The rotational \(J=1-0\) transitions of nine different isotopomers of ethinylisocyanide. \(\mathrm{H} \cdots \mathrm{C} \equiv \mathrm{C}-\mathrm{NC}\), were measured with high resolution using a pulsed molecular beam microwave Fourier transform (MB-MWFT) spectrometer. The analysis of the complex hy
Br nuclear quadrupole and H,Br nuclear-spin-nuclear-spin coupling in the rotational spectrum of H2O…HBr
✍ Scribed by A.C. Legon; A.P. Suckley
- Publisher
- Elsevier Science
- Year
- 1988
- Tongue
- English
- Weight
- 536 KB
- Volume
- 150
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
Partially resolved hyperfine structure arising from H,Br nuclear-spin-nuclear-spin coupling has been identified in each Brnuclear quadrupole component of the l,,, +O,,,, transition of H,O...HBr. Lineshape simulation leads to a value of D,,= -23 (2) kHz for the spin-spin coupling constant for both H,0...H79Br and H20...H8'Br. An apparent inconsistency between this value and the respective Br-nuclear quadrupole coupling constants x0.=424.326( 9) and 354.490( 2) MHz is resolved by allowing for the influence of the HZ0 electric charge distribution on the value ofkn.
📜 SIMILAR VOLUMES
Pulsed-nozzle, Fourier-transform microwave spectroscopy has been used to establish the ground-state spectroscopic constants &,=2734.6105(11) MHz, D,=1.49(7) kHz, DIK=35.3(4) kHz and Dj$= -230(g) kHz for the dimer (CH,),"N...HF from its rotational spectrum. The H,19F spin-spin coupling constant D zF
The ground-state rotational spectrum of the linear, hydrogen-bonded isotopomer HC'5N...D79Br has been investigated by pulsednozzle Fourier-transform microwave spectroscopy to give the spectroscopic constants &= 1374.4429( 3) MHz, D,= 1.790( ) kHz, x( 79Br) =438.645( 9) MHz and M( 79Br) =2.4( 3) kHz.
Molecules with multiple bonds are challenging for computations of nuclear spin-spin coupling constants. Tbis can be referred to the asserted importance of non-contact mechanisms, to sharp geometry variations as well as to the handling of the electronic structure problem. We employ a recently develop