Journal ArticleDOI
Infrared spectra of diacetylene-hydrogen fluoride complexes in solid argon
Kenneth O. Patten,Lester Andrews +1 more
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This article is published in The Journal of Physical Chemistry.The article was published on 1986-08-01. It has received 18 citations till now. The article focuses on the topics: Diacetylene & Infrared spectroscopy.read more
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Chemical compounds formed from diacetylene and rare-gas atoms: HKrC4H and HXeC4H
TL;DR: New organic rare-gas compounds, HRgC4H (Rg = Kr or Xe), are identified in matrix-isolation experiments supported by ab initio calculations and the IR absorption spectra indicate some further stabilization of the HRg C4H molecules as compared with the correspondingHRgC2H species.
Journal ArticleDOI
A density functional study of weakly bound hydrogen bonded complexes
Asit K. Chandra,Minh Tho Nguyen +1 more
TL;DR: In this article, B3lyP calculations with 6-31++G(d,p) basis functions have been performed on weakly bound hydrogen bonded complexes between HX (X=F,Cl) and alkenes and alkynes, such as C 2 H 4, C 2 h 4, and allene.
Journal ArticleDOI
Reactions of Laser-Ablated Be and Mg Atoms with C2H2: Infrared Spectra and Density Functional Calculations of Novel Metal−Acetylene Species
TL;DR: The 2019 cm-1 C⋮C stretching fundamental for BeCCH is between values for BCCH and AlCCH, which are all slightly blue shifted from acetylene itself as mentioned in this paper.
Journal ArticleDOI
Infrared spectrum of CCH+ in solid argon and neon
TL;DR: In this article, laser-ablation of over ten different transition, lanthanide, and actinide metals with concurrent codeposition of acetylene/argon samples at 7 K produced metal independent absorptions for CCH, CCH−, C4H, and c4H2, in agreement with previous matrix isolation work.
Journal ArticleDOI
Side-Bonded Pd-η2-(C2H2)1,2 and Pd2-η2-(C2H2) Complexes: Infrared Spectra and Density Functional Calculations
Xuefeng Wang,Lester Andrews +1 more
TL;DR: In this paper, the Pd-C2H2 π complex is characterized by a C−C and C−H stretching mode near 1710 cm-1 and a 39.8 kcal/mol binding energy predicted by DFT.
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Kenneth O. Patten,Lester Andrews +1 more