{"title":"meso-α,α-5,15-Bis(o-nicotinamidophenyl)-10,20-diphenylporphyrin n-hexane monosolvate","authors":"Xiaotao Sun , Jianfeng Li , S. Bernès (Editor)","doi":"10.1107/S2414314623010854","DOIUrl":null,"url":null,"abstract":"<div><div>In the title porphyrin solvate, the macrocycle shows a characteristic saddle-shaped distortion.</div></div><div><div>The structure of the title solvated porphyrin, C<sub>56</sub>H<sub>38</sub>N<sub>8</sub>O<sub>2</sub>·C<sub>6</sub>H<sub>14</sub>, is reported. Two porphyrin molecules, one ordered and one disordered <em>n</em>-hexane solvate molecules are present in its asymmetric unit. The porphyrin macrocycle shows a characteristic saddle-shaped distortion, and the maximum deviation from the mean plane for non-hydrogen atoms is 0.48 Å. N—H⋯N, N—H⋯O, and C—H⋯O hydrogen bonds, as well as π<em>–</em>π interactions, are observed in the crystal structure. <span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (350KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span> </div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"8 12","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2023-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"IUCrData","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/org/science/article/pii/S2414314623002195","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2023/12/22 0:00:00","PubModel":"Epub","JCR":"","JCRName":"","Score":null,"Total":0}
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Abstract
In the title porphyrin solvate, the macrocycle shows a characteristic saddle-shaped distortion.
The structure of the title solvated porphyrin, C56H38N8O2·C6H14, is reported. Two porphyrin molecules, one ordered and one disordered n-hexane solvate molecules are present in its asymmetric unit. The porphyrin macrocycle shows a characteristic saddle-shaped distortion, and the maximum deviation from the mean plane for non-hydrogen atoms is 0.48 Å. N—H⋯N, N—H⋯O, and C—H⋯O hydrogen bonds, as well as π–π interactions, are observed in the crystal structure.
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