{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,30]],"date-time":"2026-07-30T14:49:24Z","timestamp":1785422964162,"version":"3.56.0"},"reference-count":24,"publisher":"International Union of Crystallography (IUCr)","issue":"10","license":[{"start":{"date-parts":[[2023,9,29]],"date-time":"2023-09-29T00:00:00Z","timestamp":1695945600000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/legalcode"},{"start":{"date-parts":[[2023,9,29]],"date-time":"2023-09-29T00:00:00Z","timestamp":1695945600000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/legalcode"}],"funder":[{"DOI":"10.13039\/501100007684","name":"Ministry of Education and Science of Ukraine","doi-asserted-by":"publisher","award":["22BF037-03"],"award-info":[{"award-number":["22BF037-03"]}],"id":[{"id":"10.13039\/501100007684","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100007684","name":"Ministry of Education and Science of Ukraine","doi-asserted-by":"publisher","award":["22BF037-04"],"award-info":[{"award-number":["22BF037-04"]}],"id":[{"id":"10.13039\/501100007684","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["iucr.org","wiley.com","iucrj.org"],"crossmark-restriction":true},"short-container-title":["Acta Crystallogr E Cryst Commun","Acta Cryst E","Acta Cryst Sect E","Acta Crystallogr E","Acta Crystallogr Sect E","Acta Cryst E Cryst Commun","Acta Cryst Sect E Cryst Commun"],"accepted":{"date-parts":[[2023,9,26]]},"published-print":{"date-parts":[[2023,10,1]]},"abstract":"<jats:p>\n                    The unit cell of the title compound, [Fe(C\n                    <jats:sub>18<\/jats:sub>\n                    H\n                    <jats:sub>15<\/jats:sub>\n                    N\n                    <jats:sub>6<\/jats:sub>\n                    O\n                    <jats:sub>2<\/jats:sub>\n                    )\n                    <jats:sub>2<\/jats:sub>\n                    ]\u00b72CH\n                    <jats:sub>3<\/jats:sub>\n                    OH\u00b72CHCl\n                    <jats:sub>3<\/jats:sub>\n                    , consists of a charge-neutral complex molecule, two methanol and two chloroform molecules. In the complex, the two tridentate 2-(5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl)-6-(pyrazol-1-yl)pyridine ligands coordinate to the central Fe\n                    <jats:sup>II<\/jats:sup>\n                    ion through the N atoms of the pyrazole, pyridine and triazole groups, forming a pseudo-octahedral coordination sphere. Neighbouring tapered molecules are linked through weak C\u2014H(pz)...\u03c0(ph) interactions into one-dimensional chains, which are joined into two-dimensional layers through weak C\u2014H...N\/C\/O interactions. Furthermore, the layers stack in a three-dimensional network linked by weak interlayer C\u2014H...\u03c0 interactions of the methoxy and phenyl groups. The intermolecular contacts were quantified using Hirshfeld surface analysis and two-dimensional fingerprint plots, revealing the relative contributions of the contacts to the crystal packing to be H...H 32.0%, H...C\/C...H 26.3%, H...N\/N...H 13.8%, and H...O\/O...H 7.5%. The average Fe\u2014N bond distance is 2.185\u2005\u00c5, indicating the high-spin state of the Fe\n                    <jats:sup>II<\/jats:sup>\n                    ion. Energy framework analysis at the HF\/3\u201321\u2005G theory level was performed to quantify the interaction energies in the crystal structure.\n                  <\/jats:p>","DOI":"10.1107\/s2056989023008423","type":"journal-article","created":{"date-parts":[[2023,9,27]],"date-time":"2023-09-27T01:03:31Z","timestamp":1695776611000},"page":"962-966","update-policy":"https:\/\/doi.org\/10.1107\/cm_01","source":"Crossref","is-referenced-by-count":1,"title":["Crystal structure of bis{3-(3,4-dimethoxyphenyl)-5-[6-(pyrazol-1-yl)pyridin-2-yl]-1,2,4-triazol-3-ato}iron(II)\u2013methanol\u2013chloroform (1\/2\/2)"],"prefix":"10.1107","volume":"79","author":[{"ORCID":"https:\/\/orcid.org\/0000-0003-4818-8658","authenticated-orcid":true,"given":"Kateryna","family":"Znovjyak","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1092-8035","authenticated-orcid":true,"given":"Igor O.","family":"Fritsky","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Tatiana Y.","family":"Sliva","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3499-267X","authenticated-orcid":true,"given":"Vladimir M.","family":"Amirkhanov","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Sergey O.","family":"Malinkin","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1222-4373","authenticated-orcid":true,"given":"Sergiu","family":"Shova","sequence":"additional","affiliation":[{"id":[{"id":"https:\/\/ror.org\/0561n6946","id-type":"ROR","asserted-by":"publisher"}]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Maksym","family":"Seredyuk","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"329","published-online":{"date-parts":[[2023,9,29]]},"reference":[{"key":"tx2075_bb1","doi-asserted-by":"crossref","first-page":"13535","DOI":"10.1021\/acs.inorgchem.7b02272","volume":"56","author":"Bartual-Murgui","year":"2017","journal-title":"Inorg. 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