المؤلفون: Romanini, Michela, Macovez, Roberto, Valenti, Sofia, Noor, Wahi, Tamarit Mur, José Luis

المساهمون: Universitat Politècnica de Catalunya. Departament de Física, Universitat Politècnica de Catalunya. Doctorat en Física Computacional i Aplicada, Universitat Politècnica de Catalunya. PTP-GlaDyM - Phase transitions, polymorphism, glasses and dynamics of the metastability

مصطلحات موضوعية: Àrees temàtiques de la UPC::Física::Física molecular, Broadband dielectric spectroscopy, Molecular rotation, Glass manufacture -- Chemistry, Molecular conformers, Secondary relaxations, Activation barrier, Characteristic relaxation time, Internal rotation, Ring buckling, Ring inversion, Rotational isomerism, Rotació molecular, Vidre -- Fabricació -- Química

وصف الملف: application/pdf

Relation: https://www.mdpi.com/1422-0067/24/24/17189; info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PID2020-112975GB-I00/ES/DESORDEN COMO HERRAMIENTA PARA EL APROVECHAMIENTO DE LA ENERGIA /; Romanini, M. [et al.]. Dielectric spectroscopy studies of conformational relaxation dynamics in molecular glass-forming liquids. "International journal of molecular sciences", 6 Desembre 2023, vol. 24, núm. 24, article 17189.; http://hdl.handle.net/2117/403413

الاتاحة: http://hdl.handle.net/2117/403413
https://doi.org/10.3390/ijms242417189

المؤلفون: Yoshihiro Nishida, Reina Aono, Hirofumi Dohi, Wuxiao Ding, Hirotaka Uzawa

المصدر: International Journal of Molecular Sciences, Vol 24, Iss 3, p 2766 (2023)

مصطلحات موضوعية: glycerol, rotational isomerism, conformation, Karplus equation, 1 H NMR spectroscopy, bilateral symmetry, Biology (General), QH301-705.5, Chemistry, QD1-999

Relation: https://www.mdpi.com/1422-0067/24/3/2766; https://doaj.org/toc/1661-6596; https://doaj.org/toc/1422-0067; https://doaj.org/article/531ca600cef84381bf4c3a4d6bc30237

الاتاحة: https://doi.org/10.3390/ijms24032766
https://doaj.org/article/531ca600cef84381bf4c3a4d6bc30237

المؤلفون: Levitskaya, A.I.¹, Kalinin, A.A.¹, Fominykh, O.D.¹, Balakina, M.Yu.¹ mbalakina@yandex.ru

المصدر: Chemical Physics Letters. Aug2017, Vol. 681, p16-21. 6p.

مصطلحات موضوعية: *ROTATIONAL isomerism, *CHROMOPHORES, *QUINOXALINES, *NONLINEAR optical materials, *MOLECULAR polarizability

المؤلفون: Ewa Raczyńska, Jean-François Gal, Pierre-Charles Maria, Ghulam Sakhawat, Mohammad Fahim, Hamid Saeidian

المصدر: Molecules; Volume 27; Issue 14; Pages: 4370

مصطلحات موضوعية: nitrile basicity in the gas phase, methylenecyclopropene and cyclopropenimine scaffolds, geometrical and rotational isomerism, substituent effects, electron delocalization, DFT studies

جغرافية الموضوع: agris

وصف الملف: application/pdf

Relation: Physical Chemistry; https://dx.doi.org/10.3390/molecules27144370

الاتاحة: https://doi.org/10.3390/molecules27144370

المؤلفون: Kondinski, Aleksandar¹, Heine, Thomas^1,2, Monakhov, Kirill Yu.³ kirill.monakhov@ac.rwth-aachen.de

المصدر: Inorganic Chemistry. 4/18/2016, Vol. 55 Issue 8, p3777-3788. 12p.

مصطلحات موضوعية: *ROTATIONAL isomerism, *ELECTRONIC structure, *VANADATES, *MAGNETIC properties, *DENSITY functional theory, *VANADIUM oxide

المؤلفون: Chen, Lisa, Arnold, Mona, Blinder, Rémi, Jelezko, Fedor, Kuehne, Alexander J. C.

مصطلحات موضوعية: LIGHT-EMITTING-DIODES, SET MODEL CHEMISTRY, HALOTOLUENE DERIVATIVES, ROTATIONAL-ISOMERISM, TOTAL ENERGIES, SHELL, Proton magnetic resonance, Atoms, Atom

وصف الملف: application/pdf

Relation: https://www.rsc.org/suppdata/d1/ra/d1ra04638a/d1ra04638a1.pdf?_ga=2.52414633.102201692.1631008273-1004735710.1631008273

الاتاحة: https://doi.org/10.18725/OPARU-38737
http://nbn-resolving.de/urn:nbn:de:bsz:289-oparu-38813-7

المؤلفون: Andreas T. Rösch (11373895), Serge H. M. Söntjens (8892080), Jorn Robben (11373898), Anja R. A. Palmans (7376951), Tobias Schnitzer (4519111)

مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Pharmacology, Cancer, Virology, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, trifluoroacetic acid interfered, even small amounts, computational techniques showed, two rotational isomers, bis ­( 4, computational study, rotational isomerism, rotational barrier, room temperature, quadratic core, oxygen atoms, hydrogen bonds, conformational analysis, amido substituents

Relation: https://figshare.com/articles/journal_contribution/Rotational_Isomerism_of_an_Amide_Substituted_Squaraine_Dye_A_Combined_Spectroscopic_and_Computational_Study/16556353

الاتاحة: https://doi.org/10.1021/acs.joc.1c00922.s001

المؤلفون: Dendeni, Maha¹ maha.dendeni@gmail.com, Cimetiere, Nicolas^2,3, Soutrel, Isabelle², Guegan, Jean Paul², Hamida, Najib Ben¹, Amrane, Abdeltif^2,3

المصدر: Australian Journal of Chemistry. 2015, Vol. 68 Issue 5, p783-800. 18p. 1 Diagram, 1 Chart, 14 Graphs.

مصطلحات موضوعية: *QUINAPRIL, *ROTATIONAL isomerism, *CONFORMATIONAL analysis, *ACE inhibitors, *NUCLEAR magnetic resonance, *PEPTIDE analysis, *THERAPEUTICS

المؤلفون: Balazs, Amber Y. S., Davies, Nichola L., Longmire, David, Packer, Martin J., Chiarparin, Elisabetta

المصدر: Magnetic Resonance; 2021, Vol. 2 Issue 1, p489-498, 10p

مصطلحات موضوعية: NUCLEAR magnetic resonance, CONFORMATIONAL analysis, MOLECULAR dynamics, DRUG design, ROTATIONAL isomerism, DIHEDRAL angles

المؤلفون: Santos, Marcela F.¹, Braga, Carolyne B.¹, Rozada, Thiago C.², Basso, Ernani A.², Fiorin, Barbara C.¹ bcfiorin@uepg.br

المصدر: Spectrochimica Acta Part A: Molecular & Biomolecular Spectroscopy. Aug2014, Vol. 129, p148-156. 9p.

مصطلحات موضوعية: *ROTATIONAL isomerism, *CHLOROACETAMIDES, *NUCLEAR magnetic resonance, *INFRARED radiation, *CONFORMATIONAL analysis, *DATA analysis

المؤلفون: Fain V.Ya., Zaitsev B.E., Ryabov M.A.

المصدر: Russian Journal of Physical Chemistry A

مصطلحات موضوعية: 1 4 5 8-tetraaminoanthraquinone, Correlation analysis, Electronic absorption spectra, Quantum-chemical calculations, Rotational isomerism, Tautomeric composition, Tautomerism

Relation: https://doi.org/10.1134/S0036024413040109; https://openrepository.ru/article?id=252414

الاتاحة: https://openrepository.ru/article?id=252414

المؤلفون: Samdal, Svein¹, Grønås, Terje¹, Møllendal, Harald¹, Guillemin, Jean-Claude¹

المصدر: Journal of Physical Chemistry A. Feb2014, Vol. 118 Issue 8, p1413-1419. 7p.

مصطلحات موضوعية: *ROTATIONAL isomerism, *MICROWAVE spectroscopy, *CONFORMATIONAL analysis, *BUTENE, *ROTATIONAL motion

المؤلفون: Karthick, T.¹, Balachandran, V.² brsbala@rediffmail.com, Perumal, S.³, Lakshmi, A.⁴

المصدر: Spectrochimica Acta Part A: Molecular & Biomolecular Spectroscopy. Sep2013, Vol. 113, p52-66. 15p.

مصطلحات موضوعية: *ROTATIONAL isomerism, *SPECTROSCOPIC imaging, *QUANTUM chemistry, *VIBRATIONAL spectra, *PHENOL analysis, *THERMODYNAMICS

المؤلفون: Adande, G.R.¹, Ziurys, L.M.¹ lziurys@email.arizona.edu

المصدر: Journal of Molecular Spectroscopy. Aug2013, Vol. 290, p42-47. 6p.

مصطلحات موضوعية: *ROTATIONAL isomerism, *FOURIER transform infrared spectroscopy, *MICROWAVES, *LASER ablation, *MILLIMETER waves, *HYPERFINE structure, *CHEMICAL bond lengths

المؤلفون: Clements, Joseph Shelby II

Thesis Advisors: Chemistry, Carlier, Paul R., Kingston, David G. I., Tanko, James M., Yee, Gordon T.

مصطلحات موضوعية: Hydrazine, acylation, α-effect, regioselectivity, hydrazide, voltage-gated, (E)-/(Z), 19F NMR, single electron transfer (SET), rotational barrier, N-N bond rotation, rotational isomerism, helicity, transition state, dihedral angle

وصف الملف: ETD; application/pdf

الاتاحة: http://hdl.handle.net/10919/77918

المؤلفون: Anufriev, Sergei A., Zakharova, Maria V., Stogniy, Marina Yu., Sivaev, Igor B., Bregadze, Vladimir I.

المصدر: Pure & Applied Chemistry; Apr2018, Vol. 90 Issue 4, p633-642, 10p

مصطلحات موضوعية: SULFUR, CARBORANES, BORANE derivatives, SULFONIUM compounds, ROTATIONAL isomerism, CHEMICAL bonds

المؤلفون: Mahnke, Lisa K., Näther, Christian, Bensch, Wolfgang, van Leusen, Jan, Monakhov, Kirill Yu., Kögerler, Paul, Kondinski, Aleksandar, Warzok, Ulrike, Schalley, Christoph A.

المصدر: Angewandte Chemie; 3/5/2018, Vol. 130 Issue 11, p3024-3028, 5p

مصطلحات موضوعية: VANADATES, DENSITY functional theory, ROTATIONAL isomerism, POLYOXOMETALATES, ELECTROLYTIC reduction, ELECTRIC potential

المؤلفون: Horta, Pedro, Henriques, Marta S. C., Bras, Elisa M., Murtinheira, Fernanda, Nogueira, Fatima, O'Neill, Paul M., Paixao, Jose A., Fausto, Rui, Cristiano, Maria De Lurdes

مصطلحات موضوعية: Gaussian-basis sets, Plasmodium-Falciparum, Molecular calculations, Ab-Initio, Rotational-Isomerism, Density, Complex, Formate, Agents, Atoms

Relation: info:eu-repo/grantAgreement/FCT/5876/147257/PT; info:eu-repo/grantAgreement/FCT/SFRH/SFRH%2FBD%2F81821%2F2011/PT; info:eu-repo/grantAgreement/FCT/3599-PPCDT/127013/PT; http://hdl.handle.net/10400.1/11533

الاتاحة: http://hdl.handle.net/10400.1/11533
https://doi.org/10.1515/pac-2016-1119

المؤلفون: Adriano Cimini, Annalisa Paolone, Francesco Trequattrini, Oriele Palumbo

المصدر: Journal of solution chemistry (2021): 1–17. doi:10.1007/s10953-021-01079-2
info:cnr-pdr/source/autori:Cimini A.; Palumbo O.; Trequattrini F.; Paolone A./titolo:Influence of the Alkyl Chain Length on the Low Temperature Phase Transitions of Imidazolium Based Ionic Liquids/doi:10.1007%2Fs10953-021-01079-2/rivista:Journal of solution chemistry/anno:2021/pagina_da:1/pagina_a:17/intervallo_pagine:1–17/volume

مصطلحات موضوعية: Phase transition, Biophysics, Infrared spectroscopy, 02 engineering and technology, Dihedral angle, 010402 general chemistry, 01 natural sciences, Biochemistry, law.invention, chemistry.chemical_compound, law, Phase (matter), Alkyl chain, Ionic liquid, Phase transitions, Rotational isomerism, Physical and Theoretical Chemistry, Crystallization, Molecular Biology, Conformational isomerism, Alkyl, chemistry.chemical_classification, Chemistry, 021001 nanoscience & nanotechnology, 0104 chemical sciences, Crystallography, Infrared spectroscopy · Ionic liquid · Rotational isomerism · Alkyl chain · Phase transitions, 0210 nano-technology

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1be308e2035bb5b019db62aae8d115de
https://publications.cnr.it/doc/454231

المؤلفون: Vao-soongnern, Visit

المصدر: Colloid & Polymer Science; Mar2016, Vol. 294 Issue 3, p545-554, 10p

مصطلحات موضوعية: POLYETHYLENE oxide, MONTE Carlo method, POLYMER solutions, ROTATIONAL isomerism, NANOTECHNOLOGY, ANISOTROPY