Works matching IS 08943230 AND DT 2012 AND VI 25 AND IP 12

Results: 46

/V-protonated and O-protonated tautomers of 1 -azabicyclo[3.3.1 ]nonan-2-one: observation of individual 13C-NMR carbonyl peaks and comparisons with protonated tautomers of planar and other distorted lactams.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1422, doi. 10.1002/poc.3030

By:

Morgan, Jessica;
Greenberg, Arthur

Publication type:

Article

Ag-doped Ti02 enhanced photocatalytic oxidation of l-cyclohexanediol.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1418, doi. 10.1002/poc.2974

By:

Abdel‐Wahab, Aboel‐Magd A.;
Mohamed, Omima S.;
Ahmed, Saleh A.;
Mostafa, Mostafa F.

Publication type:

Article

Behavior of protonated cyclopropyl intermediates during polyalphaolefin synthesis: Mechanism and predicted product distribution.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1409, doi. 10.1002/poc.3059

By:

Gee, Jeffrey C.;
Small, Brooke L.;
Hope, Kenneth D.

Publication type:

Article

Kanamycin A: imine formation in aqueous solution.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1395, doi. 10.1002/poc.3057

By:

Fuentes‐Martínez, Yanet;
Godoy‐Alcántar, Carolina;
Medrano, Felipe;
Dikiy, Alexander

Publication type:

Article

Tautomeric equilibria analysis of ß-ketoamides by mass spectrometry.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1365, doi. 10.1002/poc.3051

By:

Laurella, Sergio L.;
Latorre, Claudia;
Dietrich, Roque;
Furlong, Jorge J. P.;
Allegretti, Patricia E.

Publication type:

Article

13C NMR relaxation and computational study of anisóle and derivatives in the solution state.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1374, doi. 10.1002/poc.3052

By:

Ng, Soon;
Salleh, Faizah Md.;
Xie, Yaoming;
Schaefer, Henry F.

Publication type:

Article

Manipulating charge-transfer character and tuning emission color with electron-withdrawing main-group moieties in iridium-based electrophosphors: a theoretical investigation.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1351, doi. 10.1002/poc.3046

By:

Ran, Xe‐Qin;
Feng, Ji‐Kang;
Wong, Wai‐Yeung;
Ren, Ai‐Min;
Zhou, Guijiang;
Sun, Chia‐Chung

Publication type:

Article

Mechanisms of interaction between luteolin and the catalytic zinc ion in matrix metalloproteinases: a computational study.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1306, doi. 10.1002/poc.3025

By:

Zhang, Ji;
Li, Hui;
Fan, Yi‐Ran;
Zhou, Xia

Publication type:

Article

Calculated polar substituent effects on the stability of 3-substituted(X) bicyclo[1.1.1]pent-1-yl cations and 4-substituted(X) bicyclo[2.2.1]hept-1-yl cations: a DFT study.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1404, doi. 10.1002/poc.3058

By:

Adcock, William

Publication type:

Article

Predicting the reaction mechanism of nucleophilic substitutions at carbonyl and thiocarbonyl centres of esters and thioesters.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1359, doi. 10.1002/poc.3048

By:

Ormazábal‐Toledo, Rodrigo;
Castro, Enrique A.;
Santos, José G.;
Millán, Daniela;
Cañete, Alvaro;
Contreras, Renato;
Campodónico, Paola R.

Publication type:

Article

Excited-state hydrogen bonding dynamics of pyruvic acid and geminal-diol, 2, 2-dihydroxypropanoic acid in aqueous solution: a DFT/TDDFT study.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1391, doi. 10.1002/poc.3055

By:

Yang, Dapeng;
Zhang, Lingfeng

Publication type:

Article

Microsolvation of morpholine, a bidentate base - the importance of cooperativity.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1380, doi. 10.1002/poc.3053

By:

Vallejos, Margarita M.;
Lamsabhi, Al Mokhtar;
Peruchena, Nélida M.;
Mó, Otilia;
Yáñez, Manuel

Publication type:

Article

The equilibrium and kinetics of intermolecular hydrogen bonding in nitroarene anion radical-alcohol system: 1,3-dinitro-benzene anion radical - R-OH (R=CH3- C2H5-, (CH3)2 CH-).

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1269, doi. 10.1002/poc.3005

By:

Mohammad, Mahboob;
Rauf, Asma;
Rauf, Saba;
Tariq, Muhammad

Publication type:

Article

Substituent effect s on the 13C NMR chemical shifts of the imine carbon in N-[4-X-benzylidene)-4-(4-Y-styryl) anilines.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1343, doi. 10.1002/poc.3032

By:

Fang, Zhengjun;
Cao, Chenzhong;
Chen, Guanfan

Publication type:

Article

Proton shuffling in acid/base-catalyzed enolizations: a computational study.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1336, doi. 10.1002/poc.3031

By:

Karaman, Rafik;
Menger, Fredric M.

Publication type:

Article

Determining the excited-state substituent constants σccex of meta-substituent from 3,4'-disubstituted stilbenes.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1315, doi. 10.1002/poc.3026

By:

Cao, Chenzhong;
Sheng, Bin;
Chen, Guanfan

Publication type:

Article

Dynamic ¹H NMR investigation along with a theoretical study around the C-C and C = C bonds in a particular phosphorus ylide.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1328, doi. 10.1002/poc.3029

By:

Habibi‐Khorassani, Sayyed Mostafa;
Maghsoodlou, Malek Taher;
Ebrahimi, Ali;
Mohammadi, Marzyeh;
Shahraki, Mehdi;
Aghdaei, Elham

Publication type:

Article

Unusual conformational preferences of 1,3-dimethyl-3-isopropoxy-3-silapiperidine.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1321, doi. 10.1002/poc.3028

By:

Kirpichenko, Svetlana V.;
Shainyan, Bagrat A.;
Kleinpeter, Erich

Publication type:

Article

Solvatochromism of catechol derivatives -solute/solvent interactions.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1261, doi. 10.1002/poc.3003

By:

Riedel, Franziska;
Spange, Stefan

Publication type:

Article

How hydrogen-bonded MnO can influence oxidation of olefins in both gas phase and solution?

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1198, doi. 10.1002/poc.2992

By:

Javan, Marjan Jebeli;
Tehrani, Zahra Aliakbar;
Fattahi, Alireza;
Hashemi, Mohammad Mahmoodi

Publication type:

Article

Mechanistic insights into the hydrolysis of organophosphorus compounds by paraoxonase-1: exploring the limits of substrate tolerance in a promiscuous enzyme.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1247, doi. 10.1002/poc.3002

By:

Muthukrishnan, Sivaramakrishnan;
Shete, Vivekanand S.;
Sanan, Toby T.;
Vyas, Shubham;
Oottikkal, Shameema;
Porter, Lauren M.;
Magliery, Thomas J.;
Hadad, Christopher M.

Publication type:

Article

Reversible formation of aryloxenium ions from the corresponding quinols under acidic conditions.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1236, doi. 10.1002/poc.2999

By:

Chakraborty, Mrinal;
Brzozowski, Christopher F.;
Novak, Michael

Publication type:

Article

Aluminum alkoxide complexes from highly substituted 3,4-epoxy alcohols: An NMR and computational study.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1299, doi. 10.1002/poc.3024

By:

Torres, Gerardo;
Ishikawa, Yasuyuki;
Prieto, José A.

Publication type:

Article

A Curtin-Hammett pentamethylene chain symmetrization process in the Bergman cydization of an 11-membered ring enediyne.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1293, doi. 10.1002/poc.3018

By:

Greer, Edyta M.;
Cosgriff, Christopher V.;
Lavinda, Olga

Publication type:

Article

A theoretical study of hemiacetal formation from the reaction of methanol with derivatives of CX3CHO (X = H, F, CI, Br and I).

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1286, doi. 10.1002/poc.3017

By:

Azofra, Luis Miguel;
Alkorta, Ibon;
Elguero, José

Publication type:

Article

Hartree-Fock and density functional theory study of remote substituent effects on heterolytic Fe-N bond energies of p-G-C6H4NHFe(CO)2(η5-C5H5) and p-G-C6H4N (COMe)Fe(CO)2(η5-C5H5)

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1275, doi. 10.1002/poc.3014

By:

Qing Zeng;
Zucheng Li;
Yujie Zhang;
Zhirong Sun;
Yingzi Wang;
Fubin Jiang

Publication type:

Article

Iodine catalyzed Mukaiyama-Michael reaction: experimental evaluation of catalytic effect in conjunction with computational study of the reaction mechanism.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1228, doi. 10.1002/poc.2997

By:

Deuri, Sanjib;
Phukan, Prodeep

Publication type:

Article

Recognition of aromatic amino acids and proteins with p-sulfonatocalix[4]arene - A luminescence and theoretical approach.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1217, doi. 10.1002/poc.2996

By:

Muthu Mareeswaran, Paulpandian;
Prakash, Muthuramalingam;
Subramanian, Venkatesan;
Rajagopal, Seenivasan

Publication type:

Article

Cu(II)-catalyzed oxidation of thiols by superoxide ligated to Co2III.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1193, doi. 10.1002/poc.2991

By:

Mishra, Ritu;
Banerjee, Rupendranath;
Mukhopadhyay, Subrata

Publication type:

Article

Unusual aspects of ion-pairing effects in room temperature ionic liquids.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1243, doi. 10.1002/poc.3000

By:

Bhat, Mohsin Ahmad;
Konar, Arkaprabha;
Ingole, Pravin P.;
Pandith, Altaf Hussain

Publication type:

Article

Diels-Alder Reaction in microemulsions with ionic liquid.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1210, doi. 10.1002/poc.2993

By:

Lü, Huihong;
An, Xueqin;
Yu, Jianguo;
Song, Xingfu

Publication type:

Article

Substituent effect s on indirect carbon-carbon couplings, J(CC), in substituted thiophenes, pyrroles, and furans studied by experiment and theory.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1127, doi. 10.1002/poc.2955

By:

Kamieńska‐Trela, Krystyna;
Dvornikova, Elena;
Biedrzycka, Zenobia;
Witanowski, Michał

Publication type:

Article

Electron transfer within 1,3-dinitrobenzene radical anions: electron hopping or superexchange?

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1139, doi. 10.1002/poc.2957

By:

Moneo, Álvaro;
Telo, João P.

Publication type:

Article

Mechanistic investigations in α-hydroxycarbonyls reduction by BH4-.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1186, doi. 10.1002/poc.2986

By:

Marincean, Simona;
Fritz, Michael;
Scamp, Ryan;
Jackson, James E.

Publication type:

Article

Self-assembly of p-tert-butyl thiacalix[4]arenes and metal cations into nanoscale three-dimensional particles.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1177, doi. 10.1002/poc.2981

By:

Stoikov, Ivan I.;
Yushkova, Elena A.;
Bukharaev, Anastas A.;
Biziaev, Dmitry A.;
Selivanovskaya, Svetlana Yu.;
Chursina, Mariya A.;
Antipin, Igor S.;
Konovalov, Alexander I.;
Zharov, Ilya

Publication type:

Article

Remote substituent effects on homolytic Fe-N bond energies of p-G-C6H4NHFe(CO)2(η5-C5H5) and p-G-C6H4(COMe)NFe(CO)2(η5-C5H5) studied using Hartree-Fock and density functional theory methods

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1119, doi. 10.1002/poc.2950

By:

Zeng, Qing;
Li, Zucheng

Publication type:

Article

Synthesis of sterically hindered antipyrines for intramolecular charge transfer facilitated sensing.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1112, doi. 10.1002/poc.2948

By:

Bian, Linyi;
Sun, Gang;
Sun, Yuxi;
Tang, Weihua

Publication type:

Article

Basicity of neutral organic superbases with vinamidine structure in gas phase and acetonitrile: a density functional theory study.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1168, doi. 10.1002/poc.2980

By:

Radić, Nena;
Maksić, Zvonimir B.

Publication type:

Article

Comparative theoretical investigation of the formation of DNA interstrand crosslinks induced by two kinds of Af-nitroso compounds: nitrosoureas and nitrosamines.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1153, doi. 10.1002/poc.2970

By:

Zhao, Lijiao;
Ma, Xinyan;
Zhong, Rugang

Publication type:

Article

Distinctive thermodynamic properties of solute-solvent hydrogen bonds in self-associated solvents.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1144, doi. 10.1002/poc.2966

By:

Sedov, Igor A.;
Solomonov, Boris N.

Publication type:

Article

Using linear solvation energy relationship model to study the retention factor of solute in liquid chromatography.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1058, doi. 10.1002/poc.3027

By:

Tang, Baokun;
Tian, Minglei;
Lee, Yu Ri;
Row, Kyung Ho

Publication type:

Article

New insight on an old reaction - the aqueous hydrolysis of acetic anhydride.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1105, doi. 10.1002/poc.2945

By:

Wiseman, Floyd Landis

Publication type:

Article

Mechanism for the reactions of sulfides and sulfoxides with hypochlorites: racemization and oxygen exchange of oxysulfonium salts and sulfoxides.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1086, doi. 10.1002/poc.2941

By:

Ruff, Ferenc;
Jalsovszky, István;
Szabó, Dénes;
Rábai, József;
Farkas, Ödön;
Kucsman, Árpád

Publication type:

Article

Theoretical study of keto-enol tautomerism by quantum mechanical calculations (the QM/MC/FEP method).

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1097, doi. 10.1002/poc.2944

By:

Kaweetirawatt, Thanayuth;
Yamaguchi, Toru;
Higashiyama, Tsutomu;
Sumimoto, Michinori;
Hori, Kenji

Publication type:

Article

The structure of and interactions in binary acetonitrile + water mixtures.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1072, doi. 10.1002/poc.3056

By:

Marcus, Yizhak

Publication type:

Article

PROFILE: Early Excellence in Physical Organic Chemistry.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 12, p. 1057, doi. 10.1002/poc.3072

By:

Hof, Fraser

Publication type:

Article