Muniappan Sankar, Lipstman Sophia, Goldberg Israel
School of Chemistry, Sackler Faculty of Exact Sciences, Tel-Aviv University, Ramat-Aviv, 69978 Tel-Aviv, Israel.
Acta Crystallogr C. 2007 Jul;63(Pt 7):o395-9. doi: 10.1107/S0108270107024936. Epub 2007 Jun 14.
Crystals of the title compounds, 20-(4-pyridyl)porphyrin-5(4),10(4),15(4)-tribenzoic acid-dimethyl sulfoxide (2/5), C(46)H(29)N(5)O(6) x 2.5C(2)H(6)OS, (I), and 20-(4-pyridyl)porphyrin-5(4),10(4),15(4)-tribenzoic acid-4-acetylpyridine-tetrahydrofuran (1/2/10), C(46)H(29)N(5)O(6) x 2C(7)H(7)NO x 10C(4)H(8)O, (II), consist of hydrogen-bonded supramolecular chains of porphyrin units solvated by molecules of dimethyl sulfoxide [in (I)] and 4-acetylpyridine [in (II)]. In (I), these chains consist of heterogeneous arrays with alternating porphyrin and dimethyl sulfoxide species, being sustained by COOH...O=S hydrogen bonds. They adopt a zigzag geometry and link on both sides to additional molecules of dimethyl sulfoxide. In (II), the chains consist of homogeneous linear supramolecular arrays of porphyrin units, which are directly connected to one another via COOH...N(pyridyl) hydrogen bonds. As in the previous case, these arrays are solvated on both sides by molecules of the 4-acetylpyridine ligand via similar COOH(porphyrin)...N(ligand) hydrogen bonds. The two crystal structures contain wide interporphyrin voids, which accommodate disordered/diffused solvent molecules, viz. dimethyl sulfoxide in (I) and tetrahydrofuran in (II).
标题化合物20-(4-吡啶基)卟啉-5(4),10(4),15(4)-三苯甲酸-二甲基亚砜(2/5),C(46)H(29)N(5)O(6)·2.5C(2)H(6)OS,(I),以及20-(4-吡啶基)卟啉-5(4),10(4),15(4)-三苯甲酸-4-乙酰基吡啶-四氢呋喃(1/2/10),C(46)H(29)N(5)O(6)·2C(7)H(7)NO·10C(4)H(8)O,(II)的晶体由卟啉单元的氢键超分子链组成,这些链被二甲基亚砜分子[在(I)中]和4-乙酰基吡啶分子[在(II)中]溶剂化。在(I)中,这些链由卟啉和二甲基亚砜物种交替的异质阵列组成,由COOH...O=S氢键维持。它们呈锯齿形几何形状,两侧与二甲基亚砜的其他分子相连。在(II)中,链由卟啉单元的均匀线性超分子阵列组成,这些阵列通过COOH...N(吡啶基)氢键直接相互连接。与前一种情况一样,这些阵列两侧被4-乙酰基吡啶配体的分子通过类似的COOH(卟啉)...N(配体)氢键溶剂化。这两种晶体结构包含宽的卟啉间空隙,容纳无序/扩散的溶剂分子,即(I)中的二甲基亚砜和(II)中的四氢呋喃。