PCN Radical
	Nitrogen
	Nuclear Quadrupole Coupling Constants
		in PCN Radical
	Table 1.  14N nqcc's in PCN Radical (MHz).  Calculation was made on ro [1] and  CCSD(T)/aug-cc-pVQZ ropt [2] structures.        ro  ropt Expt. [1]     eQq - 4.756 - 4.674 - 4.6423(91)
	Table 2.  PCN Molecular structure parameters (Å).    ro [1] ropt [2] PC 1.732(2) 1.7403 CN 1.167(2) 1.1744
	[1] D.T.Halfen, M.Sun, D.J.Clouthier, and M.Ziurys, J.Chem.Phys. 136,144312(2012).
	[2] S.Wang, Y.Yamaguchi, and H.F.Schaefer III, J.Theor.Comput.Chem. 5,281(2006).
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	Molecules/Nitrogen
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						Last Modified 25 Oct 2012