Jozef Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia.
Phys Chem Chem Phys. 2010 Apr 7;12(13):3254-9. doi: 10.1039/b925326b. Epub 2010 Feb 22.
The complete (14)N nuclear quadrupole resonance spectrum has been measured in ferroelectric (H(2)-TPPZ)(Hca)(2) using nuclear quadrupole double resonance. The quadrupole coupling tensors are assigned to various nitrogen positions in the crystal structure. Two types of asymmetric N-H(+)...N hydrogen bonds are observed in the ferroelectric phase. A slow dynamics influencing the (14)N NQR spectrum and relaxation has been observed in the paraelectric phase. The analysis of the (14)N NQR spectra in the paraelectric phase shows that above T(c) each hydrogen bond exchanges between the two types observed in the ferroelectric phase. The change of the type of hydrogen bond is associated with the transfer of protons within the bond.
采用核四极矩双共振技术,测量了铁电(H(2)-TPPZ)(Hca)(2)中的完整 (14)N 核四极矩共振谱。将核四极矩偶合张量分配给晶体结构中的各种氮位置。在铁电相中观察到两种类型的不对称 N-H(+)...N 氢键。在顺电相中观察到影响 (14)N NQR 谱和弛豫的缓慢动力学。对顺电相 (14)N NQR 谱的分析表明,在 T(c)以上,每个氢键在铁电相中观察到的两种类型之间进行交换。氢键类型的变化与键内质子的转移有关。