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三种苯并稠环大环二酰胺的合成与结构。

Synthesis and structures of three benzoannelated macrobicyclic diamides.

机构信息

Department of Chemistry, San Diego Miramar College, San Diego, CA 92126, USA.

Department of Chemistry and Biochemistry, University of Oklahoma, Norman, OK 73071-5251, USA.

出版信息

Acta Crystallogr C Struct Chem. 2022 Mar 1;78(Pt 3):176-180. doi: 10.1107/S2053229622001449. Epub 2022 Feb 14.

DOI:10.1107/S2053229622001449
PMID:35245214
Abstract

We report the synthesis and structures of 9,10,20,21-tetrahydro-5,14-(ethanooxyethano)dibenzo[e,q][1,4,10,13,7,16]tetraoxadiazacyclooctadecine-6,13-dione [systematic name: 8,11,21,24,29-pentaoxa-1,18-diazatetracyclo[16.8.5.0.0]hentriaconta-2,4,6,12(17),13,15-hexaene-19,26-dione CHNO, I], 6,7,9,10,12,13,20,21-octahydro-5,14-(ethanooxyethano)dibenzo[e,q][1,4,10,13,7,16]tetraoxadiazacyclooctadecine-23,27-dione (8,11,21,24,29-pentaoxa-1,18-diazatetracyclo[16.8.5.0.0]hentriaconta-2,4,6,12,14,16-hexaene-27,31-dione; CHNO, II), and 9,10,20,21-tetrahydro-5,14-(ethanooxyethanooxyethano)dibenzo[e,q][1,4,10,13,7,16]tetraoxadiazacyclooctadecine-6,13-dione [8,11,21,24,29,32-hexaoxa-1,18-diazatetracyclo[16.8.8.0.0]tetratriaconta-2,4,6,12(17),13,15-hexaene-19,26-dione; CHNO, III]. All three compounds are made up of two tertiary diamides and are composed of two 15-membered rings with NO donor sets and one 18-membered ring with an NO donor set (compounds I and II) or three 18-membered rings with NO donor sets (compound III). The solid-state structures of compounds I and II show little effects from the movement of the amide groups. However, compound III has a larger cavity and a different orientation of donor atoms in comparison to compounds I and II.

摘要

我们报告了 9,10,20,21-四氢-5,14-(乙氧乙氧基乙氧基)二苯并[e,q][1,4,10,13,7,16]六氧杂环十八烷-6,13-二酮 [系统命名:8,11,21,24,29-五氧-1,18-二氮杂三环[16.8.5.0.0]亨三嗪-2,4,6,12(17),13,15-六烯-19,26-二酮 CHNO,I]、6,7,9,10,12,13,20,21-八氢-5,14-(乙氧乙氧基乙氧基)二苯并[e,q][1,4,10,13,7,16]六氧杂环十八烷-23,27-二酮(8,11,21,24,29-五氧-1,18-二氮杂三环[16.8.5.0.0]亨三嗪-2,4,6,12,14,16-六烯-27,31-二酮;CHNO,II)和 9,10,20,21-四氢-5,14-(乙氧乙氧基)二苯并[e,q][1,4,10,13,7,16]六氧杂环十八烷-6,13-二酮[8,11,21,24,29,32-六氧-1,18-二氮杂三环[16.8.8.0.0]四聚体-2,4,6,12(17),13,15-六烯-19,26-二酮;CHNO,III]。所有三种化合物均由两个叔酰胺组成,由两个含 NO 给体的 15 元环和一个含 NO 给体的 18 元环(化合物 I 和 II)或三个含 NO 给体的 18 元环(化合物 III)组成。化合物 I 和 II 的固态结构显示酰胺基团的运动影响很小。然而,与化合物 I 和 II 相比,化合物 III 具有更大的空腔和给体原子的不同取向。

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