| dc.contributor.author | Korkmaz, Ufuk | |
| dc.contributor.author | Bulut, Iclal | |
| dc.contributor.author | Bulut, Ahmet | |
| dc.date.accessioned | 2020-06-21T13:32:45Z | |
| dc.date.available | 2020-06-21T13:32:45Z | |
| dc.date.issued | 2016 | |
| dc.identifier.issn | 2056-9890 | |
| dc.identifier.uri | https://doi.org/10.1107/S2056989016009725 | |
| dc.identifier.uri | https://hdl.handle.net/20.500.12712/13261 | |
| dc.description | WOS: 000379329900028 | en_US |
| dc.description | PubMed: 27555949 | en_US |
| dc.description.abstract | In the title inner salt molecule, C10H10N2O3, the four-membered cyclobutene ring is twisted by 7.1 (2)degrees with respect to the five-membered imidazole ring. The crystal packing exhibits an R-2(2)(9) hydrogen-bonding ring motif through N-H center dot center dot center dot O and C-H center dot center dot center dot O interactions. The potential non-linear optical properties were studied by a computational ab initio calculations performed at the DFT/B3LYP/6-31++G(d, p) level of theory. | en_US |
| dc.language.iso | eng | en_US |
| dc.publisher | Int Union Crystallography | en_US |
| dc.relation.isversionof | 10.1107/S2056989016009725 | en_US |
| dc.rights | info:eu-repo/semantics/openAccess | en_US |
| dc.subject | crystal structure | en_US |
| dc.subject | squarene | en_US |
| dc.subject | hydrogen bonding | en_US |
| dc.subject | quantum chemical calculations | en_US |
| dc.subject | nonlinear optical properties | en_US |
| dc.title | Crystal structure of 2-ethyl-4-methyl-1-(2-oxido-3,4-dioxocyclobut-1-en-1-yl)-1H-imidazol-3-ium | en_US |
| dc.type | article | en_US |
| dc.contributor.department | OMÜ | en_US |
| dc.identifier.volume | 72 | en_US |
| dc.identifier.startpage | 998 | en_US |
| dc.identifier.endpage | + | en_US |
| dc.relation.journal | Acta Crystallographica Section E-Crystallographic Communications | en_US |
| dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |
