Table 2: Spectroscopic constants of the ground vibrational state of CH3CHDCN, CH2DCH2CN and CH3CH2C15N.
  CH2DCH2CN in-plane CH2DCH2CN out-of-plane CH3CHDCN CH3CH2C15N
A /MHz 27651.28641(85) 25022.90806(62) 24449.0602(15) 27541.8853(13)
B /MHz 4425.144021(82) 4583.488572(88) 4661.39671(21) 4574.82824(19)
C /MHz 4000.798104(76) 4110.239468(83) 4155.45941(20) 4119.44781(19)
$\Delta_{J}$ /kHz 2.565394(33) 3.122672(31) 2.839982(82) 2.893555(79)
$\Delta_{_{JK}}$ /kHz -45.12388(92) -39.91080(59) -34.0809(14) -46.1359(13)
$\Delta_{_K}$ /kHz 551.5425(70) 405.8505(38) 365.720(24) 547.265(14)
$\delta_{_j}$ /Hz 550.855(23) 703.046(20) 656.296(27) 635.249(38)
$\delta_{_k}$ /kHz 10.8468(55) 11.0888(26) 11.6287(44) 12.5398(81)
$\Phi{_J}$ /mHz 7.5447(37) 9.9689(35) 8.4837(98) 8.9909(84)
$\Phi{_{JK}}$ /mHz -54.29(79) -34.13(73) - -20.9(11)
$\Phi{_{KJ}}$ /Hz -1.3293(42) -1.3663(31) -1.1188(27) -1.9066(62)
$\Phi{_K}$ /Hz 28.440(21) 18.8395(90) 15.57(10) 30.827(44)
$\phi{_j}$ /mHz 2.8196(28) 3.8411(23) 3.3694(40) 3.4096(49)
$\phi{_{jk}}$ /mHz 78.25(65) 101.06(39) 85.03(74) 103.26(85)
$\phi{_k}$ /Hz 5.618(63) 4.153(46) 4.067(12) 6.561(84)
LJK /MHz - - - -6.45(27)
LKKJ /MHz 38.7(27) 48.04(99) - 101.5(24)
lk /MHz 279.(14) 236.7(61) 317.(14) -
Standard deviation of the fits are given Table 1, see text for more details. Uncertainties given in parenthesis are in units of the last digit given and 1 times the standard deviation.

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