三-[(6-溴-吡啶-2-基)甲基]胺的分子-分子结构。

IF 0.5 Q4 CRYSTALLOGRAPHY Acta Crystallographica Section E: Crystallographic Communications Pub Date : 2024-09-01 DOI:10.1107/S2056989024008685

Ran Yan , Zhaohua Dai , Daniel G. Shlian , Trinit’y D. Mitchell , Aaron Loo , Kaltrina Mulosmani , Rita K. Upmacis

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引用次数: 0

摘要

多齿硝基配体与金属的配位化合物被广泛应用于催化等研究领域，以及作为生物无机化学中酶的复合活性位点模型。三(2-吡啶基甲基)胺（TPA）是一种三元四齿配体，可与金属（包括铜、铁和锌）形成配位化合物。三溴吡啶-2-甲胺（TPABr3）（C18H15Br3N4）是一种相关化合物，在三个吡啶基的 6 位上各有一个溴原子。本文报告了通过 X 射线衍射测定的 TPABr3 的分子结构。TPABr3 分子属于三linic P 空间群，分子间存在有趣的 Br⋯Br 相互作用，对分子内部产生稳定影响。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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Molecular structure of tris[(6-bromopyridin-2-yl)methyl]amine

Crystals of tris[(6-bromopyridin-2-yl)methyl]amine (TPABr₃) were obtained from a solution in acetonitrile upon evaporation. The crystals are triclinic with space group P

Coordination compounds of polydentate nitrogen ligands with metals are used extensively in research areas such as catalysis, and as models of complex active sites of enzymes in bioinorganic chemistry. Tris(2-pyridylmethyl)amine (TPA) is a tripodal tetradentate ligand that is known to form coordination compounds with metals, including copper, iron and zinc. The related compound, tris[(6-bromopyridin-2-yl)methyl]amine (TPABr₃), C₁₈H₁₅Br₃N₄, which possesses a bromine atom on the 6-position of each of the three pyridyl moieties, is also known but has not been heavily investigated. The molecular structure of TPABr₃ as determined by X-ray diffraction is reported here. The TPABr₃ molecule belongs to the triclinic, P

space group and displays interesting intermolecular Br⋯Br interactions that provide a stabilizing influence within the molecule.

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来源期刊

Acta Crystallographica Section E: Crystallographic Communications Chemistry-Chemistry (all)

CiteScore

1.90

自引率

0.00%

发文量

351

审稿时长

3 weeks

期刊介绍： Acta Crystallographica Section E: Crystallographic Communications is the IUCr''s open-access structural communications journal. It provides a fast, simple and easily accessible publication mechanism for crystal structure determinations of inorganic, metal-organic and organic compounds. The electronic submission, validation, refereeing and publication facilities of the journal ensure rapid and high-quality publication of fully validated structures. The primary article category is Research Communications; these are peer-reviewed articles describing one or more structure determinations with appropriate discussion of the science.