Works in Journal of Physical Organic Chemistry, 2023, Vol 36, Issue 2

Results: 17

Computational study of novel pentacene derivatives: Prediction of structural, electronic, and optical properties.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4443

By:

Petralia, Salvatore;
Forte, Giuseppe

Publication type:

Article

Unraveling origin of chemoselectivity and regioselectivity of iridium‐catalyzed B(4)–H functionalization of o‐carborane by alkyne.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4430

By:

Chen, Zitong;
Liu, Jiying;
Liu, Jiabin;
Bao, Panpan;
He, Hailing;
Xia, Hui;
Zhang, Wenjing

Publication type:

Article

Kinetic and mechanistic studies of the Staudinger reduction: On the chemistry of aryl phosphazides.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4442

By:

Corrigan, Samantha Y.;
Poole, James S.

Publication type:

Article

The s‐trans,s‐cis‐conformer of all‐trans‐1,6‐diphenyl‐1,3,5‐hexatriene was detected: A response.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4439

By:

Saltiel, Jack

Publication type:

Article

Experimental and theoretical study of optical properties of pyrromethene (PM‐597) laser dye in binary eco‐friendly solvent.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4445

By:

Al‐shamiri, Hamdan A. S.;
Melhi, Saad;
Alosaimi, Eid. H.;
El‐Gammal, Bilal;
Elhouichet, Habib;
Sakr, Mahmoud A. S.;
Kana, Maram T. H. Abou;
Kandel, Hamed M.

Publication type:

Article

On the road to stable, isolable [4]cumulenes: Reactivity and cyclization reactions.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4454

By:

Johnson, Matthew A.;
Meckes, Jakob A.;
Bühringer, Martina U.;
Zhou, Zheng;
Kuwatani, Yoshiyuki;
Ferguson, Michael J.;
Wei, Zheng;
Iyoda, Masahiko;
Petrukhina, Marina A.;
Tykwinski, Rik R.

Publication type:

Article

Effect of tetraethylene glycol side chain conformation on chiroptical properties of chirality‐induced benzocoumarin.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4453

By:

Ozturk, Perihan;
Akdag, Akin

Publication type:

Article

Synthesis, characterization and computational studies for (2′S,3R,3′S,8a′R)‐2′,3′‐bis(ethoxycarbonyl)‐2‐oxo‐2′,3′‐dihydro‐8a′H‐spiro[indoline‐3,1′‐indolizine]‐6′‐carboxylic acid and some derivatives

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4452

By:

Almutaleb, Arabya A. A.;
Alabbasi, Aisha A.

Publication type:

Article

Density functional theory study on gas‐phase microscopic basicity of some ketenimine derivatives and their isomers/tautomers.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4446

By:

Solgi, Leila;
Mirjafary, Zohreh;
Mokhtari, Javad;
Saeidian, Hamid

Publication type:

Article

A G4 approach to computing the Hammett substituent constants σp, σm, σ−, σ+, and σ+m.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4436

By:

Yett, Ariana;
Rablen, Paul R.

Publication type:

Article

Substituent effects on the stretching vibration frequencies of C=C bridge bond in aryl ethylene with furyl or thienyl group.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4433

By:

Wang, Linyan;
Cao, Chaotun;
Qu, Junyan;
Cao, Chenzhong

Publication type:

Article

Solvent‐polarity‐dependent excited‐state behaviors for 2‐(2‐hydroxyphenyl) benzothiazole‐5‐(9H‐carbazol‐9‐yl)phenol fluorophore: A theoretical study.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4432

By:

Li, Songtao;
Cao, Yahui;
Dong, Hao

Publication type:

Article

Uncovering and controlling the ESIPT behavior for 2,2‐dipicolylamino substituted 2‐(2′‐hydroxybenzofuranyl) benzoxazole: Solvent polarity.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4440

By:

Zhao, Jinfeng;
Fan, Liming;
Feng, Lu;
Jin, Bing;
Zhao, Shutao

Publication type:

Article

Synthesis, anticancer evaluation, and molecular docking study of novel 4‐hydroxybenzo[h][1,6]naphthyridine‐2,5‐dione derivatives.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4429

By:

Mostafa, Mai A.

Publication type:

Article

Cover Image.

Published in:: Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4363
Publication type:: Article

Issue Information.

Published in:: Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4362
Publication type:: Article

Antioxidant and anticancer properties of plant‐based bioactive flavonoids cardamonin and alpinetin: A theoretical insight from •OOH antiradical and Cu (II) chelation mechanisms.

Published in:

Journal of Physical Organic Chemistry, 2023, v. 36, n. 2, p. 1, doi. 10.1002/poc.4428

By:

Kabanda, Mwadham M.;
Bahadur, Indra;
Singh, Prashant

Publication type:

Article

Works in Journal of Physical Organic Chemistry, 2023, Vol 36, Issue 2

Computational study of novel pentacene derivatives: Prediction of structural, electronic, and optical properties.

Unraveling origin of chemoselectivity and regioselectivity of iridium‐catalyzed B(4)–H functionalization of o‐carborane by alkyne.

Kinetic and mechanistic studies of the Staudinger reduction: On the chemistry of aryl phosphazides.

The s‐trans,s‐cis‐conformer of all‐trans‐1,6‐diphenyl‐1,3,5‐hexatriene was detected: A response.

Experimental and theoretical study of optical properties of pyrromethene (PM‐597) laser dye in binary eco‐friendly solvent.

On the road to stable, isolable [4]cumulenes: Reactivity and cyclization reactions.

Effect of tetraethylene glycol side chain conformation on chiroptical properties of chirality‐induced benzocoumarin.

Synthesis, characterization and computational studies for (2′S,3R,3′S,8a′R)‐2′,3′‐bis(ethoxycarbonyl)‐2‐oxo‐2′,3′‐dihydro‐8a′H‐spiro[indoline‐3,1′‐indolizine]‐6′‐carboxylic acid and some derivatives

Density functional theory study on gas‐phase microscopic basicity of some ketenimine derivatives and their isomers/tautomers.

A G4 approach to computing the Hammett substituent constants σ<sub>p</sub>, σ<sub>m</sub>, σ<sup>−</sup>, σ<sup>+</sup>, and σ<sup>+</sup><sub>m</sub>.

Substituent effects on the stretching vibration frequencies of C=C bridge bond in aryl ethylene with furyl or thienyl group.

Solvent‐polarity‐dependent excited‐state behaviors for 2‐(2‐hydroxyphenyl) benzothiazole‐5‐(9H‐carbazol‐9‐yl)phenol fluorophore: A theoretical study.

Uncovering and controlling the ESIPT behavior for 2,2‐dipicolylamino substituted 2‐(2′‐hydroxybenzofuranyl) benzoxazole: Solvent polarity.

Synthesis, anticancer evaluation, and molecular docking study of novel 4‐hydroxybenzo[h][1,6]naphthyridine‐2,5‐dione derivatives.

Cover Image.

Issue Information.

Antioxidant and anticancer properties of plant‐based bioactive flavonoids cardamonin and alpinetin: A theoretical insight from <sup>•</sup>OOH antiradical and Cu (II) chelation mechanisms.