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https://hdl.handle.net/11499/4406
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DC Field | Value | Language |
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dc.contributor.author | Karabıyık, H. | - |
dc.contributor.author | Kılınçarslan, Rafet. | - |
dc.contributor.author | Aygün, M. | - |
dc.contributor.author | Çetinkaya, B. | - |
dc.contributor.author | García-Granda, S. | - |
dc.date.accessioned | 2019-08-16T11:33:54Z | |
dc.date.available | 2019-08-16T11:33:54Z | |
dc.date.issued | 2007 | - |
dc.identifier.issn | 1040-0400 | - |
dc.identifier.uri | https://hdl.handle.net/11499/4406 | - |
dc.identifier.uri | https://doi.org/10.1007/s11224-006-9141-y | - |
dc.description.abstract | The crystal and molecular structure of the N,N'-bis(2-methoxyethyl)- 4,5-bis(2,4,6-trimethylphenyl)- imidazolinium hexafluorophosphate, which is the first example of 1,3- and 4,5-disubstituted imidazolinium salts, have been determined and characterized by X-ray single crystal diffraction technique, 1 H, 13 C, 31 P and 19 F NMR spectroscopy. The compound, C 27 H 39 N 2 O 2 + ·PF 6 - , crystallizes in the orthorhombic space group Pba2 with a = 15.8139(4) Å, b = 22.9346(7) Å, c = 8.069(3) Å. Two charge-assisted C-H?F type crystal packing interactions between the imidazolinium C-H bonds and the F atoms of hexafluorophosphate counteranions build up zigzag chains along a-axis of the unit cell and indicate that the C-H bonds of the imidazolinium ring are also polarized. In addition, the title salt was modeled by DFT calculations in order to verify charge transfer mechanism observed in its imidazolinium ring. © 2007 Springer Science+Business Media, LLC. | en_US |
dc.language.iso | en | en_US |
dc.publisher | Springer New York | en_US |
dc.relation.ispartof | Structural Chemistry | en_US |
dc.rights | info:eu-repo/semantics/closedAccess | en_US |
dc.subject | Charge-assisted interaction | en_US |
dc.subject | Crystal structure | en_US |
dc.subject | DFT/B3LYP | en_US |
dc.subject | Imidazolinium salt | en_US |
dc.title | Structural characterization of N,N'-bis(2-methoxyethyl) -4,5-bis(2,4,6-trimethylphenyl)imidazolinium hexafluorophosphate | en_US |
dc.type | Article | en_US |
dc.identifier.volume | 18 | en_US |
dc.identifier.issue | 6 | en_US |
dc.identifier.startpage | 1011 | |
dc.identifier.startpage | 1011 | en_US |
dc.identifier.endpage | 1016 | en_US |
dc.authorid | 0000-0001-6982-9536 | - |
dc.identifier.doi | 10.1007/s11224-006-9141-y | - |
dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |
dc.identifier.scopus | 2-s2.0-37749043855 | en_US |
dc.identifier.wos | WOS:000252159000035 | en_US |
local.message.claim | 2023-03-29T12:48:49.586+0300|||rp00248|||submit_approve|||dc_contributor_author|||None | * |
dc.identifier.scopusquality | Q3 | - |
dc.owner | Pamukkale University | - |
item.grantfulltext | none | - |
item.openairetype | Article | - |
item.languageiso639-1 | en | - |
item.fulltext | No Fulltext | - |
item.cerifentitytype | Publications | - |
item.openairecristype | http://purl.org/coar/resource_type/c_18cf | - |
crisitem.author.dept | 17.01. Chemistry | - |
crisitem.author.dept | 11.01. Nursing | - |
Appears in Collections: | Fen-Edebiyat Fakültesi Koleksiyonu Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection WoS İndeksli Yayınlar Koleksiyonu / WoS Indexed Publications Collection |
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