Publication List

2017

[43] Dicationic Thiolate-Bridged Diruthenium Complexes for Catalytic Oxidation of Molecular Dihydrogen
  Yuki, M.; Sakata, K.; Nakajima, K.; Kikuchi, S.; Sekine, H.; Kawai, H.; Nishibayashi, Y.
  Organometallics 2017, 36, 4499-4506. [DOI]

[42] Mechanism and Reactivity of Catalytic Propargylic Substitution Reactions via Metal-Allenylidene Intermediates: A Theoretical Perspective
  Sakata, K.; Nishibayashi, Y.
  Catal. Sci. Technol. in press. [DOI] [Review]

[41] Cp*Co
III-Catalyzed C-H Alkenylation/Annulation Reactions of Indole with Alkynes: A DFT Study
  Sakata, K.; Eda, M.; Kitaoka, M.; Yoshino, T.; Matsunaga, S.
  J. Org. Chem. 2017, 82, 7379-7387. [DOI]

[40] Stereoselective Synthesis of Tetrasubstituted Alkenes via Cp*Co
III-Catalyzed C-H Alkenylation/Directing Group Migration Sequence
  Ikemoto, H.; Tanaka, R.; Sakata, K.; Kanai, M.; Yoshino, T.; Matsunaga, S.
  Angew. Chem., Int. Ed. 2017, 56, 7156-7160 [DOI]

[39] Catalytic Activity of Thiolate-Bridged Diruthenium Complexes Bearing Pendent Ether Moieties in the Oxidation of Molecular Dihydrogen
  Yuki, M.; Sakata, K.; Kikuchi, S.; Kawai, H.; Takahashi, T.; Ando, M.; Nakajima, K.; Nishibayashi, Y.
  Chem. Eur. J. 2017, 23, 1007-1012. [DOI]
  [Selected as inside cover picture[DOI]]
  [Selected as hot paper]
  chemeurj

[38] Origin of High Regio-, Diastereo-, and Enantioselectivities in 1,6-Addition of Azlactones to Dienyl N-Acylpyrroles: A Computational Study
  Yamanaka, M.; Sakata, K.; Yoshioka, K.; Uraguchi, D.; Ooi, T.
  J. Org. Chem. 2017, 82, 541-548. [DOI]

2016

[37] Origin of the
endo Selectivity in the Diels−Alder Reaction between Cyclopentadiene and Maleic Anhydride
  Sakata, K.; Fujimoto, H.
  Eur. J. Org. Chem. 2016, 4275-4278. [DOI]
  ejoc16

[36] Visible Light-Mediated Aromatic Substitution Reactions of Cyanoarenes with 4-Alkyl-1,4-dihydropyridines via Dual Carbon-Carbon Bonds Cleavage
  Nakajima,K.; Nojima, S.; Sakata,K.; Nishibayashi, Y.
  ChemCatChem, 2016, 8, 1028-1032. [DOI]
  [Selected as cover picture [DOI]]
  [cover profile [DOI]]
  CCC16


2015

[35] Iridium-Catalyzed [2+2+2] Cycloaddition of α,ω-Diynes with Cyanamides
  Hashimoto, T.; Ishii, S.; Yano, R.; Miura, H.; Sakata, K.; Takeuchi, R.
  Adv. Synth. Catal. 2015, 357, 3901-3916. [DOI]
  [Selected as back cover picture [DOI]]
  ASC15

[34] Dehydrative Direct C-H Allylation with Allylic Alcohols under [Cp*Co
III] Catalysis
  Suzuki, Y.; Sun, B.; Sakata, K.; Yoshino, T.; Matsunaga, S.; Kanai, M.
  Angew. Chem., Int. Ed. 2015, 54, 9944-9947. [DOI]

[33] Synthesis of Phosphabenzenes by Iron-Catalyzed [2+2+2] Cycloaddition Reaction of Diynes with Phosphaalkynes
  Nakajima, K; Takata, S.; Sakata,K.; Nishibayashi, Y.
  Angew. Chem., Int. Ed. 2015, 54, 7597-7601. [DOI]

[32] Thiolate-Bridged Dinuclear Ruthenium- and Iron-Complexes as Robust and Efficient Catalysts toward Oxidation of Molecular Dihydrogen in Protic Solvent
s
  Yuki, M.; Sakata, K.; Hirao, Y.; Nonoyama,N.; Nakajima, K.; Nishibayashi, Y.
  J. Am. Chem. Soc. 2015, 137, 4173-4182. [DOI]

[31] Quantum Chemical Study of the Reaction of 3-(Trimethylsilyl)cyclohexa-1,4-dienes with B(C
6F5)3
  Sakata, K.; Fujimoto, H.
  Organometallics 2015, 34, 236-241. [DOI]


2014

[30] Pyrroloindolone Synthesis via a Cp*CoIII-Catalyzed Redox-Neutral Directed C-H Alkenylation/Annulation Sequence
  Ikemoto, H.; Yoshino, T.; Sakata, K.; Matsunaga, S.; Kanai, M.
  J. Am. Chem. Soc. 2014, 136, 5424-5431. [DOI]

[29] Synthesis and Characterization of Binary-Complex Models of Ureas and 1,3-Dicarbonyl Compounds: Deeper Insights into Reaction Mechanisms using Snap-Shot Structural Analysis
  Azuma, T.; Kobayashi, Y.; Sakata, K.; Sasamori, T.; Tokitoh, N.; Takemoto, Y.
  J. Org. Chem. 2014, 79, 1805-1817. [DOI]


2013

[28] Quantum Chemical Study of B(C
6F5)3-Catalyzed Hydrosilylation of Carbonyl Group
  Sakata, K.; Fujimoto, H.
  J. Org. Chem. 2013, 78, 12505-12512. [DOI]

[27] Quantum Chemical Study of Diels-Alder Reactions Catalyzed by Lewis Acid
Activated Oxazaborolidines
  Sakata, K.; Fujimoto, H.
  J. Org. Chem. 2013, 78, 3095-3103. [DOI]

[26] Ruthenium-Triggered Ring-Opening of Ethynylcyclopropanes: [3+2] Cycloaddition with Aldehydes and Aldimines Involving Metal-Allenylidene Intermediates
  Miyake, Y.; Endo, S.; Moriyama, T.; Sakata, K.; Nishibayashi, Y.
  Angew. Chem., Int. Ed. 2013, 52, 1758-1762. [DOI]
  [Highlighted in Synfacts, 2013, 05]


2012

[25] Iridium-Catalyzed [2+2+2] Cycloaddition of α,ω-Diynes with Nitriles
  Onodera, G.; Shimizu, Y.; Kimura, J.; Kobayashi, J.; Ebihara, Y.; Kondo, K.; Sakata, K.; Takeuchi, R.
  J. Am. Chem. Soc. 2012, 134, 10515-10531. [DOI]


2010

[24] Copper-Catalyzed Enantioselective Propargylic Amination of Propargylic Esters with Amines: Copper-Allenylidene Complexes as Key Intermediates
  Hattori, G.; Sakata, K.; Matsuzawa, H.; Tanabe, Y.; Miyake, Y.; Nishibayashi, Y.
  J. Am. Chem. Soc. 2010, 132, 10592-10608. [DOI]

[23] Qauntum-Chemical Study of Neutral Lewis Base Catalyzed Allylation of Aldehydes with Allyltrichlorosilanes
  Sakata, K.; Fujimoto, H.
  Organometallics 2010, 29, 1004-1011. [DOI]


2009

[22] A DFT Study on the Reaction Pathway for Carbon-Carbon Bond Forming Reactions between Propargylic Alcohols and Alkenes or Ketones Catalyzed by Thiolate-Bridged Diruthenium Complexes
  Sakata, K.; Miyake, Y.; Nishibayashi, Y.
  Chem. Asian J. 2009, 4, 81-88. [DOI]


2008

[21] Quantum Chemical Study of Lewis Acid Catalyzed Allylboration of Aldehydes
  Sakata, K.; Fujimoto, H.
  J. Am. Chem. Soc. 2008, 130, 12519-12526. [DOI]

[20] Ruthenium-Catalyzed Dienyne Formation from Propargylic Alcohols and 1,3-Conjugated Dienes
  Daini, M.; Yoshikawa, M.; Inada, Y.; Uemura, S.; Sakata, K.; Kanao, K.; Miyake, Y.; Nishibayashi, Y.
  Organometallics 2008, 27, 2046-2051. [DOI]


2007

[19] Ruthenium-Catalyzed Reactions of 1-Cyclopropyl-2-propyn-1-ols with Anilines and Water via Allenylidene Intermediates: Selective Preparation of Tri- and Tetrasubstituted Conjugated Enynes
  Yamauchi, Y.; Onodera, G.; Sakata, K.; Yuki, M.; Miyake, Y.; Uemura, S.; Nishibayashi, Y
  J. Am. Chem. Soc. 2007, 129, 5175-5179. [DOI]


2006

[18] An Attempt to Decompose the Force Constants for Some Diatomic Molecules by the Derivatives of the Electronic Kinetic Energy
  Sakata, K.
  Theor. Chem. Acc. 2006, 115, 270-276. [DOI]

[17] Ab Initio Study of Molecular Structures and Excited States in Anthocyanidins
  Sakata, K.; Saito, N.; Honda, T.
  Tetrahedron 2006, 62, 3721-3731. [DOI]


2005
[16] Quantum Chemical Study of the Torsional Motions for 9-Vinylanthracene
  Sakata, K.
  Chem. Phys. 2005, 312, 69-80. [DOI]

[15] Studies toward the Synthesis of Furanocembrane Bipinnatin J: Synthesis of a 2,3,5-Trisubstituted Furfuryl Ether Intermediate
  Tsubuki, M.; Takahashi, K.; Sakata, K.; Honda, T.
  Heterocycles 2005, 65, 531-540.


2003

[14] Ab initio Study of the Torsional Potential for 9-Phenylanthracene in the Ground and Excited States
  Sakata, K; Hara, K.
  Chem. Phys. Lett. 2003, 371, 164-171. [DOI]


2002

[13] Aromaticity/Antiaromaticity in Cyclic Conjugated Hydrocarbons
  Ichikawa, H.; Sakata, K.
  Int. J. Quantum Chem. 2002, 87, 135-144.[DOI]


2001

[12] Ab initio Calculation of the Torsional Potential for 2-Alkenylanthracene in the Ground and Excited States
  Sakata, K.; Kometani, N.; Hara, K.
  Chem. Phys. Lett. 2001, 344, 185-192. [DOI]


2000

[11] Electron Reorganization along the Intrinsic Reaction Coordinate in 1,3-Dipolar Cycloaddition
  Sakata, K.
  J. Phys. Chem. A 2000, 104, 10001-10008. [DOI]

[10] Quantum-Chemical Study on the Reaction between GeF
4 and Si2H6
  Sakata, K.; Tachibana, A.
  Chem. Phys. Lett. 2000, 320, 527-534.[DOI]

[9] Quantum Chemical Mechanism of Oxidation of the Hydrogen-Terminated Si Surface by Oxygen Anion
  Sakata, K.; Sato, T.; Nakamura, K.; Osamura, A.; Tachibana, A.
  Appl. Surf. Sci. 2000, 159/160, 392-397.[DOI]

[8] Theoretical Study of Penetration Reaction of Fluorine Atoms and Ions into Hydrogen-Terminated Si(111) Thin Film
  Makino, O.; Sakata, K.; Yamazaki, H.; Iguchi, K.; Tachibana, A.
  Thin Solid Films 2000, 374, 143-149.[DOI]


1999

[7] Application of the Regional Density Functional Theory: The Chemical Potential Inequality in the HeH
+ System
  Tachibana, A.; Nakamura, K.; Sakata, K.; Morisaki, T.
  Int. J. Quantum Chem. 1999, 74, 669-679.[DOI]


1998

[6] Quantum Chemical Study of the Oxidation Sites in Hydrogen- and Water-Terminated Si Dimers: Attempt to Understand the Si−Si Back-Bond Oxidation on the Si Surface
  Sakata, K.; Tachibana, A.; Zaima, S.; Yasuda, Y.
  Jpn. J. Appl. Phys. 1998, 37, 4962-4973.[DOI]

[5] Quantum Chemical Study on the Oxidation of Hydrogen Terminated Silicon Surface by Oxygen Anions
  Tachibana, A.; Sakata, K.; Sato, T.
  Jpn. J. Appl. Phys. 1998, 37, 4493-4504.[DOI]


1997

[4] Quantum Chemical Study on Low Energy Reaction Path for SiH
4 + O(1D) → SiO + 2H2
  Tachibana, A.; Sakata, K.
  Appl. Surf. Sci. 1997, 117/118, 151-157.[DOI]

[3] Quantum Chemical Study on Aluminum Selective CVD Reaction Mechanism
  Tachibana, A.; Sakata, K.; Omoto, K.
  Appl. Surf. Sci. 1997, 117/118, 465-471.[DOI]

[2] Quantum Chemical Study on p-Doping Effect of F-Terminated Silicon Surface Reaction with Silane
  Tachibana, A.; Sakata, K.
  Appl. Surf. Sci. 1997, 117/118, 54-60.[DOI]


1996

[1] Transient Bonds and Chemical Reactivity of Molecules
  Fujimoto, H.; Sakata, K.; Fukui, K.
  Int. J. Quantum Chem. 1996, 60, 401-408.[DOI]