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双-{()-2-[(2-羟基苄基)-氨基]-4-甲基戊酸根-κ,}(1,10-菲咯啉-κ,')镍(II)的晶体结构与密度泛函理论研究

Crystal structure and DFT study of bis-{()-2-[(2-hy-droxy-benzyl)-amino]-4-methyl-penta-noato-κ,}(1,10-phenanthroline-κ,')nickel(II).

作者信息

Faizi Md Serajul Haque, Dege Necmi, Malinkin Sergey

机构信息

Department of Chemistry, College of Science, Sultan Qaboos University, PO Box 36 Al-Khod 123, Muscat, Sultanate of Oman.

Ondokuz Mayıs University, Arts and Sciences Faculty, Department of Physics, 55139 Atakum-Samsun, Turkey.

出版信息

Acta Crystallogr E Crystallogr Commun. 2017 Aug 30;73(Pt 9):1393-1397. doi: 10.1107/S2056989017012014. eCollection 2017 Sep 1.

DOI:10.1107/S2056989017012014
PMID:28932483
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC5588589/
Abstract

In the title compound, [Ni(CHNO)(CHN)], the Ni cation shows a distorted octa-hedral coordination environment. It is formed by two N atoms from the phenanthroline ligand, as well as two N and two O atoms belonging to two 2-[(2-hy-droxy-benz-yl)amino]-4-methyl-penta-noate ligands. Complex mol-ecules are connected into layers propagating along the plane hydrogen bonds formed by O atoms of carboxyl-ate and phenoxide groups, which are further connected into a three-dimensional motif.

摘要

在标题化合物[Ni(CHNO)(CHN)]中，镍阳离子呈现出扭曲的八面体配位环境。它由菲咯啉配体的两个氮原子以及属于两个2-[(2-羟基苄基)氨基]-4-甲基戊酸酯配体的两个氮原子和两个氧原子构成。配合物分子通过羧酸根和酚氧基的氧原子形成的氢键连接成沿平面传播的层，这些层进一步连接成三维结构。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/103367440efb/e-73-01393-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/cd81de4d6858/e-73-01393-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/60658aaa6235/e-73-01393-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/179b86901e51/e-73-01393-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/103367440efb/e-73-01393-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/cd81de4d6858/e-73-01393-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/60658aaa6235/e-73-01393-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/179b86901e51/e-73-01393-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fe40/5588589/103367440efb/e-73-01393-fig4.jpg

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