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3,3′‐Dinitro‐2,2′‐dithiodipyridine
Authors:Ivn Brito  Aldo Mundaca  Alejandro Crdenas  Matías Lpez‐Rodríguez
Abstract:In the title compound, C10H6N4O4S2, (I), the molecule has a centre of inversion. The structure is a positional isomer of 5,5′‐dinitro‐2,2′‐dithiodipyridine Brito, Mundaca, Cárdenas, López‐Rodríguez & Vargas (2007). Acta Cryst. E 63 , o3351–o3352], (II). The 3‐nitropyridine fragment of (I) shows excellent agreement with the bonding geometries of (II). The most obvious differences between them are in the S—S bond length 2.1167 (12) Å in (I) and 2.0719 (11) Å in (II)], and in the C—Cipso—Nring 119.8 (2)° in (I) and 123.9 (3)° in (II)] and S—C—C 122.62 (18)° in (I) and 116.0 (2)° in (II)] angles. The crystal structure of (I) has an intramolecular C—H...O interaction, with an H...O distance of 2.40 (3) Å, whereas this kind of interaction is not evident in (II). The molecules of (I) are linked into centrosymmetric R44(30) motifs by a C—H...O interaction. There are no aromatic π–π stacking and no C—H...π(arene) interactions. Compound (I) can be used as a nucleophilic tecton in self‐assembly reactions with metal centres of varying lability.
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