查询词典 isomers

Density functional method was applied to the study of the isomers of the primary explosive of tetrazene.

采用密度泛函理论对四氮烯起爆药的异构体进行研究。

The geometrical structures of the three isomers of tetrazene molecule which had been proposed formerly were fully optimized at the B3LYP/6-311 +G(superscript **) level of theory.

在B3LYP/6-311+G水平下对四氮烯三种异构体分子的几何结构进行全优化计算。

Comparisons show that there is no correlation between the experimental sensitivity of tetrazole compounds and various previously proposed theoretical static criteria, such as the bond length and bond order of relevant bonds, net atomic charges and electronegativity and the content of 2H-teterazole isomers in both gaseous and condensed states.

把四唑衍生物的实验感度与前人曾提出过的各种感度理论判据—一些静态结构性质(如相关键的键长、键级、原子电荷和电负性等)以及平衡体系中2H-异构体的含量—进行比较，均未找到它们之间的规律性联系。

This paper investigates that the different composition of the headspace gas and polluted sediment slurries can affect the ratios of degradation on benzoic acid, toluic acid and phthalic acid isomers. We found that a sediment slurry which has been polluted can develop a stronger microbial degradation.

此篇文章主要是探讨不同上层气体之组成和被污染过之底泥可影响苯甲酸、甲基苯甲酸异构物及苯二酸异构物被分解的速率，我们发现被污染过之底泥可发展出较强之微生物降解力。

At 60 ℃ the reaction of 1-O-alkyl-2-O-acetyl-3-O-trityl glycerol with iodine/methanol system removed trityl and acetyl and gave 1-alkyl glycerol. But at r.t. the reaction only removed trityl and gave two isomers 1-O-alkyl-2-O-acetyl glycerol and 1-O-alkyl-3-O-acetyl glycerol.

1-烷氧基-2乙酰氧基-3-三苯甲氧基甘油醚与碘/甲醇体系反应，在60 ℃时，同时发生了脱三苯甲基及乙酰基，在室温下，仅脱三苯甲基，但乙酰基在反应过程中发生了部分转移，产生了两个异构体。

A and B isomers could interconvert each other by an inversion of the imine nitrogen atom. In this work, we investigated the substituent effects and solvent effects. This study used the most popular one of density functional theory method unrestricted hybrid Becke three-parameter Lee-Yang-Parr (B3LYP) with the 6-31+G basis set to compute the reaction and activation energies of B/A thermal isomerization.

腙分子的异构化过程藉由转动亚胺基上的氮原子，使腙分子由A 型结构转变成B 型结构(Scheme1)，本研究运用密度泛函数理论中最常被使用的B3LYP，搭配6-31+G基底函数，计算腙分子异构化过程的活化能以及反应热，并且考虑取代基与溶剂效应对能量所造成的影响。

Respectively, glutamic acid derivatized β-CD has been synthesized with epoxy chloropropane as the intermediate, a water-insoluble yellow liquid was got after the acetylating of the by using acetic anhydride, which was used as a novel gas chromatographic CSP; A water-soluble β-CD polymer cross-linked with epoxy chloropropane has been synthesized, and the derivatives of β-CD polymer were synthesized by its alkylating and acetylating. The different β-CD derivatives were coated on silica capillary columns by dynamic method, the chromatographic properties and retention behaviors of the fused silica capillary columns were studied, the results showed that the β-CD derivatives had good stereoselectivity and separation results to some compounds, especially to various positional isomers and enantiomers.

本文还分别以环氧氯丙烷为中间体，合成了七{2，6-二-O-[3-(1，3-二羟基丙氨酸)]}-β-环糊精，再用醋酸酐将其乙酰化，得到了一种淡黄色粘稠液体，合成了一种新型的环糊精衍生物；以环氧氯丙烷作交联剂合成了一种水溶性的β-环糊精聚合物，再将其烷基化和酰基化，合成了β-环糊精聚合物的不同衍生物，用动态法将不同类型的β-环糊精衍生物涂渍在石英毛细管柱上，通过对所制备柱柱性能的测试和对一系列化合物的分离和保留行为的研究，结果表明所合成的β-环糊精衍生物对各类化合物，特别是对位置异构体和对映异构体具有较好的分离效果，显示了很强的立体选择性。

It is concluded that not only incorporation of CLA isomers into the tissue is selective but also CLA supplementation remodels the desaturase and elongase pathway in hens.

结果表明，CLA异构体在老鼠乳汁中的分布与母鼠饲料中的组成非常相似。

Most negative charges are distributed on N(4) and N(1) with N(4) being the most. Above 3000cm-1 C-substituted tetrazoles have more and stronger absorption lines than the corresponding N-substituted isomers.

环负电荷主要分布在N(4)和N(1)原子上且N(4)较N(1)为多。C-取代物的IR光谱在3000cm-1以上有较强吸收而N-取代物则较小，且前者的强吸收线多于后者。

In this paper, an approach to two problems in organic chemical teaching was made:(1) Determination of the type and the number of Cis-trans isomers of acyclic alkenes;(2)An easy way to convert a Fischer Projection into a zigzag representation.

对如下两个有机化学教学问题进行了探讨：(1)如何确定链状多烯顺反异构体的数目和类型；(2)单糖的Fischer投影式转变为透视式的简便方法。

Singer Leona Lewis and former Led Zeppelin guitarist Jimmy Page emerged as the bus transformed into a grass-covered carnival float, and the pair combined for a rendition of "Whole Lotta Love".

歌手leona刘易斯和前率领的飞艇的吉他手吉米页出现巴士转化为基层所涵盖的嘉年华花车，和一双合并为一移交&整个lotta爱&。

This is Kate, and that's Erin.

这是凯特，那个是爱朗。