Schwingungsspektren und Kraftkonstanten der Hexacyano-Komplexe des Mangan(I), Technetium(I) und Rhenium(I) / Vibrational Spectra and Force Constants of the Hexacyano Complexes of Mangan(l), Technicium(I) and Rhenium(l)

1972 ◽  
Vol 27 (8-9) ◽  
pp. 1193-1196 ◽  
Author(s):  
W. Krasser ◽  
K. Schwochau
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Vibrational Spectra ◽  
Point Group ◽  
Force Constants ◽  
Irreducible Representations ◽  
Infrared And Raman Spectra ◽  
Valence Force ◽  
Valence Force Field ◽  
Complex Salts

The infrared and Raman spectra of the complex salts K5[Mn(CN)6], K5[Tc(CN)6] and K5[Re(CN)s] have been recorded in the range from 4000 to 40 cm-1. All expected fundamental vibrations have been observed and could be assigned to the irreducible representations of the sym­metry point group Oh . The calculation of the force constants is based on the concept of the generalized valence force field. The low CN-valence force constants indicate the relatively strong Π-bonding character of the metal carbon bond, which is especially pronounced for K5[Tc(CN)6).

scholarly journals Vibrational Spectra and Force Constants of Tetrasulfurtetranitride, S4N4 [1]

1981 ◽  
Vol 36 (8) ◽  
pp. 850-858 ◽  
Author(s):  
Ralf Steudel
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Vibrational Spectra ◽  
Point Group ◽  
Force Constants ◽  
Infrared And Raman Spectra ◽  
Valence Force ◽  
Group D ◽  
Single Bonds ◽  
Good Agreement

Abstract Infrared and Raman spectra of solid and dissolved S414N4 and of solid S415N4 have been recorded and assigned in accordance with the molecular point group D2d. 22 of the 28 fundamental vibrations of both molecules have been identified and used to calculate force constants applying a modified Urey-Bradley force field with 9 independent constants. Good agreement between observed and calculated wavenumbers was obtained, and both Urey-Bradley and valence force constants are given. The results indicate that-S4N4 basically contains eight SN single bonds and two extremely weak SS bonds.

scholarly journals The Vibrational Spectra of Silane and Germane Derivatives. Part IV. The Infrared and Raman Spectra of the Iodo(methyl)germanes

1971 ◽  
Vol 49 (18) ◽  
pp. 2931-2936 ◽  
Author(s):  
J. W. Anderson ◽  
G. K. Barker ◽  
J. E. Drake And ◽  
R. T. Hemmings
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Vibrational Spectra ◽  
A Priori ◽  
Normal Coordinate Analysis ◽  
Infrared And Raman Spectra ◽  
Normal Coordinate ◽  
Valence Force ◽  
Valence Force Field ◽  
Fundamental Frequencies

The infrared and Raman spectra of the series of iodo(methyl)germanes, CH3GeI3, (CH3)2GeI2, and (CH3)3GeI have been recorded. A normal coordinate analysis based on a modified valence force field confirms the a priori assignments for all of the fundamental frequencies except the torsional modes.

The vibrational spectra of some phenylmercuric halides and diphenylmercury

1977 ◽  
Vol 30 (9) ◽  
pp. 1905 ◽  
Author(s):  
CG Barraclough ◽  
GE Berkovic ◽  
GB Deacon
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Infrared Spectra ◽  
Vibrational Spectra ◽  
Infrared And Raman Spectra ◽  
Normal Coordinate ◽  
Valence Force ◽  
Valence Force Field ◽  
Phenylmercuric Chloride ◽  
Good Agreement

The Raman spectra of phenylmercuric chloride, phenylmercuric bromide, phenylmercuric iodide and diphenylmercury, and the infrared and Raman spectra of diphenylmercury in solution are reported. Using the previously reported infrared spectra of these compounds, vibrations were assigned, normal coordinate analyses were performed and frequencies were calculated using a valence force field. Good agreement was achieved between observed and calculated frequencies. The structure of diphenyl-mercury in solution is discussed.

On the application of OVFF to MX6 type ions

1972 ◽  
Vol 27 (5) ◽  
pp. 867-869 ◽  
Author(s):  
J. N. Rai ◽  
S. N. Tiwary ◽  
S. N. Rai
Keyword(s):  
Force Field ◽  
Point Group ◽  
Force Constants ◽  
Valence Force ◽  
Valence Force Field

AbstractForce constants for nine ions belonging to Oh point group have been evaluated by using Orbital Valence Force Field. The constants have been compared with their values obtained by using Urey-Bradley Force Field. The validity of the two methods has been discussed

Studies of silyl and germyl group VI species. Part VI. Synthesis and vibrational spectra of methylthiosilanes

1981 ◽  
Vol 59 (19) ◽  
pp. 2909-2920 ◽  
Author(s):  
John E. Drake ◽  
Boris M. Glavinčevski ◽  
Layla N. Khasrou
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Vibrational Spectra ◽  
Ir And Raman Spectra ◽  
Normal Coordinate ◽  
Group Vi ◽  
Valence Force ◽  
Valence Force Field ◽  
Ir And Raman

Methylthiosilanes of the type (CH3)nH3−nSiSCH3, n = 0–3, and (CH3)HSi(SCH3)2 have been prepared. Their ir and Raman spectra were recorded and assigned. The assignments were supported by normal coordinate analyses based on a modified valence force field.

Darstellung und spektroskopische Charakterisierung der Oxorhenate(V), [ReOI4]–und [ReO(SCF3)4]–/ Preparation and Spectroscopic C haracterization of the Oxorhenates(V), [ReOI4]–and [ReO(SCF3)4]–

1993 ◽  
Vol 48 (1) ◽  
pp. 44-47 ◽  
Author(s):  
W. Preetz
Keyword(s):  
Force Field ◽  
Vibrational Spectra ◽  
Ligand Exchange ◽  
Nmr Spectra ◽  
Point Group ◽  
Exchange Reactions ◽  
Normal Coordinate ◽  
Valence Force ◽  
Valence Force Field ◽  
First Time

By ligand exchange reactions of (n-Bu4N )[ReOBr4] with NaI dissolved in acetone pure (n-Bu4N )[ReOI4], and with AgSCF3 suspended in dichloromethane (n-Bu4N )[ReO(SCF3)4] have been prepared for the first time. The vibrational spectra of both complexes are assigned according to point group C4v, supported by normal coordinate analysis based on a general valence force field. 13C and ,19F NMR spectra provide evidence for the equivalence o f the SCF3 groups.

Notizen:Schwingungsspektrum und Kraftfeld von Natriumhexanitrokobaltat

1969 ◽  
Vol 24 (10) ◽  
pp. 1667-1668
Author(s):  
Wolfgang Krasser
Keyword(s):  
Raman Spectrum ◽  
Force Field ◽  
Point Group ◽  
Vibrational Frequencies ◽  
Force Constants ◽  
Selection Rules ◽  
Valence Force ◽  
Valence Force Field ◽  
Infrared Data

Abstract The Raman spectrum of Na3[Co(NO,)8] has been mea-sured in the range from 2000 to 50 cm 1 and the vibrational frequencies and their assignment are compared with infrared data already obtained. The force constants are calculated in the valence force field. With respect to vibrational spectro-scopy the CoN6-octaeder and the N02-group are assumed to be approximately two separate units. The justification of this approximation is discussed on the basis of the Raman spec-trum and the selection rules for the Symmetrie point group S6 of Na3 [Co (N02) 6]. Gefärbte Substanzen mit Absorptionsbanden im kurzwelligen sichtbaren Spektralbereich eignen sich vorzüglich für die Aufnahme des Raman-Spektrums, wenn man einen He —Ne-Laser mit seinem relativ lang-welligen Erregerlicht einsetzt 1 . Ein Molekül mit

Vibrational spectra and a force field for H2S3 and H2S4

1969 ◽  
Vol 47 (10) ◽  
pp. 1633-1637 ◽  
Author(s):  
H. Wieser ◽  
P. J. Krueger ◽  
E. Muller ◽  
J. B. Hyne
Keyword(s):  
Force Field ◽  
Least Squares ◽  
Concentration Dependence ◽  
Raman Spectra ◽  
Vibrational Spectra ◽  
Average Error ◽  
Infrared And Raman Spectra ◽  
Valence Force Field ◽  
Least Squares Fit ◽  
Complete Assignment

The infrared and Raman spectra of H2S3 and H2S4 in CCl4 and CS2 solutions are reported and a complete assignment is presented. On the basis of the spectra and their temperature and concentration dependence, H2S3 is considered to be in the GG and H2S4 in the GG′G conformation. A valence force field is derived which provides a least-squares fit between observed and calculated frequencies for both molecules simultaneously, with an average error of 1.5 cm−1 (or 0.4%) over all frequencies.

Raman Spectra of Gases. XXII. (CH3)3SiCl, (CD3)3SiCl and Some Normal Coordinate Calculations on (CH3)3SiNCO and (CH3)3SiNCS

1979 ◽  
Vol 33 (4) ◽  
pp. 364-371 ◽  
Author(s):  
J. R. Durig ◽  
M. Jalilian
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Force Constants ◽  
Normal Coordinate ◽  
Vibrational Coupling ◽  
Valence Force ◽  
Vibrational Assignments ◽  
Valence Force Field ◽  
Normal Coordinate Calculation

The Raman spectra (0 to 3600 cm−1) of gaseous (CH3)3SiCl and (CD3)3SiCl have been recorded. It was possible to resolve the symmetric and antisymmetric SiC3 deformations. The spectra are discussed in detail and previous vibrational assignments are compared. A normal coordinate calculation has been carried out utilizing a modified simple valence force field. The extent of the vibrational coupling has been determined. It is believed that the main force constants should be transferable to other substituted trimethylsilyl compounds and this transferability is demonstrated by some normal coordinate calculations for trimethylsilylisocyanate and trimethylsilylisothiocyanate.

Schwingungsspektren und Normalkoordinatenanalyse der Bromo-Iodo-Osmate(IV), [OsBrnI6-n]2-, n = 0-6 / Vibrational Spectra and Normal Coordinate Analysis of Bromo-Iodo-Osmates(IV), [OsBrnI6-n]2-, n = 0-6

1992 ◽  
Vol 47 (12) ◽  
pp. 1667-1672 ◽  
Author(s):  
W. Preetz ◽  
M. Manthey
Keyword(s):  
Low Temperature ◽  
Force Field ◽  
Raman Spectra ◽  
Vibrational Spectra ◽  
Normal Coordinate ◽  
Geometrical Isomers ◽  
Valence Force ◽  
Valence Force Field ◽  
Point Groups ◽  
Ir And Raman

The IR and Raman spectra of the ten bromo-iodo-osmates(IV) [OsBrnI6-n]2-, n = 0-6, including the geometrical isomers for n = 2, 3, 4, have been recorded at low temperature. The vibrational spectra are completely assigned according to point groups Oh, D4h, C4v, C3v, and C2v, as supported by normal coordinate analyses based on a general valence force field. Due to the different trans-influences Br<I in asymmetric axes Br′–Os–I′, the Os–I′ bonds are strengthened and the Os–Br′ bonds are weakened, as indicated by valence force constants, for Os–I′ on average 4% higher and for Os–Br′ 4% lower, as compared with the values calculated for symmetric I–Os–I and Br–Os–Br axes, respectively.

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