Infrared spectra and density functional theory calculations of coinage metal disulfide molecules and complexes

Wang XF; Liang BY; Andrews L

首页> 外文期刊>Dalton transactions: An international journal of inorganic chemistry >Infrared spectra and density functional theory calculations of coinage metal disulfide molecules and complexes

【24h】

Infrared spectra and density functional theory calculations of coinage metal disulfide molecules and complexes

机译：造币金属二硫键分子和配合物的红外光谱和密度泛函理论计算

获取原文

获取原文并翻译 | 示例

掌桥外文数据库（机构版） >>

开具论文收录证明 >>

文献代查 >>

页面导航

摘要
著录项
相似文献
相关主题

摘要

Sulfur diatomic molecules were reacted with laser ablated Cu, Ag, and Au atoms in excess argon and condensed at 7 K. Several reaction products were identified for each metal from matrix infrared spectra through sulfur-34 isotopic shifts, spectra of sulfur isotopic mixtures, and frequencies calculated by density functional theory. The linear centrosymmetric (CuS2)-Cu-63, (CuS2)-Cu-65, and AuS2 metal disulfide molecules were observed at 508.7, 504.8, and 455.9 cm(-1), respectively. The bent CuSS, AgSS, and AuSS isomers were identified from 608.6, 580.7, and 601.1 cm(-1) S-S stretching fundamentals, respectively. These group 11 metals also formed cyclic tetrasulfur molecules, MS4, in contrast to group 10 metal atoms, which formed side-bonded disulfur complexes M(S-2)(2).

机译：硫双原子分子与激光烧蚀后的过量氩气中的Cu，Ag和Au原子反应并在7 K处冷凝。从基质红外光谱，硫34同位素位移，硫同位素混合物的光谱以及通过密度泛函理论计算的频率。线性中心对称（CuS2）-Cu-63，（CuS2）-Cu-65和AuS2金属二硫化物分子分别在508.7、504.8和455.9 cm（-1）处观察到。分别从608.6、580.7和601.1 cm（-1）S-S拉伸基础上确定了弯曲的CuSS，AgSS和AuSS异构体。与第10组金属原子形成侧键合的二硫配合物M（S-2）（2）相比，这些第11组金属还形成了环状四硫分子MS4。

著录项

来源
《Dalton transactions: An international journal of inorganic chemistry》 |2009年第21期|共9页
作者
Wang XF; Liang BY; Andrews L;
展开▼
作者单位

展开▼
收录信息
原文格式 PDF
正文语种 eng
中图分类化学;
关键词
ELECTRON-SPIN-RESONANCE; SOLID ARGON; TRANSITION-METALS; OXYGEN COMPLEXES; COPPER OXIDES; ATOMS; SULFIDES; CU; MATRICES; AU;

机译：电子自旋共振;固体氩;过渡金属;氧络合物;铜氧化物;原子;硫化物;CU;材料;AU;

相似文献

外文文献
中文文献
专利

1. Infrared spectra and density functional theory calculations of coinage metal disulfide molecules and complexes [J] . Wang XF, Liang BY, Andrews L Dalton transactions: An international journal of inorganic chemistry . 2009,第21期

机译：造币金属二硫键分子和配合物的红外光谱和密度泛函理论计算
2. Infrared Spectra and Density Functional Theory Calculations of Group 10 Transition Metal Sulfide Molecules and Complexes [J] . Binyong Liang, Xuefeng Wang, Lester Andrews The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2009,第14期

机译：第10族过渡金属硫化物分子和配合物的红外光谱和密度泛函理论计算
3. Infrared Spectra and Density Functional Theory Calculations of Group 8 Transition Metal Sulfide Molecules [J] . Binyong Liang, Xuefeng Wang, Lester Andrews The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2009,第18期

机译：8族过渡金属硫化物分子的红外光谱和密度泛函理论计算
4. Adsorption of Alkanethiols on Coinage Metals.A Density Functional Theory Investigation [C] . A.Ferral, F.Cometto, P.Paredes Olivera The Meeting of the Electrochemical Society . 2001

机译：在凝固金属上吸附链烷醇。密度函数理论调查
5. Matrix infrared spectroscopy and density functional theory calculations of novel transition metal-containing molecules. [D] . Liang, Binyong. 2002

机译：新型含过渡金属分子的基质红外光谱和密度泛函理论计算。
6. Adsorption of iron tetraphenylporphyrin on (111) surfaces of coinage metals: a density functional theory study [O] . Hao Tang, Nathalie Tarrat, Véronique Langlais, 2017

机译：四苯基卟啉铁在造币金属（111）表面的吸附：密度泛函理论研究
7. “Troublesome ” Vibrations of Aromatic Molecules in Second-Order Mo1ller-Plesset and Density Functional Theory Calculations: Infrared Spectra of Phenol and Phenol-OD Revisited [O] . Danuta Michalska, Wiktor Zierkiewicz, Dariusz C. Bieńko, 2015

机译：二阶mo1ller-plesset中芳烃分子的“麻烦”振动和密度泛函理论计算：苯酚和酚-OD的红外光谱重新检测
8. Calculation of Vibrational and Electronic Excited-State Absorption Spectra of Arsenic-Water Complexes Using Density Functional Theory. [R] . Huang, L., Lambrakos, S. G., Shabaev, A., 2016

机译：用密度泛函理论计算砷 - 水配合物的振动和电子激发态吸收光谱。

Infrared spectra and density functional theory calculations of coinage metal disulfide molecules and complexes

摘要

著录项

相似文献

相关主题

期刊订阅