, v.30, no.9, pp.987 - 996, 2019-06 |
Allene C(sp(2))-H Activation and Alkenylation Catalyzed by Palladium Schreib, Benedikt S.; Son, Mina; Aouane, Francoise A.; Baik, Mu-Hyun; Carreira, Erick M., JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.143, no.51, pp.21705 - 21712, 2021-12 |
alpha,beta-(C-C-C) Agostic bonds in transition metal based olefin metathesis catalyses Suresh, CH; Baik, Mu-Hyun, DALTON TRANSACTIONS, no.18, pp.2982 - 2984, 2005 |
Amphiphile self-assembly dynamics at the solution-solid interface reveal asymmetry in head/tail desorption Castillo, Henry D.; Espinosa-Duran, John M.; Dobscha, James R.; Ashley, Daniel C.; Debnath, Sibali; Hirsch, Brandon E.; Schrecke, Samantha R.; et al, CHEMICAL COMMUNICATIONS, v.54, no.72, pp.10076 - 10079, 2018-09 |
An aryl diimine cobalt(i) catalyst for carbonyl hydrosilylation Sharma, Anuja; So, Sangho; Kim, Jun-Hyeong; MacMillan, Samantha N.; Baik, Mu-Hyun; Trovitch, Ryan J., CHEMICAL COMMUNICATIONS, v.58, no.77, pp.10793 - 10796, 2022-09 |
An experimental and computational analysis of the formation of the terminal nitrido complex (eta(3)-Cp*)(2)Mo(N)(N-3) by elimination of N-2 from CP*Mo-2(N-3)(2): The barrier to elimination is strongly influenced by the exo versus endo configuration of the azide ligand Shin, JH; Bridgewater, BM; Churchill, DG; Baik, Mu-Hyun; Friesner, RA; Parkin, G, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.123, no.41, pp.10111 - 10112, 2001-10 |
An Isolable Azide Adduct of Titanium(II) Follows Bifurcated Deazotation Pathways to an Imide Reinholdt, Anders; Kwon, Seongyeon; Jafari, Mehrafshan G.; Gau, Michael R.; Caroll, Patrick J.; Lawrence, Chad; Gu, Jun; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.144, no.1, pp.527 - 537, 2022-01 |
Ancillary ligand increases the efficiency of heteroleptic Ir-based triplet emitters in OLED devices Baek, Seung-yeol; Kwak, Seung-Yeon; Kim, Seoung-Tae; Hwang, Kyu Young; Koo, Hyun; Son, Won-Joon; Choi, Byoungki; et al, NATURE COMMUNICATIONS, v.11, 2020-05 |
APP-C31: An Intracellular Promoter of Both Metal-Free and Metal-Bound Amyloid-β<sub>40</sub> Aggregation and Toxicity in Alzheimer's Disease Nam, Eunju; Lin, Yuxi; Park, Jiyong; Do, Hyunsu; Han, Jiyeon; Jeong, Bohyeon; Park, Subin; et al, ADVANCED SCIENCE, v.11, no.4, 2024-01 |
Application of computational chemistry for the analysis and interpretation of complex catalytic reaction mechanisms = 계산화학을 활용한 복잡한 촉매반응의 메커니즘 규명 및 해석link Park, Bohyun; 박보현; et al, 한국과학기술원, 2023 |
Bifunctional binding of cisplatin to DNA: Why does cisplatin form 1,2-intrastrand cross-links with AG but not with GA? Mantri, Yogita; Lippard, Stephen J.; Baik, Mu-Hyun, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.129, no.16, pp.5023 - 5030, 2007-04 |
Binary role of an ylide in formation of a terminal methylidene complex of niobium Searles, Keith; Keijzer, Karlijn; Chen, Chun-Hsing; Baik, Mu-Hyun; Mindiola, Daniel J., CHEMICAL COMMUNICATIONS, v.50, no.47, pp.6267 - 6269, 2014 |
C-H Bond Addition across a Transient Uranium-Nitrido Moiety and Formation of a Parent Uranium Imido Complex Mullane, Kimberly C.; Ryu, Ho; Cheisson, Thibault; Grant, Lauren N.; Park, Ji Young; Manor, Brian C.; Carroll, Patrick J.; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.140, no.36, pp.11335 - 11340, 2018-09 |
C-H/C-C Functionalization Approach to N-Fused Heterocycles from Saturated Azacycles Ham, Jin Su; Park, Bohyun; Son, Mina; Roque, Jose B.; Jurczyk, Justin; Yeung, Charles S.; Baik, Mu-Hyun; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.142, no.30, pp.13041 - 13050, 2020-07 |
Calculation-Assisted Stereochemical Analysis of Securingine A Kang, Gyumin; Baik, Mu-Hyun; Han, Sunkyu, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.42, no.3, pp.486 - 488, 2021-03 |
Carbon Dioxide Promoted H+ Reduction Using a Bis(imino)pyridine Manganese Electrocatalyst Mukhopadhyay, Tufan K.; MacLean, Nicholas L.; Gan, Lu; Ashley, Daniel C.; Groy, Thomas L.; Baik, Mu-Hyun; Jones, Anne K.; et al, INORGANIC CHEMISTRY, v.54, no.9, pp.4475 - 4482, 2015-05 |
Carbon Dioxide-Catalyzed Stereoselective Cyanation Reaction Roy, Tamal; Kim, Myungjo J.; Yang, Yang; Kim, Suyeon; Kang, Gyumin; Ren, Xinyi; Kadziola, Anders; et al, ACS CATALYSIS, v.9, no.7, pp.6006 - 6011, 2019-05 |
Catalytic Asymmetric Dearomatization by Visible-Light-Activated [2+2] Photocycloaddition Hu, Naifu; Jung, Hoimin; Zheng, Yu; Lee, Juhyeong; Zhang, Lilu; Ullah, Zakir; Xie, Xiulan; et al, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.57, no.21, pp.6242 - 6246, 2018-04 |
Catalytic borylation of methane Smith, Kyle T.; Berritt, Simon; Gonzalez-Moreiras, Mariano; Ahn, Seihwan; Smith, Milton R., III; Baik, Mu-Hyun; Mindiola, Daniel J., SCIENCE, v.351, no.6280, pp.1424 - 1427, 2016-03 |
Catalytic Cascade Reaction To Access Cyclopentane-Fused Heterocycles: Expansion of Pd-TMM Cycloaddition Ko, Donguk; Baek, Seung-Yeol; Shim, Jae Yul; Lee, Ju Young; Baik, Mu-Hyun; Yoo, Eun Jeong, ORGANIC LETTERS, v.21, no.11, pp.3998 - 4002, 2019-06 |
Catalytic, Interrupted Carbonyl-Olefin Metathesis for the Formation of Functionalized Cyclopentadienes McAtee, Christopher C.; Nasrallah, Daniel J.; Ryu, Ho; Gatazka, Michael R.; McAtee, Rory C.; Baik, Mu-Hyun; Schindler, Corinna S., ACS CATALYSIS, v.13, no.5, pp.3036 - 3043, 2023-02 |
Charting a course for chemistry Aspuru-Guzik, Alan; Baik, Mu-Hyun; Balasubramanian, Shankar; Banerjee, Rahul; Bart, Suzanne; Borduas-Dedekind, Nadine; Chang, Sukbok; et al, NATURE CHEMISTRY, v.11, no.4, pp.286 - 294, 2019-04 |
Chemical methodologies for controlling pathogenic features in Alzheimer’s disease: computational and experimental approaches = 계산 및 실험적 접근을 통한 알츠하이머병의 병원성 요인들을 조절할 수 있는 화학적 방법론 연구link Hong, Mannkyu; 홍만규; et al, 한국과학기술원, 2021 |
Chemoselective Coupling of 1,1-Bis[(pinacolato)boryl]alkanes for the Transition-Metal-Free Borylation of Aryl and Vinyl Halides: A Combined Experimental and Theoretical Investigation Lee, Yeosan; Baek, Seung-yeol; Park, Jinyoung; Kim, Seoung Tae; Tussupbayev, Samat; Kim, Jeongho; Baik, Mu-Hyun; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.139, no.2, pp.976 - 984, 2017-01 |
Chiral Bronsted acid-controlled intermolecular asymmetric [2+2] photocycloadditions Sherbrook, Evan M.; Genzink, Matthew J.; Park, Bohyun; Guzei, Ilia A.; Baik, Mu-Hyun; Yoon, Tehshik P., NATURE COMMUNICATIONS, v.12, no.1, 2021-09 |
Chirally directed formation of nanometer-scale proline clusters Myung, Sunnie; Fioroni, Marco; Julian, Ryan R.; Koeniger, Stormy L.; Baik, Mu-Hyun; Clemmer, David E., JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.128, no.33, pp.10833 - 10839, 2006-08 |
cis,cis-[(bpy)(2)(RuO)-O-V](2)O4+ catalyzes water oxidation formally via in situ generation of radicaloid Ru-IV-O center dot Yang, X; Baik, Mu-Hyun, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.128, no.23, pp.7476 - 7485, 2006-06 |
cis-{Pt(NH3)(2)(L)}(2+/+) (L = Cl, H2O, NH3) binding to purines and CO: Does pi-back-donation play a role? Baik, Mu-Hyun; Friesner, RA; Lippard, SJ, INORGANIC CHEMISTRY, v.42, no.26, pp.8615 - 8617, 2003-12 |
Comparing the Electronic Structure of Iron, Cobalt, and Nickel Compounds That Feature a Phosphine-Substituted Bis(imino)pyridine Chelate Mena, Matthew R.; Kim, Jun-Hyeong; So, Sangho; Ben-Daat, Hagit; Porter, Tyler M.; Ghosh, Chandrani; Sharma, Anuja; et al, INORGANIC CHEMISTRY, v.61, no.17, pp.6438 - 6450, 2022-05 |
Complete Switch of Selectivity in the C-H Alkenylation and Hydroarylation Catalyzed by Iridium: The Role of Directing Groups Kim, Jiyu; Park, Sung-Woo; Baik, Mu-Hyun; Chang, Sukbok, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.137, no.42, pp.13448 - 13451, 2015-10 |
Comprehensive understanding of oxidation properties of ferrocene- and cymantrene- tagged breast cancer prodrug, Tamoxifen = 페로센 및 시만트렌이 태그된 유방암 치료제 후보물질 타목시펜의 산화 과정에 대한 개괄적 연구link Nam, Hyerim; Baik, Mu-Hyun; et al, 한국과학기술원, 2018 |
Computational and spectroscopic characterization of key intermediates of the Selective Catalytic Reduction cycle of NO on zeolite-supported Cu catalyst Crandell, Douglas W.; Zhu, Haiyang; Yang, Xiaofan; Hochmuth, John; Baik, Mu-Hyun, INORGANICA CHIMICA ACTA, v.430, pp.132 - 143, 2015-05 |
Computational design of homogeneous catalytic reactions and the molecular orbital analysis of their electronic structures = 균일 촉매 반응에 대한 계산 화학적 설계 및 전자 구조의 분자 궤도 분석link Baek, Seung-yeol; Baik, Mu-Hyun; et al, 한국과학기술원, 2021 |
Computational study of the binding of Cu(II) to Alzheimer's amyloid-beta peptide: Do A beta 42 and A beta 40 bind copper in identical fashion? Mantri, Yogita; Fioroni, Marco; Baik, Mu-Hyun, JOURNAL OF BIOLOGICAL INORGANIC CHEMISTRY, v.13, no.8, pp.1197 - 1204, 2008-11 |
Computationally Designed and Experimentally Confirmed Diastereoselective Rhodium-Catalyzed Pauson-Khand Reaction at Room Temperature Baik, Mu-Hyun; Mazumder, Shivnath; Ricci, Paolo; Sawyer, James R.; Song, Ye-Geun; Wang, Huijun; Evans, P. Andrew, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.133, no.20, pp.7621 - 7623, 2011-05 |
Computer-aided rational design of Fe(III)-catalysts for the selective formation of cyclic carbonates from CO2 and internal epoxides Sinha, Indranil; Lee, Yu Seop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min Seob; Kim, Jin; et al, CATALYSIS SCIENCE & TECHNOLOGY, v.7, no.19, pp.4375 - 4387, 2017-10 |
Computing redox potentials in solution: Density functional theory as a tool for rational design of redox agents Baik, Mu-Hyun; Friesner, RA, JOURNAL OF PHYSICAL CHEMISTRY A, v.106, no.32, pp.7407 - 7412, 2002-08 |
Conformational and Electronic Consequences in Crafting Extended, pi-Conjugated, Light-Harvesting Macrocycles Boerner, Leigh J. K.; Mazumder, Shivnath; Pink, Maren; Baik, Mu-Hyun; Zaleski, Jeffrey M., CHEMISTRY-A EUROPEAN JOURNAL, v.17, no.51, pp.14539 - 14551, 2011-12 |
Conjugate Addition of Perfluoroarenes to alpha,beta-Unsaturated Carbonyls Enabled by an Alkoxide-Hydrosilane System: Implication of a Radical Pathway Xie, Weilong; Park, Sung-Woo; Jung, Hoimin; Kim, Dongwook; Baik, Mu-Hyun; Chang, Sukbok, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.140, no.30, pp.9659 - 9668, 2018-08 |
Controlled Regulation of the Nitrile Activation of a Peroxocobalt(III) Complex with Redox-Inactive Lewis Acidic Metals Kim, Kyungmin; Cho, Dasol; Noh, Hyeonju; Ohta, Takehiro; Baik, Mu-Hyun; Cho, Jaeheung, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.143, no.30, pp.11382 - 11392, 2021-08 |
Controlling pi-pi Interactions of Highly Soluble Naphthalene Diimide Derivatives for Neutral pH Aqueous Redox Flow Batteries Singh, Vikram; Kwon, Seongyeon; Choi, Yunseop; Ahn, Seongmo; Kang, Gyumin; Yi, Yelim; Lim, Mi Hee; et al, ADVANCED MATERIALS, v.35, no.13, 2023-03 |
Conversion of methane to ethylene using an Ir complex and phosphorus ylide as a methylene transfer reagent Zatsepin, Pavel; Ahn, Seihwan; Pudasaini, Bimal; Gau, Michael R.; Baik, Mu-Hyun; Mindiola, Daniel J., CHEMICAL COMMUNICATIONS, v.55, no.13, pp.1927 - 1930, 2019-02 |
Copper clusters built on bulky amidinate ligands: spin delocalization via superexchange rather than direct metal-metal bonding Jiang, X; Bollinger, JC; Baik, Mu-Hyun; Lee, D, CHEMICAL COMMUNICATIONS, no.8, pp.1043 - 1045, 2005-02 |
Copper-Catalyzed Enantiotopic-Group-Selective Allylation of gem-Diborylalkanes Kim, Minjae; Park, Bohyun; Shin, Minkyeong; Kim, Suyeon; Kim, Junghoon; Baik, Mu-Hyun; Cho, Seung Hwan, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.143, no.2, pp.1069 - 1077, 2021-01 |
Copper-Catalyzed Regiodivergent Internal Allylic Alkylations Manna, Madhu Sudan; Yoo, Seok Yeol; Sharique, Mohammed; Choi, Hyoju; Pudasaini, Bimal; Baik, Mu-Hyun; Tambar, Uttam K., ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.62, no.35, 2023-08 |
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