Zobrazeno 1 - 10
of 16
pro vyhledávání: '"Noriaki Ochi"'
Publikováno v:
The Journal of Physical Chemistry A. 114:659-665
The {2 + 2} cycloaddition of alkyne across the Ti=N bond of [(H(3)SiO)(2)Ti(=NSiH(3))] 1 was theoretically investigated. Though this cycloaddition is symmetry forbidden in a formal sense by the Woodward-Hoffmann rule, the cycloaddition of 2-butyne (M
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0948ba9fdc82bd2fdccdf82f97ddd7ce
https://doi.org/10.1021/jp908465b
https://doi.org/10.1021/jp908465b
Publikováno v:
Canadian Journal of Chemistry. 87:1415-1424
The O–H σ-bond activation of methanol, the Si–H σ-bond activation of silane, and the Si–C σ-bond activation of methylsilane by titanium(IV)–imido complex (Me3SiO)2Ti(NSiMe3) were theoretically investigated with DFT and MP2 to MP4(SDQ) meth
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5d6649055a964c2ac87461d9cb382274
https://doi.org/10.1139/v09-113
https://doi.org/10.1139/v09-113
Autor:
Yoshihiro Matano, Yoshihide Nakao, Shigeyoshi Sakaki, Noriaki Ochi, Hiroshi Imahori, Hirofumi Sato
Publikováno v:
Journal of the American Chemical Society. 131:10955-10963
The palladium complex of P,S-containing hybrid calixphyrin 1 was investigated with the DFT method. There are two kinds of valence tautomer in 1: one is a Pd(II) form in which the calixphyrin moiety possesses -2 charges and the Pd center takes +2 oxid
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::05cc9d0f04c0d3052c37b63f4ede35f9
https://doi.org/10.1021/ja901166a
https://doi.org/10.1021/ja901166a
Autor:
Koichi Sakajiri, Katsuhiro Maeda, Yoko Hase, Kento Okoshi, Noriaki Ochi, Eiji Yashima, Kanji Nagai, Hiroki Iida, Kyoichi Sawabe
Publikováno v:
Journal of American Chemical Society. 131:10719-10732
An optically inactive poly(4-carboxyphenyl isocyanide) (poly-1-H) changed its structure into the prevailing, one-handed helical structure upon complexation with optically active amines in dimethylsulfoxide (DMSO) and water, and the complexes show a c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0551d5273e06d4d37b691cec25979bde
http://t2r2.star.titech.ac.jp/cgi-bin/publicationinfo.cgi?q_publication_content_number=CTT100599420
http://t2r2.star.titech.ac.jp/cgi-bin/publicationinfo.cgi?q_publication_content_number=CTT100599420
Autor:
Yoshihiro Matano, Noriaki Ochi, Yoshihide Nakao, Tooru Miyajima, Hiroshi Imahori, Shigeyoshi Sakaki
Publikováno v:
The Journal of Organic Chemistry. 73:5139-5142
The synthesis, structure, and optical and electrochemical properties of thiophene-containing hybrid calixphyrins are reported. The 5,10-porphodimethene type 14pi- and 16pi-S,N2,X-hybrid calixphyrins (X = NH, O, S) were prepared by acid-promoted dehyd
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::592a3223020675c44d4f82b92ff1c552
https://doi.org/10.1021/jo800532n
https://doi.org/10.1021/jo800532n
Autor:
Yoshihiro Matano, Motoo Shiro, Tooru Miyajima, Shigeyoshi Sakaki, Yoshihide Nakao, Noriaki Ochi, Takashi Nakabuchi, Hiroshi Imahori
Publikováno v:
Journal of the American Chemical Society. 130:990-1002
The syntheses, structures, and coordination chemistry of phosphole-containing hybrid calixphyrins (P,N2,X-hybrid calixphyrins) and the catalytic activities of their transition-metal complexes are reported. The 5,10-porphodimethene type 14pi-P,(NH)2,X
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4980c38bffba3bd4ef92d9f11a3bb8a4
https://doi.org/10.1021/ja076709o
https://doi.org/10.1021/ja076709o
Publikováno v:
Journal of the American Chemical Society. 129:8131-8138
The oxidation process by molybdenum-containing enzyme, xanthine oxidase, is theoretically studied with a model complex representing the reaction center and a typical benchmark substrate, formamide. Comparisons were systematically made among reaction
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6064cd73419b7d324773fc1b16acda95
https://doi.org/10.1021/ja068584d
https://doi.org/10.1021/ja068584d
Autor:
Yoshihide Nakao, Shigeyoshi Sakaki, Kazuyuki Tatsumi, Hirofumi Sato, Noriaki Ochi, Tsuyoshi Matsumoto, Takeya Dei
Publikováno v:
Inorganic chemistry. 54(2)
Heterolytic activation of dihydrogen molecule (H2) by hydroxo-/sulfido-bridged ruthenium-germanium dinuclear complex [Dmp(Dep)Ge(μ-S)(μ-OH)Ru(PPh3)](+) (1) (Dmp = 2,6-dimesitylphenyl, Dep = 2,6-diethylphenyl) is theoretically investigated with the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c1dfbe73f5fab21528dafb80e3de249a
https://pubmed.ncbi.nlm.nih.gov/25559259
https://pubmed.ncbi.nlm.nih.gov/25559259
Publikováno v:
Computational Modeling for Homogeneous and Enzymatic Catalysis: A Knowledge-Base for Designing Efficient Catalysts
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::615b1c68dc204df0ca147c5c21695677
https://doi.org/10.1002/9783527621965.ch12
https://doi.org/10.1002/9783527621965.ch12
Publikováno v:
Journal of the American Chemical Society. 129(27)
The C-H sigma-bond activation of methane and the N-H sigma-bond activation of ammonia by (Me3SiO)2Ti(=NSiMe3) 1 were theoretically investigated with DFT, MP2 to MP4(SDQ), and CCSD(T) methods. The C-H sigma-bond activation of methane takes place with
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f48bf76b69500bde0e47387275a47b33
https://pubmed.ncbi.nlm.nih.gov/17579411
https://pubmed.ncbi.nlm.nih.gov/17579411