المؤلفون: Jacob Davies, Julien R. Lyonnet, Bjørn Carvalho, Basudev Sahoo, Craig S. Day, Francisco Juliá-Hernández, Yaya Duan, Álvaro Velasco-Rubio, Marc Obst, Per-Ola Norrby, Kathrin H. Hopmann, Ruben Martin

مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Inorganic Chemistry, Plant Biology, Space Science, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, previously inaccessible endeavor, )– alkyl species, 2 , catalyzed direct carboxylation, kinetically controlled insertion, direct carboxylation, carboxylation arena, walking processes, stereoelectronic effects, rapid formation, nickel catalysis, initial c, hydride elimination, controlled ni

Relation: https://figshare.com/articles/journal_contribution/Kinetically-Controlled_Ni-Catalyzed_Direct_Carboxylation_of_Unactivated_Secondary_Alkyl_Bromides_without_Chain_Walking/24968722

الاتاحة: https://doi.org/10.1021/jacs.3c11205.s002
https://figshare.com/articles/journal_contribution/Kinetically-Controlled_Ni-Catalyzed_Direct_Carboxylation_of_Unactivated_Secondary_Alkyl_Bromides_without_Chain_Walking/24968722

المؤلفون: Renan V. Viesser, Cláudio F. Tormena

المصدر: Journal of Magnetic Resonance Open, Vol 12, Iss , Pp 100080- (2022)

مصطلحات موضوعية: Chemical shift, Stereoelectronic effects, Heavy-atom effect, Spin-orbit coupling, Non-covalent interaction, Medical physics. Medical radiology. Nuclear medicine, R895-920, Physics, QC1-999

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2666441022000504; https://doaj.org/toc/2666-4410

URL الوصول: https://doaj.org/article/49a9f1b1cc1044cb976d684e1e37fef5

المؤلفون: Pimsuda Pansa-Ngat (8494677), Kamalpreet Singh (8968547), Bhrugu Patel (14278819), Chaowaphat Seriwattanachai (14278822), Pongsakorn Kanjanaboos (1363281), Oleksandr Voznyy (1376316)

مصطلحات موضوعية: Biochemistry, Medicine, Biotechnology, Immunology, Cancer, Infectious Diseases, Astronomical and Space Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, two divalent cations, critical bottleneck hindering, 40 – 60, based stereoelectronic effects, substituted analogues reverted, 3 , 2 +, phase stability remains, single dopant fails, phase stability, stereoelectronic effect, single dopant, yellow phase, phase stabilization, black phase, sufficient amount, site doping, simultaneously introduced, room temperature, readily reverts, photovoltaic applications

Relation: https://figshare.com/articles/journal_contribution/Stereoelectronic_Effect_from_B_Site_Dopants_Stabilizes_Black_Phase_of_CsPbI_sub_3_sub_/21751378

الاتاحة: https://doi.org/10.1021/acs.chemmater.2c03159.s001

المؤلفون: Reagan J. Meredith (12029956), Margaret McGurn (12029959), Christopher Euell (12029962), Peter Rutkowski (12029965), Evan Cook (12029968), Ian Carmichael (2028778), Anthony S. Serianni (2028775)

مصطلحات موضوعية: Biophysics, Biotechnology, Sociology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, synergistic stereoelectronic effects, roughly equal distribution, density functional theory, coupling constants sensitive, containing biomolecules promises, aqueous (< sup, ribofuranoside (< b, sugar ring behavior, new experimental method, obtain parameterized equations, models describe two, g ., hydrogen, 2 , 4 , 3 , 20 nmr spin, state conformational equilibria, south ring conformers, furanose ring conformation, 2 , south conformers, conformational equilibria, ring conformation, furanose ring

Relation: https://figshare.com/articles/journal_contribution/_i_MA_AT_i_Analysis_of_Aldofuranosyl_Rings_Unbiased_Modeling_of_Conformational_Equilibria_and_Dynamics_in_Solution/19104820

الاتاحة: https://doi.org/10.1021/acs.biochem.1c00630.s001

المؤلفون: Laconsay, Croix James

مصطلحات موضوعية: Organic chemistry, Computational chemistry, C-H insertion, density functional theory, dirhodium complex, heterolytic fragmentations, sigmatropic rearrangements, stereoelectronic effects

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/3qm9r76q

المؤلفون: Filho, Sílvio Quintino de Aguiar

المساهمون: Pereira, Douglas Henrique

مصطلحات موضوعية: Barreiras rotacionais, Efeitos estereoeletrônicos, Etanos substituídos, Átomos em moléculas, Rotational barriers, Stereoelectronic effects, Substituted ethanes, Atoms in molecules, CNPQ::CIENCIAS EXATAS E DA TERRA::QUIMICA

وصف الملف: application/pdf

Relation: AGUIAR FILHO, Sílvio Quintino de. Estudo de barreiras rotacionais internas do Etano, e derivados substituídos por Bromo, Cloro, Flúor e Iodo utilizando a teoria Atoms in Molecules – aim. 2021. 69 f. TCC (Graduação) - Curso de Química Ambiental, Universidade Federal do Tocantins, Gurupi, 2018.; http://hdl.handle.net/11612/3125

الاتاحة: http://hdl.handle.net/11612/3125

المؤلفون: Maiz-Pastor, P, Brémond, E, Pérez-Jiménez, A J, Adamo, C, Sancho-García, J C

المصدر: Chemphyschem ; ISSN:1439-7641 ; Volume:25 ; Issue:24

مصطلحات موضوعية: Density Functional Theory, Double-hybrid density functionals, Stereoelectronic effects, non-covalent interactions

Relation: https://doi.org/10.1002/cphc.202400466; https://pubmed.ncbi.nlm.nih.gov/39257369; https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11648831/

الاتاحة: https://doi.org/10.1002/cphc.202400466
https://pubmed.ncbi.nlm.nih.gov/39257369
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11648831/

المؤلفون: Will R. Henderson (8181204), Guancen Liu (8181207), Khalil A. Abboud (1274355), Ronald K. Castellano (1676596)

مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Molecular Biology, Biotechnology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, dithia, carbon atom, isodesmic polymerization elongation., sulfur atom, Tuning Supramolecular Polymer Assembly, stereoelectronic effects, transannular amide hydrogen, X-ray crystallography, Stereoelectronic Interactions, donor, amide hydrogen, supramolecular polymerization, Experimental signatures, atom results, supramolecular polymer assembly, interaction, single-point exchange, model system

Relation: https://figshare.com/articles/journal_contribution/Tuning_Supramolecular_Polymer_Assembly_through_Stereoelectronic_Interactions/15105747

الاتاحة: https://doi.org/10.1021/jacs.1c05522.s001

المؤلفون: Valery Lutsyk (11467035), Wojciech Plazinski (2347468)

مصطلحات موضوعية: Biophysics, Biochemistry, Biotechnology, Cancer, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, potential building blocks, molecular dynamics study, gag glycosidic linkages, basic conformational degree, 6 , 3 , diverse gag disaccharides, identified sulfation sites, exist numerous cases, longer gag chains, glycosidic linkage present, glycosidic linkage conformation, present study, glycosidic linkage, 106 gag, conformational properties, related disaccharides, glycosaminoglycan disaccharides, weakly affected, unfunctionalized units, sulfation increases, structural heterogeneity, stereoelectronic effects

Relation: https://figshare.com/articles/journal_contribution/Conformational_Properties_of_Glycosaminoglycan_Disaccharides_A_Molecular_Dynamics_Study/16661469

الاتاحة: https://doi.org/10.1021/acs.jpcb.1c04860.s001

المؤلفون: Welday Desta Weldu (10202449), Cheng-Chung Wang (1735783)

مصطلحات موضوعية: Biophysics, Biochemistry, Immunology, Infectious Diseases, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, torsional angle ω, side chain along, fundamental research clarifies, dihedral angles ϕ, >- linked α, interglycosidic bond conformations, >- interglycosidic bond, protecting group pattern, nonreducing end sugar, range stereoelectronic effects, disaccharide donors thereof, interglycosidic linkages, reducing end, leaving group, stereoelectronic influence, key precursors, glycosidic bonds, conformational preferences, anomeric effects, 4 ‑<, 4 -<

Relation: https://figshare.com/articles/journal_contribution/Rationalizing_the_Stereoelectronic_Influence_of_Interglycosidic_Bond_Conformations_on_the_Reactivity_of_1_4_i_O_i_Linked_Disaccharide_Donors/17080623

الاتاحة: https://doi.org/10.1021/acs.joc.1c02207.s001

المؤلفون: César Ray, Carolina Díaz-Norambuena, Christopher Schad, Florencio Moreno, Antonia R. Agarrabeitia, María J. Ortiz, Teresa Arbeloa, Jorge Bañuelos, Beatriz L. Maroto, Santiago de la Moya

المصدر: Chemistry Proceedings; Volume 8; Issue 1; Pages: 3

مصطلحات موضوعية: organic dyes, BODIPY, stereoelectronic effects, photophysics, chiroptics

وصف الملف: application/pdf

Relation: https://dx.doi.org/10.3390/ecsoc-25-11701

الاتاحة: https://doi.org/10.3390/ecsoc-25-11701

المؤلفون: Daniel Rodrigues Lima, Sílvio Quintino de Aguiar Filho, Laura Beatriz Camargo do Oh, Anna Karla dos Santos Pereira, Douglas Henrique Pereira

المصدر: Heliyon, Vol 6, Iss 9, Pp e04957- (2020)

مصطلحات موضوعية: Organic chemistry, Theoretical chemistry, Stereoelectronic effects, QTAIM, NBO, Free rotor, Science (General), Q1-390, Social sciences (General), H1-99

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2405844020318004; https://doaj.org/toc/2405-8440

URL الوصول: https://doaj.org/article/9e3c95b863c146e1bd3fc5e4e2184c07

المؤلفون: Graham Pattison

المصدر: Beilstein Journal of Organic Chemistry, Vol 13, Iss 1, Pp 2915-2921 (2017)

مصطلحات موضوعية: α-halogenated ketones, conformational analysis, reactivity, stereoelectronic effects, Science, Organic chemistry, QD241-441

وصف الملف: electronic resource

Relation: https://doaj.org/toc/1860-5397

URL الوصول: https://doaj.org/article/dccd057eed9c4cd2905976398adb99fb

المؤلفون: Knight, Lee

مصطلحات موضوعية: 547, Stereoelectronic effects

URL الوصول: http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.322792

المؤلفون: Silva, Daniela Rodrigues, Zeoly, Lucas A., Cormanich, Rodrigo A., Guerra, Célia Fonseca, Freitas, Matheus P.

المصدر: Silva , D R , Zeoly , L A , Cormanich , R A , Guerra , C F & Freitas , M P 2020 , ' Evaluation of the Alicyclic Gauche Effect in 2-Fluorocyclohexanone Analogs : a Combined NMR and DFT Study ' , European Journal of Organic Chemistry , vol. 2020 , no. 7 , pp. 884-890 . https://doi.org/10.1002/ejoc.201901815

مصطلحات موضوعية: Axial–equatorial equilibrium, Conformation analysis, Fluorine gauche effect, Heterocycles, Stereoelectronic effects

الاتاحة: https://research.vu.nl/en/publications/2fb199b4-f714-49e2-966c-f10c7af3f4a0
https://doi.org/10.1002/ejoc.201901815
https://hdl.handle.net/1871.1/2fb199b4-f714-49e2-966c-f10c7af3f4a0
http://www.scopus.com/inward/record.url?scp=85079429898&partnerID=8YFLogxK
http://www.scopus.com/inward/citedby.url?scp=85079429898&partnerID=8YFLogxK

المؤلفون: Piscelli, Bruno, Sanders, William, Yu, Cihang, Al-Maharik, Nawaf, Lebl, Tomas, Cormanich, Rodrigo, O'Hagan, David

المصدر: Piscelli , B , Sanders , W , Yu , C , Al-Maharik , N , Lebl , T , Cormanich , R & O'Hagan , D 2020 , ' Fluorine induced pseudo -anomeric effects in methoxycyclohexanes through electrostatic 1,3-diaxial interactions ' , Chemistry - A European Journal , vol. 26 , no. 52 , pp. 11989-11994 . https://doi.org/10.1002/chem.202003058

مصطلحات موضوعية: Organofluorine, Anomeric effect, Conformational analysis, Stereoelectronic effects, Computational chemistry

وصف الملف: application/pdf

الاتاحة: https://risweb.st-andrews.ac.uk/portal/en/researchoutput/fluorine-induced-pseudoanomeric-effects-in-methoxycyclohexanes-through-electrostatic-13diaxial-interactions(b602d73a-34c4-4359-9e4b-670af59e02f8).html
https://doi.org/10.1002/chem.202003058
https://research-repository.st-andrews.ac.uk/bitstream/10023/20484/1/Piscelli_2020_CEJ_Fluorine_induced_CC.pdf

المؤلفون: Silva, Daniela Rodrigues, Zeoly, Lucas André, Cormanich, Rodrigo Antonio, Guerra, Célia Fonseca, Freitas, Matheus Puggina de

المصدر: European Journal of Organic Chemistry

مصطلحات موضوعية: Axial–equatorial equilibrium, Conformation analysis, Fluorine gauche effect, Heterocycles, Stereoelectronic effects, Equilíbrio axial-equatorial, Análise conformacional, Efeito gauche do fluoreto, Compostos Heterocíclicos, Efeitos Estereoeletrônicos

وصف الملف: application/pdf

Relation: SILVA, D. R. et al. Evaluation of the Alicyclic Gauche Effect in 2‐Fluorocyclohexanone Analogs: a Combined NMR and DFT Study. European Journal of Organic Chemistry, [S. I.], v. 2020, n. 7, p. 884–890, Feb. 2020. DOI:10.1002/ejoc.201901815.; http://repositorio.ufla.br/jspui/handle/1/43086

الاتاحة: http://repositorio.ufla.br/jspui/handle/1/43086

المؤلفون: Bridge, Colin Francis

مصطلحات موضوعية: 547, Stereoelectronic effects, Fluorinated penicillins

URL الوصول: http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.363551

المؤلفون: Hammoud, Jana, Joosten, Antoine, Lecourt, Thomas

المساهمون: Chimie Organique et Bioorganique : Réactivité et Analyse (COBRA), Institut de Chimie Organique Fine (IRCOF), Université de Rouen Normandie (UNIROUEN), Normandie Université (NU)-Normandie Université (NU)-Institut national des sciences appliquées Rouen Normandie (INSA Rouen Normandie), Institut National des Sciences Appliquées (INSA)-Normandie Université (NU)-Institut National des Sciences Appliquées (INSA)-Centre National de la Recherche Scientifique (CNRS)-Université de Rouen Normandie (UNIROUEN), Institut National des Sciences Appliquées (INSA)-Normandie Université (NU)-Institut National des Sciences Appliquées (INSA)-Centre National de la Recherche Scientifique (CNRS)-Institut Normand de Chimie Moléculaire Médicinale et Macromoléculaire (INC3M), Université de Caen Normandie (UNICAEN), Normandie Université (NU)-Normandie Université (NU)-École Nationale Supérieure d'Ingénieurs de Caen (ENSICAEN), Normandie Université (NU)-Université Le Havre Normandie (ULH), Normandie Université (NU)-Université de Rouen Normandie (UNIROUEN), Normandie Université (NU)-Institut national des sciences appliquées Rouen Normandie (INSA Rouen Normandie), Institut National des Sciences Appliquées (INSA)-Normandie Université (NU)-Institut National des Sciences Appliquées (INSA)-Institut de Chimie - CNRS Chimie (INC-CNRS)-Centre National de la Recherche Scientifique (CNRS)-Université de Caen Normandie (UNICAEN), Normandie Université (NU)-École Nationale Supérieure d'Ingénieurs de Caen (ENSICAEN), Normandie Université (NU)-Institut de Chimie - CNRS Chimie (INC-CNRS)-Centre National de la Recherche Scientifique (CNRS)-Centre National de la Recherche Scientifique (CNRS), ANR-11-LABX-0029,SYNORG,Synthèse Organique : des molécules au vivant(2011)

المصدر: ISSN: 0008-6215.

مصطلحات موضوعية: C-H bond functionalization, Rh(II)-carbene, Quaternarization, Stereoelectronic effects, [CHIM]Chemical Sciences

Relation: hal-02548495; https://normandie-univ.hal.science/hal-02548495; https://normandie-univ.hal.science/hal-02548495/document; https://normandie-univ.hal.science/hal-02548495/file/S0008621519305646.pdf; PII: S0008-6215(19)30564-6

الاتاحة: https://normandie-univ.hal.science/hal-02548495
https://normandie-univ.hal.science/hal-02548495/document
https://normandie-univ.hal.science/hal-02548495/file/S0008621519305646.pdf
https://doi.org/10.1016/j.carres.2019.107834

المؤلفون: Benjamin L. Harris, Jonathan M. White

المصدر: Molecules, Vol 18, Iss 10, Pp 11705-11711 (2013)

مصطلحات موضوعية: hyperconjugation, stereoelectronic effects, selenium interactions, Organic chemistry, QD241-441

وصف الملف: electronic resource

Relation: http://www.mdpi.com/1420-3049/18/10/11705; https://doaj.org/toc/1420-3049

URL الوصول: https://doaj.org/article/d9bd6bf3ac004bc6bd4bb1ccb009c520