isocyanic acid

isocyanic acid的基本解释

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异氰酸

与isocyanic acid相关的网络例句 [注：此内容来源于网络，仅供参考]

Using the MP2 method at the 6-311G level, the geometries of the reactants, transition state and products of the hydrogen abstraction reaction of isocyanic acid with formyl radical have been optimized. Changes of bond lengths of interacting molecules and the stationary point structures were discussed along the minimum energy paths.

在 UMP2/6-311G计算水平上，优化了标题反应的反应物、过渡态、产物的几何结构，沿最小能量途径讨论了异氰酸和甲酰自由基发生氢转移反应位能面上驻点的结构以及相互作用分子结构变化。

Isocyanic acid ; Hydrogen abstraction reaction ; ab initio ; Formyl radical ; Rate constant

异氰酸；氢转移反应； abinitio ；甲酰基自由基；速率常数

The salts of fulminic acid differ basically isocyanic acid and its trimers.

雷酸盐基本上不同于异氰酸盐和异氰三聚物的盐。

The Density Function Theorymethod are employed to study the geometries of the cyanic acid and isocyanic acid on the base of B3LYP/6-31++Gin the paper.

主要采用密度泛函理论方法，在B3LYP/6-31++G水平上，优化了氰酸、异氰酸的结构，分别得到氰酸的能量为-168.69356 a.u，异氰酸的能量为-168.73227 a.u，并对过渡态进行了反应的内禀反应曲线IRC计算。

A DFT study of cyanic acid and isocyanic acid in the isomerization;2. The reaction path of isocyanic acid with carbon-hydrogen radicals CH, CH 2 and CH 3 have been investigated by using UMP2 method at 6-311g level.

在UMP2 / 6 311计算水平上，计算并讨论了碳氢自由基和异氰酸发生氢转移反应位能面上驻点的结构和分子结构变化，并依据UMP2的优化构型，进一步采用UQCISD方法对反应途径上的驻点进行了单点能量计算。

与isocyanic acid相关的网络解释 [注：此内容来源于网络，仅供参考]

isocyanic acid：[化]异氰酸

pixilated 精神有点失常的 | isocyanic acid [化]异氰酸 | exchange lattice 交换格

isocyanic acid phenyl ester：异氰酸苯酯

异氰酸异丁酯 isocyanic acid isobutyl ester; isobutyl isocyanate | 异氰酸苯酯 isocyanic acid phenyl ester | 异氰酸[草(之上)+叨]酯 isocyanic acid tolyl ester

isocyanic acid tolyl ester：异氰酸[草(之上)+叨]酯

异氰酸苯酯 isocyanic acid phenyl ester | 异氰酸[草(之上)+叨]酯 isocyanic acid tolyl ester | 怪氰酸 isocyanilic acid

isocyanic acid：异氰酸

isocyanate varnish ==> 异氰酸酯清漆 | isocyanic acid ==> 异氰酸 | isocyanilic acid ==> 怪氰酸

isocyanic acid ethyl ester：异氰酸乙酯

异氰酸 isocyanic acid | 异氰酸乙酯 isocyanic acid ethyl ester | 异氰酸异丁酯 isocyanic acid isobutyl ester; isobutyl isocyanate