1970
DOI: 10.1063/1.1674551
|View full text |Cite
|
Sign up to set email alerts
|

Single-Crystal Infrared and Raman Spectra of Cyanuric Chloride

Abstract: The single-crystal infrared and Raman spectra of cyanuric chloride, 1,3,5-trichlorotriazine, were measured at 298 and 77°K. A complete assignment for the intramolecular fundamentals was made, including a study of a modified valence force field. Intensity predictions from the oriented gas model qualitatively agreed with the experimental results for the intensity of the free molecule Raman-active bands. Spectral measurements in the low-frequency region resulted in the assignment of several bands to the optically… Show more

Help me understand this report

Search citation statements

Order By: Relevance

Paper Sections

Select...
3
1
1

Citation Types

1
8
0
1

Year Published

1971
1971
2016
2016

Publication Types

Select...
8

Relationship

1
7

Authors

Journals

citations
Cited by 20 publications
(10 citation statements)
references
References 18 publications
1
8
0
1
Order By: Relevance
“…He reports that, with the exception of ν 11 (749 cm -1 in gas phase, 795 cm -1 in the solid), the gas-phase spectrum of cyanuric chloride is very similar to that of the condensed phase. We were able to match all calculated vibrational modes of the cyanuric chloride to experimental assignments through visual inspection of the eigenvectors when compared to those illustrated in Figure 9 of ref . Calculated vibrational frequencies of cyanuric chloride are within 100 cm -1 of the experimental frequencies with the exception of modes denoted ν 4 and ν 5 in ref (modes 16 and 9 here).…”
Section: Resultsmentioning
confidence: 79%
See 2 more Smart Citations
“…He reports that, with the exception of ν 11 (749 cm -1 in gas phase, 795 cm -1 in the solid), the gas-phase spectrum of cyanuric chloride is very similar to that of the condensed phase. We were able to match all calculated vibrational modes of the cyanuric chloride to experimental assignments through visual inspection of the eigenvectors when compared to those illustrated in Figure 9 of ref . Calculated vibrational frequencies of cyanuric chloride are within 100 cm -1 of the experimental frequencies with the exception of modes denoted ν 4 and ν 5 in ref (modes 16 and 9 here).…”
Section: Resultsmentioning
confidence: 79%
“…The most complete vibrational analysis for this system was performed by Thomas et al . They reported the single-crystal infrared and Raman spectra for cyanuric chloride at 298 and 77 K and made complete assignments for all fundamentals.…”
Section: Resultsmentioning
confidence: 99%
See 1 more Smart Citation
“…In terms of the previous vibrational study of cyanuric chloride in solutions or in the solid state (Table 4), the vibrations at 1269 and 1493 cm −1 may be related to cyanuric chloride itself, due to the C−N stretching and ring deforming modes, respectively. 22,23 However, cyanuric chloride cannot account for the strong peaks at 1534 and 1560 cm −1 . As shown by the calculated infrared frequencies of cyanuric acid in monoketo and triol forms on TiO 2 (110) (Table 2), the hydroxylated s-triazine rings have peaks in the range of ∼1540− 1585 cm −1 due to ring stretching and N−H and O−H bending modes.…”
Section: ■ Results and Discussionmentioning
confidence: 99%
“…Fu Èr (NCCl) 3 und (NCF) 3 [4,8,18], in denen die CX-Valenzschwingung der jeweils ho Èchsten Wellenzahl zugeordnet wird. Fu Èr (NCCl) 3 und (NCF) 3 [4,8,18], in denen die CX-Valenzschwingung der jeweils ho Èchsten Wellenzahl zugeordnet wird.…”
Section: Ergebnisse Und Diskussionunclassified