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相关概念视频

Valence Bond Theory02:42

Valence Bond Theory

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Coordination compounds and complexes exhibit different colors, geometries, and magnetic behavior, depending on the metal atom/ion and ligands from which they are composed. In an attempt to explain the bonding and structure of coordination complexes, Linus Pauling proposed the valence bond theory, or VBT, using the concepts of hybridization and the overlapping of the atomic orbitals. According to VBT, the central metal atom or ion (Lewis acid) hybridizes to provide empty orbitals of suitable...
8.6K
Crystal Field Theory - Tetrahedral and Square Planar Complexes02:46

Crystal Field Theory - Tetrahedral and Square Planar Complexes

42.7K
Tetrahedral Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
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Predicting Molecular Geometry02:27

Predicting Molecular Geometry

34.4K
VSEPR Theory for Determination of Electron Pair Geometries
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Complexation Equilibria: The Chelate Effect01:19

Complexation Equilibria: The Chelate Effect

524
In complexation reactions, metal atoms or cations interact with ligands to form donor-acceptor adducts called metal complexes. Ligands that bind through one donor site are monodentate, ligands with two donor sites are bidentate, and those with more than two donor sites are polydentate ligands. For example, ethylene diamine is a bidentate ligand that binds through two nitrogen donor atoms, forming a five-membered ring. EDTA is a polydentate ligand that binds through four oxygen and two nitrogen...
524
Complexation Equilibria: Factors Influencing Stability of Complexes01:09

Complexation Equilibria: Factors Influencing Stability of Complexes

380
In complexation reactions, metal cations are the electron pair acceptors, and the ligands are the electron pair donors. The stability of the metal complexes depends primarily on the complexing ability of the central metal ion and the nature of the ligands. Generally, the complexing ability of the metal ion depends on the size and charge of the ion. As the metal ion size increases, the stability of the metal complexes decreases, provided that the valency of the metal ion and the ligands remain...
380
Metal-Ligand Bonds02:51

Metal-Ligand Bonds

20.8K
The hemoglobin in the blood, the chlorophyll in green plants, vitamin B-12, and the catalyst used in the manufacture of polyethylene all contain coordination compounds. Ions of the metals, especially the transition metals, are likely to form complexes.
In these complexes, transition metals form coordinate covalent bonds, a kind of Lewis acid-base interaction in which both of the electrons in the bond are contributed by a donor (Lewis base) to an electron acceptor (Lewis acid). The Lewis acid in...
20.8K

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相关实验视频

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Preparation and Reactivity of a Triphosphenium Bromide Salt: A Convenient and Stable Source of PhosphorusI
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Preparation and Reactivity of a Triphosphenium Bromide Salt: A Convenient and Stable Source of PhosphorusI

Published on: November 22, 2016

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三素─封闭外金属电离子相互作用

Damian P Duda1, David A Dixon1

  • 1Department of Chemistry and Biochemistry, The University of Alabama, Tuscaloosa, Alabama 35487-0336, United States.

The journal of physical chemistry. A
|November 15, 2023
PubMed
概括

1组和2组的阴离子与trifenylphosphine相互作用.

科学领域:

  • 计算化学的计算化学
  • 量子化学 是一个量子化学.
  • 化学物理 化学物理

背景情况:

  • 三四素是协调化学中的多功能连接体.
  • 对于催化和材料科学来说,了解阴离子-连接体相互作用至关重要.

研究的目的:

  • 研究1组和11组单和2组二与三酸的结合方式和能量.
  • 分析阴离子-π相互作用和替代剂效应.

主要方法:

  • 相关的分子轨道理论
  • 密度函数理论 (DFT) 是一种密度函数理论.

主要成果:

  • 发现了两种结合方式:单对和环.
  • 1组和2组的电离子有利于π系结合,与离子半径和硬度相关.
  • 11组单离子更喜欢单对结合,与离子硬度相关.

结论:

  • 在trifenylphosphine复合体中,阴离子-π相互作用是显著的.
  • 离子性质决定了结合偏好和强度.
  • 计算方法提供了可靠的数据,用于介质-连接物相互作用.

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