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氯代-（5,10,15,20-四苯基-卟啉合-κ(4)N）锰（III）2-氨基吡啶二溶剂合物的晶体结构

Crystal structure of chlorido-(5,10,15,20-tetra-phenyl-porphyrinato-κ(4) N)manganese(III) 2-amino-pyridine disolvate.

作者信息

Harhouri Wafa, Dhifaoui Salma, Najmudin Shabir, Bonifácio Cecilia, Nasri Habib

机构信息

Laboratoire de Physico-chimie des Matériaux, Faculté des Sciences de Monastir, Avenue de l'Environnement, 5019 Monastir, University of Monastir, Tunisia.

Faculdade de Medicina, Veterinària, Universidade Tecnica de Lisboa, Avenida da Universidade Tecnica, 1300-477 Lisboa, Portugal.

出版信息

Acta Crystallogr E Crystallogr Commun. 2015 Jan 17;71(Pt 2):165-7. doi: 10.1107/S205698901500050X. eCollection 2015 Feb 1.

DOI:10.1107/S205698901500050X
PMID:25878809
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC4384609/
Abstract

In the title compound, [Mn(C44H28N4)Cl]·2C5H6N2, the Mn(III) centre is coordinated by four pyrrole N atoms [averaged Mn-N = 2.012 (4) Å] of the tetra-phenyl-porphyrin mol-ecule and one chloride axial ligand [Mn-Cl = 2.4315 (7) Å] in a square-pyramidal geometry. The porphyrin macrocycle exhibits a non-planar conformation with major ruffling and saddling distortions. In the crystal, two independent solvent mol-ecules form dimers through N-H⋯N hydrogen bonding. In these dimers, one amino N atom has a short Mn⋯N contact of 2.642 (1) Å thus completing the Mn environment in the form of a distorted octa-hedron, and another amino atom generates weak N-H⋯Cl hydrogen bonds, which link further all mol-ecules into chains along the a axis.

摘要

在标题化合物[Mn(C₄₄H₂₈N₄)Cl]·2C₅H₆N₂中，Mn(III)中心由四苯基卟啉分子的四个吡咯N原子[平均Mn-N = 2.012 (4) Å]和一个氯化物轴向配体[Mn-Cl = 2.4315 (7) Å]以四方锥几何构型配位。卟啉大环呈现出具有主要褶皱和鞍形畸变的非平面构象。在晶体中，两个独立的溶剂分子通过N-H⋯N氢键形成二聚体。在这些二聚体中，一个氨基N原子与Mn有2.642 (1) Å的短接触，从而以扭曲八面体的形式完成了Mn的配位环境，另一个氨基原子形成弱N-H⋯Cl氢键，这些氢键进一步将所有分子沿a轴连接成链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5d26/4384609/20b342e0e35d/e-71-00165-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5d26/4384609/1d77f61feeb1/e-71-00165-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5d26/4384609/20b342e0e35d/e-71-00165-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5d26/4384609/1d77f61feeb1/e-71-00165-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5d26/4384609/20b342e0e35d/e-71-00165-fig2.jpg

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