首页> 外文期刊>International Journal of Quantum Chemistry >A New organic-Cation Cyclotetraphosphate C_(10)H_(28)N_4P_4O_(12).4H_2O: Crystal Structure, Thermal Analysis, and Vibrationial Spectra
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A New organic-Cation Cyclotetraphosphate C_(10)H_(28)N_4P_4O_(12).4H_2O: Crystal Structure, Thermal Analysis, and Vibrationial Spectra

机译:新型有机阳离子环四磷酸盐C_(10)H_(28)N_4P_4O_(12).4H_2O:晶体结构,热分析和振动光谱

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摘要

Anew organic-cation phosphate of C_(10)H_(28)N_4P_4O_(12). 4H_2O has been obtained. The crystal structure determination shows that this compound crystallizes in the triclinic system, space group P-1, with the following unit cell parameters: a = 9.147(3) A; b = 9.258(3) A; c = 8.974(3) A; #alpha# = 79.92(3); #beta# = 117.41(3); #gamma# = 116.58(3)0. P_4O_(12) cycles, which present the strongest distortion in this kind of materials, are connected through O_w-H-0-P hydrogen bonds, so that bidimensionallayers parallel to the ab plane are formed. These layers are themselves interconnected by means N-H-o-P hydrogen bonds origin- ating from the (C_(10)H_(28)N_4)~(4+) cations forming a three-dimensional network. The hydrated character of this phosphate is confirmed by the coupled TG-DTA thermal study which shows the success- ive loss of water molecules. The molecular arrangement within the structure has been confirmed by the IR spectroscopy.
机译:一种新的C_(10)H_(28)N_4P_4O_(12)的有机阳离子磷酸盐。已获得4H_2O。晶体结构的确定表明,该化合物在三斜晶系空间群P-1中结晶,具有以下晶胞参数:a = 9.147(3)A; b = 9.258(3)A; c = 8.974(3)A; #alpha#= 79.92(3); #beta#= 117.41(3); #gamma#= 116.58(3)0。 P_4O_(12)循环通过O_w-H-0-P氢键连接,是这类材料中变形最强的循环,因此形成了平行于ab平面的二维层。这些层本身通过源自(C_(10)H_(28)N_4)〜(4+)阳离子的N-H-o-P氢键相互连接,形成三维网络。 TG-DTA耦合热学研究证实了这种磷酸盐的水合特征,该研究表明水分子的连续损失。结构内的分子排列已通过IR光谱法确认。

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