Vibrational spectra and assignments for 3,3,4,4-tetrafluorocyclobutene-d0, -d1, and -d2

Norman C. Craig; Steven S. Borick; C. Patrick Collier; Julie S. Humm; Hidong Kim; Lac V. Lee

doi:10.1016/0584-8539(94)E0079-P

Vibrational spectra and assignments for 3,3,4,4-tetrafluorocyclobutene-d₀, -d₁, and -d₂

Norman C. Craig
, Steven S. Borick
, C. Patrick Collier
, Julie S. Humm
, Hidong Kim
, Lac V. Lee

Research output: Contribution to journal › Article › peer-review

3 Scopus citations

Abstract

Infrared and Raman spectra have been obtained in various physical states for 3,3,4,4-tetrafluorocyclobutene (TFCB) and its singly and doubly deuterated isotopic modifications. Vibrational fundamentals for TFCB are, in cm^-1, (a₁) 3152, 1564, 1350, 1162, 1034, 755, 500, 277; (a₂)-, 957, ∼610, 348, 133; (b₁) 3108, 1338, ∼1150, 1058, 730, 614, 431; (b₂) 1155, 799, 366, 208. Comparably complete assignments of the fundamentals for the d₁ and d₂ isotopomers support these assignments. The ring puckering frequencies of 15 halogen-substituted cyclobutenes are compared. The ring puckering mode at 133 cm^-1 for TFCB fits into the systematic dependence of the frequency of this mode on mass, location and extent of halogen substitution on the cyclobutene framework.

Original language	English
Pages (from-to)	45-63
Number of pages	19
Journal	Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
Volume	51
Issue number	1
DOIs	https://doi.org/10.1016/0584-8539(94)E0079-P
State	Published - Jan 1995
Externally published	Yes

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title = "Vibrational spectra and assignments for 3,3,4,4-tetrafluorocyclobutene-d0, -d1, and -d2",

abstract = "Infrared and Raman spectra have been obtained in various physical states for 3,3,4,4-tetrafluorocyclobutene (TFCB) and its singly and doubly deuterated isotopic modifications. Vibrational fundamentals for TFCB are, in cm-1, (a1) 3152, 1564, 1350, 1162, 1034, 755, 500, 277; (a2)-, 957, ∼610, 348, 133; (b1) 3108, 1338, ∼1150, 1058, 730, 614, 431; (b2) 1155, 799, 366, 208. Comparably complete assignments of the fundamentals for the d1 and d2 isotopomers support these assignments. The ring puckering frequencies of 15 halogen-substituted cyclobutenes are compared. The ring puckering mode at 133 cm-1 for TFCB fits into the systematic dependence of the frequency of this mode on mass, location and extent of halogen substitution on the cyclobutene framework.",

author = "Craig, \{Norman C.\} and Borick, \{Steven S.\} and Collier, \{C. Patrick\} and Humm, \{Julie S.\} and Hidong Kim and Lee, \{Lac V.\}",

year = "1995",

month = jan,

doi = "10.1016/0584-8539(94)E0079-P",

language = "English",

volume = "51",

pages = "45--63",

journal = "Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy",

issn = "1386-1425",

publisher = "Elsevier",

number = "1",

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TY - JOUR

T1 - Vibrational spectra and assignments for 3,3,4,4-tetrafluorocyclobutene-d0, -d1, and -d2

AU - Craig, Norman C.

AU - Borick, Steven S.

AU - Collier, C. Patrick

AU - Humm, Julie S.

AU - Kim, Hidong

AU - Lee, Lac V.

PY - 1995/1

Y1 - 1995/1

N2 - Infrared and Raman spectra have been obtained in various physical states for 3,3,4,4-tetrafluorocyclobutene (TFCB) and its singly and doubly deuterated isotopic modifications. Vibrational fundamentals for TFCB are, in cm-1, (a1) 3152, 1564, 1350, 1162, 1034, 755, 500, 277; (a2)-, 957, ∼610, 348, 133; (b1) 3108, 1338, ∼1150, 1058, 730, 614, 431; (b2) 1155, 799, 366, 208. Comparably complete assignments of the fundamentals for the d1 and d2 isotopomers support these assignments. The ring puckering frequencies of 15 halogen-substituted cyclobutenes are compared. The ring puckering mode at 133 cm-1 for TFCB fits into the systematic dependence of the frequency of this mode on mass, location and extent of halogen substitution on the cyclobutene framework.

AB - Infrared and Raman spectra have been obtained in various physical states for 3,3,4,4-tetrafluorocyclobutene (TFCB) and its singly and doubly deuterated isotopic modifications. Vibrational fundamentals for TFCB are, in cm-1, (a1) 3152, 1564, 1350, 1162, 1034, 755, 500, 277; (a2)-, 957, ∼610, 348, 133; (b1) 3108, 1338, ∼1150, 1058, 730, 614, 431; (b2) 1155, 799, 366, 208. Comparably complete assignments of the fundamentals for the d1 and d2 isotopomers support these assignments. The ring puckering frequencies of 15 halogen-substituted cyclobutenes are compared. The ring puckering mode at 133 cm-1 for TFCB fits into the systematic dependence of the frequency of this mode on mass, location and extent of halogen substitution on the cyclobutene framework.

UR - https://www.scopus.com/pages/publications/16244388343

U2 - 10.1016/0584-8539(94)E0079-P

DO - 10.1016/0584-8539(94)E0079-P

M3 - Article

AN - SCOPUS:16244388343

SN - 1386-1425

VL - 51

SP - 45

EP - 63

JO - Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

JF - Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

IS - 1

ER -

Vibrational spectra and assignments for 3,3,4,4-tetrafluorocyclobutene-d₀, -d₁, and -d₂

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