Patterns in synchrotron near-free-rotor FIR spectra of CH3OH and CD3OH – The tau of methanol

2020 ◽  
Vol 1209 ◽  
pp. 127960
Author(s):  
R.M. Lees ◽  
Li-Hong Xu ◽  
B.E. Billinghurst
Keyword(s):  
1984 ◽  
Vol 39 (11) ◽  
pp. 1490-1499 ◽  
Author(s):  
H. Homborg ◽  
W. Kalz

Abstract The preparation of anionic phthalocyaninato-cobaltates(III) [CoX2Pc(2-)]- (X = OH . F, CI, Br) is described. The UV -VIS. IR and Resonance-R am an (RR ) spectra are measured and com pared with those of the complexes [CoX2Pc(1 -)] (X = Cl, Br) containing the phthalocyanine-π-cation- radical.The characteristic spectroscopical differences for the Pc(1-)- and Pc(2-)-Ligands are discussed. Besides the typical B-, Q- and N-transitions of the Pc(1 -)- and Pc(2 -)-ligand additional weak bands are observed in the UV -VIS spectra for both dichloro- and dibromocomplexes. These bands are assigned to X (π , σ) → Co electron transfer a2u(πx), a2u(σx) → a1g(d); for the Pc(1 - )-complexes Cl(π) is at 22.9, Cl(σ) at 38.9. Br(π-) at 19.6 and Br(σ) at 36.4 kK. For the Pc(2-)-complexes these bands are slightly red-shifted by about 0.5 kK. The assignment is confirm ed by the RR-spectra. For both dichloro- and dibromo-complexes the sym. (Co-X)- stretching vibration (a1g, ν1) is strongly RR-enhanced and up to four overtones of ν1 are observed (for Pc(2-): ν ( Co - X ) for X = Cl: 270. Br: 165 cm-1; for Pc ( 1 - ) : X = Cl: 280. Br: 168 cm-1). The antisym. (Co -X)-stretching vibration (a2u) is observed in the FIR spectra (for Pc(2 -): ν(Co-X) for X = F: 546. Cl: 333. Br: 243 cm-1; for Pc ( 1 - ) : X = Cl: 326. Br: 250 cm-1).


1991 ◽  
Vol 46 (6) ◽  
pp. 789-794 ◽  
Author(s):  
M. Somer ◽  
D. Thiery ◽  
K. Peters ◽  
L. Walz ◽  
M. Hartweg ◽  
...  

The compounds Cs6M2X4 (M = Al, Ga; X = P, As) were synthesized from stoichiometric mixtures of Cs, M and Cs4X6 in sealed Nb ampoules at 950 K. They are isotypic and crystallize in the monoclinic space group P21/c (No. 14) with Z = 4 formula units per unit cell. The anion partial structure is characterized by isolated [M2X4]6- units with relatively short distances for the terminal d(M–X) bonds corresponding to a Pauling Bond Order PBO = 1.5. The distances d(M–X) of the four-membered M2X2 rings correspond to single bonds.The FIR spectra have been interpreted on the basis of the [M2X4]6- units with 2/m 2/m 2/m-D2h, symmetry by considering a factor group splitting. The assignment of the observed frequencies is supported by a normal coordinate analysis.


RSC Advances ◽  
2017 ◽  
Vol 7 (37) ◽  
pp. 22771-22776 ◽  
Author(s):  
Qing-Rui Dong ◽  
Chun-Xiang Liu

We study theoretically the triangular zigzag graphene quantum dot in electric fields and find that there exist the remarkable optical selection rules in the FIR spectra.


2010 ◽  
Vol 260 (2) ◽  
pp. 139-140 ◽  
Author(s):  
M. Elkeurti ◽  
L.H. Coudert ◽  
J. Orphal ◽  
G. Wlodarczak ◽  
C.E. Fellows ◽  
...  
Keyword(s):  

2008 ◽  
Vol 251 (1-2) ◽  
pp. 90-101 ◽  
Author(s):  
M. Elkeurti ◽  
L.H. Coudert ◽  
J. Orphal ◽  
G. Wlodarczak ◽  
C.E. Fellows ◽  
...  
Keyword(s):  

1984 ◽  
Vol 24 (2-3) ◽  
pp. 201-208 ◽  
Author(s):  
S.K. Husain ◽  
J.B. Hasted ◽  
D. Rosen ◽  
E. Nicol ◽  
J.R. Birch
Keyword(s):  

1994 ◽  
Vol 49 (1) ◽  
pp. 50-56 ◽  
Author(s):  
Svend Sievertsen ◽  
Hendrik Schlehahn ◽  
Heiner Homborg

Abstract Low spin di(bromo)phthalocyaninatometalates of tervalent iron, ruthenium and osmium ([MBr2Pc2-]-) are formed by the reaction of [FeBrPc2-] or H[MBr2Pc2-] (M = Ru, Os) with excess bromide in DMF or THF and isolated as (nBu4N)+ salts. The electronic spectra show the typical π- π*- transitions (B, Q, N region) of the Pc2- ligand together with a number of extra bands due to trip-multiplett and (Pc, Br → M)CT transitions. νs(MBr) is observed in the resonance Raman (RR) spectrum (RR enhanced for M = Fe, Ru) at 161 cm-1 (Fe), 183 cm-1 (Ru) and 192 cm-1 (Os), νas(MBr) at 251 cm-1 (Fe), 234 cm-1 (Ru) and 218 cm-1 (Os) in the FIR spectra. The RR spectra obtained by excitation at low absorbance between the B and Q region are dominated by the intraconfigurational " Γ7 →Γ 8" transition due to spin orbit splitting of the 2T2g ground state for Fe at 583 cm-1, Ru at 1026/1050 cm-1 and Os at 3131 cm-1 . In the MIR resp. NIR spectra vibronically induced transitions are observed for the Ru or Os complex.


1996 ◽  
Vol 169 ◽  
pp. 627-628
Author(s):  
N. Junkes

G54.4–0.3 is an extended shell-type supernova remnant (SNR) in the Galactic plane. We selected this source as a candidate for the interaction of SNRs with the interstellar medium on the base of an investigation of cool IRAS point sources in the direction of SNRs. We found a statistical excess of IRAS sources with FIR spectra similar to young stellar objects (Td ≈ 25 − 45 K) in the vicinity of G54.4–0.3 and a number of other SNRs in the northern hemisphere (Junkes & Fürst 1992).


1974 ◽  
Vol 15 (3) ◽  
pp. 526-530 ◽  
Author(s):  
Eva-Maria Amrhein ◽  
Delbert E. Day ◽  
Norbert J. Kreidel ◽  
J.H. Weaver

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