dc.creator | Dostanić, Jasmina | |
dc.creator | Lončarević, Davor | |
dc.creator | Zlatar, Matija | |
dc.date.accessioned | 2019-05-29T20:55:39Z | |
dc.date.available | 2019-05-29T20:55:39Z | |
dc.date.issued | 2014 | |
dc.identifier.isbn | 978-86-82475-30-9 | |
dc.identifier.uri | http://www.socphyschemserb.org/en/events/pc2014/ | |
dc.identifier.uri | https://cer.ihtm.bg.ac.rs/handle/123456789/2902 | |
dc.description.abstract | Quantum chemical calculations performed by the density functional theory (DFT) were used to determine the structural parameters of arylazo pyridone dyes. The influence of electronic effects of substituent in diazo moiety of dyes on their structure properties was studied and quantified using Hammett equation. The correlation between dye bond length and Hammett substituent constants σp gave us possibility to locate the most sensitive bond to substituent effects. | en |
dc.language.iso | en | sr |
dc.publisher | Society of Physical Chemists of Serbia | sr |
dc.publisher | Društvo fizikohemičara Srbije | sr |
dc.relation | info:eu-repo/grantAgreement/MESTD/Integrated and Interdisciplinary Research (IIR or III)/45001/RS// | sr |
dc.rights | openAccess | sr |
dc.rights.uri | https://creativecommons.org/licenses/by-nc-nd/4.0/ | |
dc.source | Physical Chemistry 2014 – 12th International Conference on Fundamental and Applied Aspects of Physical Chemistry | sr |
dc.subject | arylazo pyridone dyes | sr |
dc.subject | Hammett substituent constants | sr |
dc.subject | DFT | sr |
dc.title | Theoretical study of substituent effects on structural properties of arylazo pyridone dyes | en |
dc.type | conferenceObject | sr |
dc.rights.license | BY-NC-ND | sr |
dcterms.abstract | Достанић, Јасмина; Златар, Матија; Лончаревић, Давор; | |
dc.rights.holder | Society of Physical Chemists of Serbia | sr |
dc.citation.volume | 1 | |
dc.citation.spage | 180 | |
dc.citation.epage | 183 | |
dc.identifier.rcub | https://hdl.handle.net/21.15107/rcub_cer_2902 | |
dc.identifier.fulltext | https://cer.ihtm.bg.ac.rs/bitstream/id/7039/bitstream_7039.pdf | |
dc.type.version | publishedVersion | sr |