[読みたい論文] アリル鉛化合物: πかメタラサイクルかそれともσか?

Viewed: 03:15:11 in December 11, 2019

Posted: August 26, 2019

Low valent lead hydride chemistry: hydroplumbylation of phenylacetylene and 1,1-dimethylallene (Weiß, Sebastian; Schubert, Hartmut; Wesemann, Lars)Chem. Commun. 2019, 55 (69), 10238−10240.

Keywords: Pb; allene; 1,1-dimethylallene; phenylacetylene; Tipp


plumbyleneかあ…。この言葉は現役時代には出会わなかった。

鉛(II)ヒドリドと不飽和炭化水素の反応と生成物の構造に関する論文のようです。

不飽和炭化水素がフェニルアセチレンの場合には、生成ぶtの構造は一般的な付加反応と大差はないようですが、アレン化合物との反応の場合にはGraphical abstractにあるようなメタラサイクル、つまり、3角形の環構造を持つようなのが生成するとあります。その一方で要旨テキストには"allyl plumbylene"。π錯体なのか「3角形」なのかσ化合物なのか気になります。

Supporting informationにあるCIFファイルを可視化し、アリル鉛構造の部分を拡大したものが下の画像ですが、これはσアリル構造っぽく見えますね。


本文中で著者達がこの構造からどのような考察をしているのか知りたいので、読みたい論文に追加です。

この記事を書いた人
「牧岡ふうふ堂」オーナー。博士(工学)。
酒都圏在住。
某地方の国立系工業大学でアシスタントをしていました。 専門は有機反応・金属錯体(主に希土類)・π共役系。
twitterアカウントは@makiokafufudo(お仕事用)、@ymakioka(個人用)です。

 

1971年はこんな年

人名反応など
Abramov反応 [Doi 1]
Hajos−Parris−Eder−Sauer−Wiechert反応Kochiクロスカップリング [Doi 1]
Masamune−Bergman環化 [Doi 1] [Doi 2]
Minisci反応 [Doi 1]
Mizoroki−Heck反応 [Doi 1] [Doi 2]
Seyferth−Gilbert反応 [Doi 1] [Doi 2]
ノーベル化学賞
遊離基の電子構造と幾何学的構造の研究
(Gerhard Herzberg)
できごと
世界経済フォーラム(WEF)設立。ダボス会議。
アスワンダム公式開通
「新婚さんいらっしゃい!」放送開始(朝日放送)
「セキスイハイム」発売(積水化学工業)
NASDAQによる証券取引はじまる
多摩ニュータウンの入居が始まる
自動車などの6業種の資本自由化実施
「ゴールデン洋画劇場」放映開始(フジテレビ)
「仮面ライダー」放映開始
「non-no」創刊(集英社)
ノエビア設立
環境庁発足
マクドナルド銀座店オープン
プリンスホテル設立
ニクソン・ショック
円変動相場制移行
「サッポロ一番塩らーめん」発売(サンヨー食品)
「小枝」発売(森永製菓)
「カップヌードル」発売(日清食品)
第一勧業銀行発足
「マジックリン」発売(花王石鹸=花王)
「スター誕生!」放送開始(日本テレビ)
「テレビマガジン」創刊(講談社)
川崎ローム斜面崩壊実験事故
ソ連の火星探査機マルス2号が火星に衝突
スミソニアン体制発足

 

きょうのどうぶつ

ここの画像を使用しています。

オッドアイっぽいシロクロ。

 

計算終わりました

 

あわせてどうぞ

SOHOのすすめ記事一覧 2019年
お仕事関係の記事のリストです(2019年)。

読みたい論文シリーズ− 2019年3Q
読みたいけと読んでいない論文を、構造式を描きながら紹介します(2019年7〜9月)。

 

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触媒反応ならなお良かった。
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御大の名前入り論文。
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限られた人だけが扱える有機金属化合物。
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フッ素化合物の宿命。
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注目のWebコンテンツ

医療ビッグデータで免疫チェックポイント阻害剤誘発副作用のハイリスク患者を明らかに
(徳島大学)
https://www.tokushima-u.ac.jp/...

雲の中の
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http://murai-kun.cocolog-nifty...

2017年10月初め
(村井君のブログ)
http://murai-kun.cocolog-nifty...

化学反応における微量中間体の直接構造解析に成功
(JST)
https://www.jst.go.jp/pr/annou...

気体を安全に加圧可能な高圧反応装置の開発 〜不活性な気体資源の有効活用に道筋〜
(JST)
https://www.jst.go.jp/pr/annou...

気候変動に伴う波浪の将来変化予測に成功 −地球温暖化の沿岸域への影響を定量化−
(京都大学)
http://www.kyoto-u.ac.jp/ja/re...

8月学会 その2
(ある女性研究者の日記)
https://sunnily.exblog.jp/3075...

化学反応における微量中間体の直接構造解析に成功
(東京大学)
https://www.s.u-tokyo.ac.jp/ja...

幸福の脳活動を解明 −大脳右楔前部の安静時活動が低いほど主観的幸福得点が高い−
(京都大学)
http://www.kyoto-u.ac.jp/ja/re...

研究成果展開事業 研究成果最適展開支援プログラム(A−STEP) 「産学共同フェーズ(シーズ育成タイプ)」 2019年度募集における新規採択課題の決定について
(JST)
https://www.jst.go.jp/pr/info/...

思春期特発性側弯症の発症に関わる遺伝子座を同定 −世界最大規模の研究コホートで解明進む−
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http://www.riken.jp/pr/press/2...

O157などの腸管出血性大腸菌の出現機構を解明 -安全な食肉生産による感染予防に期待-
(九州大学)
http://www.kyushu-u.ac.jp/f/36...

膵臓がんの進行を抑制する新種の細胞を発見 ~ がん細胞の周囲環境を変える新規治療法の開発に期待 ~
(名古屋大学)
https://www.med.nagoya-u.ac.jp...

世界初、360度方向に連続的に移動可能な円形断面型クローラーを開発 ―柔らかい絨毯や点字ブロックの上でも、向きを変えずにスムーズに移動―
(NEDO)
https://www.nedo.go.jp/news/pr...

ウェルプレート毎の培養細胞をリアルタイム、 かつ一括でモニタリングできる装置の実用試験を開始
(熊本大学)
https://www.kumamoto-u.ac.jp/d...

世界初、360度方向に連続的に移動可能な円形断面型クローラーを開発 ―柔らかい絨毯や点字ブロックの上でも、向きを変えずにスムーズに移動―
(東北大学)
https://www.tohoku.ac.jp/japan...
NEDOと東北大学は、全方向(360度方向)への連続移動を実現した円形断面型クローラーの開発に世界で初めて成功しました。…

不活性!?生態系を循環する窒素 〜液体窒素の実験〜
(高純度化学研究所)
https://www.kojundo.blog/exper...

南極の海洋生物起源の硫酸塩エアロゾルは氷期に減少していた 南極ドームふじアイスコア分析データの解析から
(東京工業大学)
https://www.titech.ac.jp/news/...
国立極地研究所(所長:中村卓司(なかむらたくじ))の東久美子(あずまくみこ)教授を中心とする研究グループは、南極のドームふじで掘削されたアイスコア(図1)のイオン分析データを用いて、南極海の植物プランクトンに由来する硫酸塩エアロゾルの変動を、過去72万年間にわたって推定しました。…

DNAのような高分子は
(村井君のブログ)
http://murai-kun.cocolog-nifty...

 

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Tag: CS, SC

[J. Phys. Chem. Lett. 20190823105725, 2019, 16−4752]
Enhanced Dissociation of Hot Excitons with an Applied Electric Field under Low-Power Photoexcitation in Two-Dimensional Perovskite Quantum Wells
(Kattoor, Vidya; Awasthi, Kamlesh; Jokar, Efat; Diau, Eric Wei-Guang; Ohta, Nobuhiro)
Tag: EF, PV, PL, EEF, QW, TF, P

[J. Phys. Chem. Lett. 2019082310585, 2019, 16−4499]
Ultrafast Internal Conversion and Solvation of Electrons in Water, Methanol, and Ethanol
(Karashima, Shutaro; Yamamoto, Yo-ichi; Suzuki, Toshinori)
Tag: BE, IC, PE, TR, CH3CH2OH, BDE, GS, PS, CH3OH, e-, EBE, EtOH

ナノ結晶  
[J. Phys. Chem. Lett. 20190823110134, 2019, 16−4731]
Ionization and Neutralization Dynamics of CsPbBr3 Perovskite Nanocrystals Revealed by Double-Pump Transient Absorption Spectroscopy
(Nakahara, Satoshi; Ohara, Keiichi; Tahara, Hirokazu; Yumoto, Go; Kawawaki, Tokuhisa; Saruyama, Masaki; Sato, Ryota; Teranishi, Toshiharu; Kanemitsu, Yoshihiko)
Tag: AR, TAS, QE, PL, TA, ABS, NC, P

[J. Org. Chem. 20190823110217, 2019, 16−9850]
Theoretical Study on the Geometry, Aromaticity, and Electronic Properties of Benzo[3,4]cyclobutathiophenes and Their Homologues
(Hashimoto, Shingo; Tahara, Kazukuni)
Tag: NICS, UMO, TP, TPH, HC, MO, PhH, BZ, CS, e-, DFT

[J. Org. Chem. 2019082311045, 2019, 16−9957]
Two-Step Transformation of Aliphatic Polyketones into Ï?-Conjugated Polyimines
(Manabe, Yumehiro; Uesaka, Mitsuharu; Yoneda, Tomoki; Inokuma, Yasuhide)
Tag: PK, SS, 562-49-2, ABS, 302-01-2, C2H4

[J. Org. Chem. 2019082311057, 2019, 16−10024]
Unexpected Propargylic Retro-Brook Rearrangements in Alkynes
(Wang, Xiao; Gao, Qi; Buevich, Alexei V.; Yasuda, Nobuyoshi; Zhang, Yonglian; Yang, Rong-Sheng; Zhang, Li-Kang; Martin, Gary E.; Williamson, R. Thomas)
Tag: C, O, RLS, GS, DFT

[Langmuir 20190823111435, 2019, 33−10762]
Water Filling and Emptying Kinetics in Two-Dimensional Hexagonal Mesoporous Silica of the Same Pore Diameter but Different Pore Lengths
(Hwang, Junho; Yanagita, Kosuke; Sakamoto, Kazuki; Hsu, Wei-Lun; Kataoka, Sho; Endo, Akira; Daiguji, Hirofumi)
Tag: MS, PD, HEX, Hx, HMS

ナノ粒子  
[Langmuir 2019082311160, 2019, 33−10846]
Bioinspired Approach to Silica Nanoparticle Synthesis Using Amine-Containing Block Copoly(vinyl ethers): Realizing Controlled Anisotropy
(Sugawara-Narutaki, Ayae; Tsuboike, Sachio; Oda, Yukari; Shimojima, Atsushi; Landenberger, Kira B.; Okubo, Tatsuya; Aoshima, Sadahito)
Tag: IBVE, HBNP, NH2, i-Bu, iBu, VE, NP, SNP, HNP

液晶  
[Langmuir 20190823111625, 2019, 33−10877]
Molecular Behavior of Linear Alkylbenzene Sulfonate in Hydrated Crystal, Tilted Gel, and Liquid Crystal Phases Studied by Molecular Dynamics Simulation
(Takeda, Kosuke; Andoh, Yoshimichi; Shinoda, Wataru; Okazaki, Susumu)
Tag: Lam, PPL, PhH, BZ, Na, MDS, MD, LC, LAS, LAB, Alk

液晶 酸化グラフェン  
[Langmuir 20190823111649, 2019, 33−10900]
Polymer-Brush-Decorated Graphene Oxide: Precision Synthesis and Liquid-Crystal Formation
(Ohno, Kohji; Zhao, Chenzhou; Nishina, Yuta)
Tag: SI, LLC, R, In, MMA, ATRP, RP, LC, ATR, GO, Me, MWD

ナノファイバー  
[Langmuir 20190823111721, 2019, 33−10920]
Dual Functions of TEMPO-Oxidized Cellulose Nanofibers in Oil-in-Water Emulsions: A Pickering Emulsifier and a Unique Dispersion Stabilizer
(Goi, Yohsuke; Fujisawa, Shuji; Saito, Tsuguyuki; Yamane, Kenichi; Kuroda, Katsushi; Isogai, Akira)
Tag: CC, IFT, TEMPO, NF, O/W, OTS, e-, CNF, IFT

[Inorg. Chem. 20190823111838, 2019, 16−10436]
Celebrating the Year of the Periodic Table: Emerging Investigators in Inorganic ChemistryElectrochemical and Spectroscopic Behaviors of a Novel Ruthenium(II) Complex with a Six-Membered Chelate Structure
(Dempsey, Jillian L.; Lancaster, Kyle M.; Ito, Akitaka; Matsui, Yushi)
Tag: EC, MLCT, CT, MCLT, ABS

ルテニウム  
[Inorg. Chem. 20190823112230, 2019, 16−10656]
2D Molecular Superconductor to Insulator Transition in the Î′′-(BEDT-TTF)2[(H2O)(NH4)2M(C2O4)3]·18-crown-6 Series (M = Rh, Cr, Ru, Ir)
(Morritt, Alexander L.; Lopez, Jordan R.; Blundell, Toby J.; Canadell, Enric; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee)
Tag: SC, Ir, Ru, R, e-

[Inorg. Chem. 2019082311245, 2019, 16−10743]
High-Spin and Incomplete Spin-Crossover Polymorphs in Doubly Chelated [Ni(L)2Br2] (L = tert-Butyl 5-Phenyl-2-pyridyl Nitroxide)
(Kyoden, Yukiya; Homma, Yuta; Ishida, Takayuki)
Tag: SCO, HS, SC, R, as, Pyr, tBu, t-Bu, Bu, SG, GS, Ph, DFT

[Inorg. Chem. 20190823112429, 2019, 16−10769]
In-Depth Theoretical Probe into Novel Mixed-Metal Uranium-Based Endohedral Clusterfullerenes Sc2[email protected]Ih(31924)-C80 (X = C, N)
(Zhao, Yao-Xiao; Yuan, Kun; Li, Meng-Yang; Ehara, Masahiro; Zhao, Xiang)
Tag: QTAIM, U, FMO, ET, ES, MO, AIMD, DB, MDS, MD, AIM, AIM, ABMD, NBO, e-, DFT

[Inorg. Chem. 20190823112644, 2019, 16−10890]
Site-Selective Doping and Site-Sensitive Photoluminescence of Eu3+ and Tb3+ in Perovskite-Type LaLuO3
(Ueda, Kazushige; Tanaka, Syuto; Yoshino, Takuma; Shimizu, Yuhei; Honma, Tetsuo)
Tag: CT, PL, NEXAFS, XANES, XR, CF, UC, ABS, XRD, P, CTT

層状複水酸化物  
[Inorg. Chem. 20190823112728, 2019, 16−10928]
Why Do Carbonate Anions Have Extremely High Stability in the Interlayer Space of Layered Double Hydroxides? Case Study of Layered Double Hydroxide Consisting of Mg and Al (Mg/Al = 2)
(Sasai, Ryo; Sato, Hiroaki; Sugata, Mako; Fujimura, Takuya; Ishihara, Shinsuke; Deguchi, Kenzo; Ohki, Shinobu; Tansho, Masataka; Shimizu, Tadashi; Oita, Naoto; Numoto, Mako; Fujii, Yasuhiro; Kawaguchi, Shogo; Matsuoka, Yoshiki; Hagura, Koki; Abe, Tomohiro; Moriyoshi, Chikako)
Tag: Ra, SR, SS, LDH, XR, LDH, XRD

[Inorg. Chem. 20190823112747, 2019, 16−10936]
Phosphorescent Material Search Using a Combination of High-Throughput Evaluation and Machine Learning
(Hazama, Hirofumi; Sobue, Susumu; Tajima, Shin; Asahi, Ryoji)
Tag: HT, RMSE, MSE, ML, TF

[Anal. Chem. 20190823113555, 2019, 16−10432]
Improved Atomic Force Microscopy Stiffness Measurements of Nanoscale Liposomes by Cantilever Tip Shape Evaluation
(Takechi-Haraya, Yuki; Goda, Yukihiro; Izutsu, Kenichi; Sakai-Kato, Kumiko)
Tag: AF, AR, STD, RSD, SD, Chol, AFM

[Anal. Chem. 20190823113640, 2019, 16−10484]
High Sensitivity Monitoring Device for Onboard Measurement of Dimethyl Sulfide and Dimethylsulfoniopropionate in Seawater and an Oceanic Atmosphere
(Okane, Daiki; Koveke, Edwin P.; Tashima, Koya; Saeki, Kentaro; Maezono, Seiya; Nagahata, Takanori; Hayashi, Norio; Owen, Kylie; Zitterbart, Daniel P.; Ohira, Shin-Ichi; Toda, Kei)
Tag: S, CL, DL, DMSP, IMR, FPD, DMS, GS

[Anal. Chem. 2019082311388, 2019, 16−10549]
Sequencing of Sulfopeptides Using Negative-Ion Tandem Mass Spectrometry with Hydrogen Attachment/Abstraction Dissociation
(Asakawa, Daiki; Takahashi, Hidenori; Sekiya, Sadanori; Iwamoto, Shinichi; Tanaka, Koichi)
Tag: PTM, LC, H, R, ESI, Mat, MALDI, MS2, MS/MS, MS

[Anal. Chem. 20190823113830, 2019, 16−10557]
Quantitative Measurements of Intercellular Adhesion Strengths between Cancer Cells with Different Malignancies Using Atomic Force Microscopy
(Kim, Hyonchol; Ishibashi, Kenta; Matsuo, Kosuke; Kira, Atsushi; Okada, Tomoko; Watanabe, Kenta; Inada, Masaki; Nakamura, Chikashi)
Tag: AF, BCC, AFM

[Anal. Chem. 20190823113831, 2019, 16−10564]
Ultrasensitive Single Cell Metabolomics by Capillary Electrophoresis–Mass Spectrometry with a Thin-Walled Tapered Emitter and Large-Volume Dual Sample Preconcentration
(Kawai, Takayuki; Ota, Nobutoshi; Okada, Kaori; Imasato, Akiko; Owa, Yuri; Morita, Makiko; Tada, Misa; Tanaka, Yo)
Tag: STD, LOD, RSD, SD, TOF, AA, ESI, ITP, QTof, TQ, SCA

イオン液体  
[RSC Adv. 20190823115016, 2019, 43−24922]
Physicochemical compatibility of highly-concentrated solvate ionic liquids and a low-viscosity solvent
(Takahashi, Keitaro; Ishino, Yuki; Murata, Wataru; Umebayashi, Yasuhiro; Tsuzuki, Seiji; Watanabe, Masayoshi; Takaba, Hiromitsu; Seki, Shiro)
Tag: IL, SIL

[RSC Adv. 2019082311548, 2019, 43−25177]
Mechanistic study on substitution reaction of a citrato(p-cymene)Ru(II) complex with sulfur-containing amino acids
(Aizawa, Sen-ichi; Takizawa, Kohei; Aitani, Momoko)
Tag: AA, S

[J. Phys. Chem. C 20190823121617, 2019, 32−19269]
Room-Temperature Hydrogen Absorption of Titanium with Surface Modification by Organic Solvents
(Shinzato, Keita; Hamamoto, So; Miyaoka, Hiroki; Ichikawa, Takayuki)
Tag: PE, H, Ti, XPS, O, DMK, ABS, PS, ACE, C

[J. Phys. Chem. C 20190823121623, 2019, 32−19275]
Carrier Recombination and Diffusion in Wet-Cast Tin Iodide Perovskite Layers Under High Intensity Photoexcitation
(Å Äajev, Patrik; Aleksieju?nas, Ramu?nas; Baronas, Paulius; Litvinas, DÅiugas; Kolenda, Marek; Qin, Chuanjiang; Fujihara, Takashi; Matsushima, Toshinori; Adachi, Chihaya; JurÅÄnas, Saulius)
Tag: TRPL, SE, ASE, TR, PL, QY, em, Sn, TG, NIR, LE, MHP, LHP, P, IR

[J. Phys. Chem. C 2019082312171, 2019, 32−19307]
Intrinsic and Extrinsic Defects in Layered Nitride Semiconductor SrTiN2
(He, Xinyi; Xiao, Zewen; Katase, Takayoshi; Ide, Keisuke; Hosono, Hideo; Kamiya, Toshio)
Tag: CB, CBM, ETL, H, SC, e-, DFT

[J. Phys. Chem. C 20190823121923, 2019, 32−19447]
Photoelectrochemical Reaction in an Electric Cell with a Porous Carbon Anode
(Kaizu, Toshiyuki; Kawajiri, Yousuke; Enomoto, Masahito; Uchino, Takashi; Mizuhata, Minoru; Ichihashi, Yuichi; Taniya, Keita; Nishiyama, Satoru; Sugiyama, Masakazu; Ueno, Masami; Kita, Takashi)
Tag: PEC, Pv, TP, C, Pt, PEC, e-, CD

[J. Phys. Chem. C 2019082312204, 2019, 32−19486]
Scaling Relation of Oxygen Reduction Reaction Intermediates at Defective TiO2 Surfaces
(Yamamoto, Yoshiyuki; Kasamatsu, Shusuke; Sugino, Osamu)
Tag: O, OV, Ovac, C, ORR

CO酸化  
[J. Phys. Chem. C 20190823122136, 2019, 32−19557]
Ultra-Low-Temperature CO Oxidation Activity of Octahedral Site Cobalt Species in Co3O4 Based Catalysts: Unravelling the Origin of the Unique Catalytic Property
(Baidya, Tinku; Murayama, Toru; Nellaiappan, Subramanian; Katiyar, Nirmal Kumar; Bera, Parthasarathi; Safonova, Olga; Lin, Mingyue; Priolkar, Kaustubh R.; Kundu, Samapti; Rao, Bolla Srinivasa; Steiger, Patrick; Sharma, Sudhanshu; Biswas, Krishanu; Pradhan, Swapan Kumar; Lingaiah, Nakka; Malviya, Kirtiman Deo; Haruta, Masatake)
Tag: EC, O, Co, COO, C, Cat

[J. Phys. Chem. C 20190823122617, 2019, 32−19786]
Variations in Atomic-Scale Step Edge Structures and Dynamics of Dissolving Calcite in Water Revealed by High-Speed Frequency Modulation Atomic Force Microscopy
(Miyata, Kazuki; Kawagoe, Yuta; Tracey, John; Miyazawa, Keisuke; Foster, Adam S.; Fukuma, Takeshi)
Tag: AF, C, ML, MDS, MD, IS, AFM

ナノ粒子  
[J. Phys. Chem. C 20190823122846, 2019, 32−19920]
Corrosion of Gold by a Nanoscale Gold and Copper Beltlike Structure
(Sawada, Hidetaka; Borisenko, Konstantin B.; Shima, Masahide; Ikita, Konomi; Hashiguchi, Hiroki; Onishi, Ichiro; Okunishi, Eiji; Kirkland, Angus I.)
Tag: GNP, AuNP, Au, Cu, O, EM, SC, HREM, NP, OSC, e-, OFC, DFT

ナノ結晶 量子ドット  
[J. Phys. Chem. C 20190823122854, 2019, 32−19927]
Temperature-Dependent Electroabsorption and Electrophotoluminescence and Exciton Binding Energy in MAPbBr3 Perovskite Quantum Dots
(Rana, Shailesh; Awasthi, Kamlesh; Bhosale, Sumit S.; Diau, Eric Wei-Guang; Ohta, Nobuhiro)
Tag: BE, EF, LED, pc, PL, em, SS, BDE, PMMA, ABS, EDM, NC, QD, EEF, LE, ED, LHP, EBE, P

[J. Phys. Chem. C 20190823122937, 2019, 32−19970]
In Quest of a Ferromagnetic Insulator: Structure-Controlled Magnetism in Mg–Ti–O Thin Films
(Frantti, Johannes; Fujioka, Yukari; Rouleau, Christopher; Steffen, Alexandra; Puretzky, Alexander; Lavrik, Nickolay; Ivanov, Ilia N.; Meyer, Harry M.)
Tag: Mg, Ti, Fm, e-, TF

[J. Phys. Chem. C 20190823123023, 2019, 32−20006]
Understanding the Solubility Behavior of Atomically Precise Gold Nanoclusters
(Cowan, Michael J.; Higaki, Tatsuya; Jin, Rongchao; Mpourmpakis, Giannis)
Tag: NC, Au, DFT

[J. Phys. Chem. B 20190823123340, 2019, 32−7036]
Relation between Anharmonicity of Free-Energy Profile and Spectroscopy in Solvation Dynamics: Differences in Spectral Broadening and Peak Shift in Transient Hole-Burning Spectroscopy Studied by Equilibrium Molecular Dynamics Simulation
(Yamaguchi, Tsuyoshi; Yoshida, Norio; Nishiyama, Katsura)
Tag: TD, FEP, HB, GS, MDS, MD, GSD, EMD

[J. Phys. Chem. A 20190823123421, 2019, 32−6813]
High-Temperature Unimolecular Decomposition of Diethyl Ether: Shock-Tube and Theory Studies
(Sela, Paul; Sakai, Yasuyuki; Choi, Hang Seok; Herzler, JÃrgen; Fikri, Mustapha; Schulz, Christof; Peukert, Sebastian)
Tag: GC, TOFMS, ether, DEE, TOF, TR, ABS, ARAS, Arrhenius, MS

[J. Phys. Chem. A 20190823123442, 2019, 32−6828]
Ionization-Induced Ï? ? H Site Switching in Resorcinol–Arn (n = 1 and 2) Clusters Probed by Infrared Spectroscopy
(Miyazaki, Mitsuhiko; Chatterjee, Kuntal; Hattori, Kaori; Otsuka, Remina; Ishiuchi, Shun-ichi; Dopfer, Otto; Fujii, Masaaki)
Tag: BE, H, BDE, GS, M, IR

[J. Phys. Chem. A 20190823123442, 2019, 32−6840]
Dehydrogenation of Methane by Partially Oxidized Tungsten Cluster Cations: High Reactivity Comparable to That of Platinum Cluster Cations
(Hirabayashi, Shinichi; Ichihashi, Masahiko)
Tag: Pt, W, O, CH4, DFT

[J. Phys. Chem. A 20190823123450, 2019, 32−6848]
Time-Resolved Photoelectron Imaging of Acetone with 9.3 eV Photoexcitation
(Uenishi, Ryuta; Horio, Takuya; Suzuki, Toshinori)
Tag: PE, KE, TR, DMK, e-, ACE

[J. Phys. Chem. A 20190823123745, 2019, 32−7021]
Reaction Behavior of the NO Molecule on the Surface of an Mn Particle (M = Ru, Rh, Pd, and Ag; n = 13 and 55): Theoretical Study of Its Dependence on Transition-Metal Element
(Takagi, Nozomi; Ishimura, Kazuya; Fukuda, Ryoichi; Ehara, Masahiro; Sakaki, Shigeyoshi)
Tag: VB, TS, CT, TM, LE, HE, OTS

[J. Phys. Chem. A 20190823123751, 2019, 32−7034]
Importance of van der Waals Descriptions on Accurate Isomerization Energy Calculations of Thiourea Compounds: LCgau-BOP+LRD Method
(Ahn, Dae-Hwan; Sato, Takeshi; Song, Jong-Won; Hirao, Kimihiko)
Tag: VdW, LRC, Et, Pr, WF, 57-13-6, TU, Me, DFT, Alk, LRD

[J. Phys. Chem. A 20190823123938, 2019, 32−7148]
Effects of pH on Interfacial Ozonolysis of α-Terpineol
(Qiu, Junting; Ishizuka, Shinnosuke; Tonokura, Kenichi; Sato, Kei; Inomata, Satoshi; Enami, Shinichi)
Tag: HPO, OA, OTS, MS, O3

[J. Phys. Chem. A 2019082312406, 2019, 32−7177]
Second Generation of Multiple-Angle Incidence Resolution Spectrometry
(Shioya, Nobutaka; Tomita, Kazutaka; Shimoaka, Takafumi; Hasegawa, Takeshi)
Tag: IF, AOI, FT, ABS, TF, IR, MAIRS