Force constant calculations for pyramidal four-atom molecules—I The pyramidal XY3 molecules As(CH3)3, AsCl3 and AsBr3

E.G. Claeys, G.P. Van Der Kelen
{"title":"Force constant calculations for pyramidal four-atom molecules—I The pyramidal XY3 molecules As(CH3)3, AsCl3 and AsBr3","authors":"E.G. Claeys,&nbsp;G.P. Van Der Kelen","doi":"10.1016/0371-1951(66)80058-9","DOIUrl":null,"url":null,"abstract":"<div><p>Using W<span>ilson's</span> <strong>FG</strong> matrix technique, general valence force constants and Urey—Bradley force constants of As(CH<sub>3</sub>)<sub>3</sub>, AsCl<sub>3</sub> and AsBr<sub>3</sub>, all molecules of the type XY<sub>3</sub>, have been calculated from published Raman data and structural parameters.</p><p>It appears however that the molecule As(CH<sub>3</sub>)<sub>3</sub> cannot be approached by the Urey—Bradley force field. So the comparative study of the bonding characteristics is limited to the general valence force field data.</p></div>","PeriodicalId":101180,"journal":{"name":"Spectrochimica Acta","volume":"22 12","pages":"Pages 2095-2101"},"PeriodicalIF":0.0000,"publicationDate":"1966-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0371-1951(66)80058-9","citationCount":"15","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Spectrochimica Acta","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/0371195166800589","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 15

Abstract

Using Wilson's FG matrix technique, general valence force constants and Urey—Bradley force constants of As(CH3)3, AsCl3 and AsBr3, all molecules of the type XY3, have been calculated from published Raman data and structural parameters.

It appears however that the molecule As(CH3)3 cannot be approached by the Urey—Bradley force field. So the comparative study of the bonding characteristics is limited to the general valence force field data.

查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
锥体四原子分子的力常数计算——ⅰ。锥体XY3分子As(CH3)3, AsCl3和AsBr3
利用Wilson’s FG矩阵技术,根据已发表的拉曼数据和结构参数,计算了所有XY3型分子As(CH3)3、AsCl3和AsBr3的一般价力常数和Urey-Bradley力常数。然而,分子As(CH3)3似乎不能被Urey-Bradley力场接近。因此,键合特性的比较研究仅限于一般的价态力场数据。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
求助全文
约1分钟内获得全文 去求助
来源期刊
自引率
0.00%
发文量
0
期刊最新文献
Errata The dipole moment of rhodamine B from absorption spectrophotometry The fluorescence spectrum of benzo(f)quinoline Infra-red spectra of sulphamide and sulphamide-d4 Comments on the vibrational assignments of HBCl2 and HBBr2
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1