Microcalorimetry investigation of synthetic hemoprotein (albumin‐heme)

Recombinant human serum albumin (rHSA) incorporating the iron(II) complex of the tetraphenylporphyrin derivative (FepivP or FecycP) is a synthetic O₂‐carrying hemoprotein [albumin‐heme (rHSA‐FepivP or rHSA‐FecycP)], which acts as a red blood cell substitute. The association and dissociation behavior of FepivP and FecycP with rHSA has been initially investigated by isothermal titration calorimetry. A strong heat release appeared after the injection of albumin‐heme into a large molar excess of rHSA. This exothermic enthalpy change was due to the transference of hemes to the other free albumins. The difference in the heme binding affinity to rHSA can be manifested in the enthalpy term. Copyright © 2003 John Wiley & Sons, Ltd.     

四氯合镉酸正十一烷铵的合成、晶体结构及低温热容

合成了四氯合镉酸正十一烷铵配合物(C₁₁H₂₃NH₃)₂CdCl₄(s)[简写: C₁₁Cd(s)]. 用X 射线单晶衍射技术、化学分析和元素分析确定其晶体结构和化学组成. 利用其晶体学数据计算出晶格能为: U_POT＝908.18 kJ·mol^-1. 利用精密自动绝热热量计测定了它在78～395 K 温区的低温热容, 结果表明, 该配合物在此温区出现两次连续的固-固相转变, 计算出两次相变的峰温、摩尔焓及摩尔熵分别为: T_trs,1＝(321.88±0.07) K, Δ_trsH_m,1＝(37.59±0.17) kJ·mol^-1, Δ_trsS_m,1＝(117.24±0.12) J·K^-1·mol^-1, T_trs,2＝(323.81±0.30) K, Δ_trsH_m,2＝(12.42±0.02) kJ·mol^-1 和Δ_trsS_m,2＝(38.36±0.09) J·K^-1·mol^-1. 用最小二乘法将实验摩尔热容对温度进行拟合, 得到热容随温度变化的多项式方程. 用此方程进行数值积分,得到此温区每隔5 K 的舒平热容值和相对于298.15 K 时的热力学函数值.     

Quantum chemical studies on the structures, properties and decomposition of the azido derivatives of trinitrobenzenes

The geometries,heats of formation and electronic structures of 15 azido-derivatives of 1,2,3-TNB (Ⅰ),1,2,4-TNB (Ⅱ) and 1,3,5-TNB (Ⅲ) have been studied using quantum chemical AMI method at HF level.The effect of azido substitution on the structures and properties of TNBs has been discussed and the relative stability of the title compounds has been established.The processes of the decomposition of the title compounds by breaking C-NO2,C-N3 and CN-N2 bonds are investigated at UHF-AM1 level.It is shown that the decomposition of the title compounds may be initiated by the cleavage of both C-NO2 and N-N2 bonds.     

R(-)四氢噻唑-2-硫酮-4-羧酸对D,L-氨基酸酯拆分的研究

以新手性拆分试剂R(-)四氢噻唑-2-硫酮-4-羧酸[简称R(-)TTCA]对D,L-氨基酸酯进行手性拆分,分别得到(R)TTCA氨基酸酯盐1a_1f([α]_D²⁰＝-30.40°～-42.70°)及光学活性氨基酸酯2a-2f,其光学纯度为35.4%～75.8%.由1a_1f在碱存在下分解出2a-2f的对映体3a-3f,光学纯度为39.50%～69.10%.用半经验的量子化学PM3方法研究了氨基的碱性、中间产物铵盐生成热和稳定性.     

Adsorption Heat Pump Using an Innovative Coupling Refrigeration Cycle

An adsorption heat pump system using a new binary coupling adsorptive cycle is developed and tested. Experimental results show that the COP of the binary coupling cycle is higher than that of a pure zeolite-water system. The system operating pressure is found to be moderate (close to the ambient pressure) when a proper concentration of ammonia is used in the system. The moderate operating pressure of the new coupling cycle results in low leakage to the system, achieving long life and the light design of the system vessels. The use of the new binary adsorption cycle greatly improves the feasibility and reliability of the adsorption heat pumps, providing essential benefits for the industrialisation of adsorption heat pumps.     

Characterization of quasi-one-dimensional S=1/2 Heisenberg antiferromagnets Sr2Cu(PO4)2 and Ba2Cu(PO4)2 with magnetic susceptibility, specific heat, and thermal analysis

Properties of Sr₂Cu(PO₄)₂ and Ba₂Cu(PO₄)₂ having [Cu(PO₄)₂]_∞ linear chains in their structures with Cu-O-P-O-Cu linkages were studied by magnetic susceptibility (T=2-400 K, H=100 Oe) and specific heat measurements (T=0.45-21 K). Magnetic susceptibility versus temperature curves, χ(T), showed broad maxima at T_M=92 K for Sr₂Cu(PO₄)₂ and T_M=82 K for Ba₂Cu(PO₄)₂ characteristic of quasi-one-dimensional systems. The χ(T) data were excellently fitted by the spin susceptibility curve for the uniform S=1/2 chain (plus temperature-independent and Curie-Weiss terms) with g=2.153(4) and J/k_B=143.6(2) K for Sr₂Cu(PO₄)₂ and g=2.073(4) and J/k_B=132.16(9) K for Ba₂Cu(PO₄)₂ (Hamiltonian H=JΣS_iS_i+1). The similar J/k_B values were obtained from the specific heat data. No anomaly was observed on the specific heat from 0.45 to 21 K for both compounds indicating that the temperatures of long-range magnetic ordering, T_N, were below 0.45 K. Sr₂Cu(PO₄)₂ and Ba₂Cu(PO₄)₂ are an excellent physical realization of the S=1/2 linear chain Heisenberg antiferromagnet with k_BT_N/J<0.34% together with Sr₂CuO₃ (k_BT_N/J≈0.25%) and γ-LiV₂O₅ (k_BT_N/J<0.16%). Sr₂Cu(PO₄)₂ and Ba₂Cu(PO₄)₂ were stable in air up to 1280 and 1150 K, respectively.     

3,4-二硝基呋咱基氧化呋咱的比热容、热力学性质、绝热至爆时间及热感度概率密度分布

应用Micro-DSCⅢ微热量仪对3,4-二硝基呋咱基氧化呋咱(DNTF)进行比热容测定, 得到了DNTF比热容随温度变化的线性方程定压cp=0.31064＋2.109×10-3T (285 K相似文献   

镥晶体的绝热量热法测试和热力学函数

文章合成了Lu(NO₃)₃(C₂H₅O₂N)_4.H₂O,用红外和元素分析对其进行了表征。用高精度全自动绝热量热仪,测定了该配合物80-382 K温区的热容, 利用实验热容数据, 根据热容与焓、熵的热力学关系, 求出了配合物85-350 K温区内每隔5 K相对于298.15K的标准热力学函数(HT - H298.15)m和(ST - S298.15)m.在80-350 K温度区间内,配合物的热容随温度升高而增大,没有相转移点和热力学吸收峰的出现,该配合物在此温度区间内是稳定存在的。     

Low-temperature Heat Capacity and Standard Thermodynamic Functions of D-Galactose and Galactitol

The heat capacities of D-galactose and galactitol were measured on a quantum design physical property measurement system(PPMS) over a temperature range of 1.9―300 K, and the experimental data were fitted to a function of T using a series of theoretical and empirical models in appropriate temperature ranges. The fit results were used to calculate thermodynamic function values,C_p,m^θ,Δ₀^TS_m^θ, and Δ₀^TH_m^θfrom 0 K to 300 K. The standard molar heat capacity, entropy and enthalpy values of D-galactose and galactitol at 298.15 K and 0.1 MPa were determined to be C_p,m^θ =(227.96±2.28) and (239.50±2.40) J·K^-1·mol^-1,S_m^θ= (211.22±2.11) and (230.82±2.30) J·K^-1·mol^-1 and = H_m^θ (33.95±0.34) and (36.57± 0.37) kJ/mol, respectively.     

Evaluation of radiation damage behavior in polyimide aerogel by infrared camera and photoacoustic spectroscopy

In this work, the optical absorption and thermal properties of polyimide aerogel have been investigated by Infrared Camera, ultraviolet–visible and photoacoustic spectroscopy under low energy proton irradiation. The characterization method of the infrared camera can obtain the optical absorption ratio, and meanwhile get the information of specific heat capacity. Moreover, it can acquire the nature information of damaged area rather than the overall performance. The results show an increase in optical absorption after proton irradiation, which is in good coincidence with Ultraviolet–visible spectroscopy analysis. And the specific heat capacity decreased linearly with proton fluences, which can be attributed to the irradiation damage and carbonization in polyimide aerogel. The Raman spectra suggested the cleavage of chemical bonds and carbonization in polyimide aerogel. This work provides the novel, non-destructive and sensitive methods to characterize irradiation damage of aerogel.