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双[μ-3-(吡啶-2-基)吡唑合]双[乙酸根-(3,5-二甲基-1-吡唑)-镍(II)]

Bis[μ-3-(pyridin-2-yl)pyrazolato]bis-[acetato-(3,5-dimethyl-1-pyrazole)-nickel(II)].

作者信息

Pilavadi Thangamuniyandi, Krishnan Soundararajan, Loganathan Nagarajan

机构信息

School of Chemistry Bharathidasan University, Tiruchirappalli 620 024 Tamilnadu India.

Department of Chemistry, Periyar Maniammai Institute of Science and Technology, Vallam-613403, Thanjavur, Tamil Nadu, India.

出版信息

IUCrdata. 2024 Aug 30;9(Pt 8):x240810. doi: 10.1107/S2414314624008101. eCollection 2024 Aug.

DOI:10.1107/S2414314624008101
PMID:39247075
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11375596/
Abstract

The title compound, [Ni(CHN)(CHO)(CHN)] or [Ni(-OOCCH)(2-PyPz)(MePzH)] () [2-PyPz = 3-(pyridin-2-yl) pyrazole; MePzH = 3,5-dimethyl pyrazole] was synthesized from Ni(OOCCH)·4HO, 2-PyPzH, MePzH and tri-ethyl-amine as a base. Compound {[Ni(CHNNiO)]} at 100 K has monoclinic (2/) symmetry and the mol-ecules have crystallographic inversion symmetry. Mol-ecules of comprise an almost planar dinuclear Ni core with an NO coordination environment. The equatorial plane consists of N,O coordination derived from one of the bidentate acetate O atoms and three of the N atoms of the chelating 2-PyPz ligand while the axial positions are occupied by neutral MePzH and the second O atom of the acetate unit. The Ni atoms are bridged by the nitro-gen atom of a deprotonated 2-PyPz ligand. Compound exhibits various inter- and intra-molecular C-H⋯O and N-H⋯O hydrogen bonds.

摘要

标题化合物[Ni(CHN)(CHO)(CHN)]或[Ni(-OOCCH)(2-PyPz)(MePzH)]()[2-PyPz = 3-(吡啶-2-基)吡唑;MePzH = 3,5-二甲基吡唑]由Ni(OOCCH)·4HO、2-PyPzH、MePzH和作为碱的三乙胺合成。化合物{[Ni(CHNNiO)]}在100 K时具有单斜(2/)对称性,分子具有晶体学反演对称性。的分子包含一个几乎平面的双核Ni核,具有NO配位环境。赤道平面由来自一个双齿乙酸根O原子和螯合2-PyPz配体的三个N原子的N,O配位组成,而轴向位置由中性MePzH和乙酸根单元的第二个O原子占据。Ni原子由去质子化的2-PyPz配体的氮原子桥连。化合物表现出各种分子间和分子内的C-H⋯O和N-H⋯O氢键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8385/11375596/291f0068a6ac/x-09-x240810-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8385/11375596/938d00f7f025/x-09-x240810-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8385/11375596/291f0068a6ac/x-09-x240810-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8385/11375596/938d00f7f025/x-09-x240810-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8385/11375596/291f0068a6ac/x-09-x240810-fig2.jpg

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