稀有气体与芳香分子的键能:吡啶的旋转光谱和动力学?霓虹灯

PhysChemComm Pub Date : 2000-01-01 DOI:10.1039/A909649C
W. Caminati, S. Melandri, A. Dell'Erba, P. Favero
{"title":"稀有气体与芳香分子的键能:吡啶的旋转光谱和动力学?霓虹灯","authors":"W. Caminati, S. Melandri, A. Dell'Erba, P. Favero","doi":"10.1039/A909649C","DOIUrl":null,"url":null,"abstract":"The rotational spectrum of the pyridazine(((Ne complex, a species observable in supersonic expansions, has been measured by free jet absorption millimeter wave spectroscopy. The equilibrium configuration, dynamics and dissociation energy have been deduced from the spectroscopic constants. The equilibrium distance of Ne with respect to the center of mass of the molecule is 3.26 A, with the Ne atom tilted by 5.8° from the perpendicular to the center of mass of the ring towards the mid-point of the two nitrogen atoms. The dissociation energy is estimated, from the centrifugal distortion constant DJ, to be ca. 0.8 kJ mol?1.","PeriodicalId":20106,"journal":{"name":"PhysChemComm","volume":null,"pages":null},"PeriodicalIF":0.0000,"publicationDate":"2000-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"6","resultStr":"{\"title\":\"Bonding energies of rare gases with aromatic molecules: rotational spectrum and dynamics of pyridazine?neon\",\"authors\":\"W. Caminati, S. Melandri, A. Dell'Erba, P. Favero\",\"doi\":\"10.1039/A909649C\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"The rotational spectrum of the pyridazine(((Ne complex, a species observable in supersonic expansions, has been measured by free jet absorption millimeter wave spectroscopy. The equilibrium configuration, dynamics and dissociation energy have been deduced from the spectroscopic constants. The equilibrium distance of Ne with respect to the center of mass of the molecule is 3.26 A, with the Ne atom tilted by 5.8° from the perpendicular to the center of mass of the ring towards the mid-point of the two nitrogen atoms. The dissociation energy is estimated, from the centrifugal distortion constant DJ, to be ca. 0.8 kJ mol?1.\",\"PeriodicalId\":20106,\"journal\":{\"name\":\"PhysChemComm\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2000-01-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"6\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"PhysChemComm\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1039/A909649C\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"PhysChemComm","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1039/A909649C","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 6

摘要

用自由射流吸收毫米波光谱法测定了在超音速膨胀中可观测到的吡嗪(Ne)配合物的旋转光谱。从光谱常数推导出了平衡构型、动力学和解离能。Ne原子相对于分子质心的平衡距离为3.26 A, Ne原子从与环质心的垂直方向向两个氮原子的中点倾斜5.8°。根据离心畸变常数DJ,估计离解能约为0.8 kJ mol?1。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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
Bonding energies of rare gases with aromatic molecules: rotational spectrum and dynamics of pyridazine?neon
The rotational spectrum of the pyridazine(((Ne complex, a species observable in supersonic expansions, has been measured by free jet absorption millimeter wave spectroscopy. The equilibrium configuration, dynamics and dissociation energy have been deduced from the spectroscopic constants. The equilibrium distance of Ne with respect to the center of mass of the molecule is 3.26 A, with the Ne atom tilted by 5.8° from the perpendicular to the center of mass of the ring towards the mid-point of the two nitrogen atoms. The dissociation energy is estimated, from the centrifugal distortion constant DJ, to be ca. 0.8 kJ mol?1.
求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
自引率
0.00%
发文量
0
期刊最新文献
Theoretical studies of the electronic properties of confined aromatic molecules in support of electronic confinement effect Theoretical studies on hyperpolarizabilities and UV-vis-IR spectra of a diamminecobalt(III) tetripeptide transition-metal complex Thermoacoustical approach to the intermolecular free-length of liquid mixtures H2O-catalyzed formation of O3 in the self-reaction of HO2: a computational study on the effect of nH2O (n = 1–3) Formation energies of lithium intercalations in AlSb, GaSb and InSb
×
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