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Discovery of two new magnesium-bearing species in IRC+10216: MgC 3N and MgC 4H ?

机译:在IRC + 10216中发现了两个新的含镁物种:MgC 3 N和MgC 4 H

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We report on the detection of two series of harmonically related doublets in IRC +10216. From the observed frequencies, the rotational constant of the first series is B ?=?1380.888 MHz and that of the second series is B ?=?1381.512 MHz. The two series correspond to two species with a~(2)Σ electronic ground state. After considering all possible candidates, and based on quantum chemical calculations, the first series is assigned to MgC_(3)N and the second to MgC_(4)H. For the latter species, optical spectroscopy measurements support its identification. Unlike diatomic metal-containing molecules, the line profiles of the two new molecules indicate that they are formed in the outer layers of the envelope, as occurs for MgNC and other polyatomic metal-cyanides. We also confirm the detection of MgCCH that was previously reported from the observation of two doublets. The relative abundance of MgC_(3)N with respect to MgNC is close to one while that of MgC_(4)H relative to MgCCH is about ten. The synthesis of these magnesium cyanides and acetylides in IRC +10216 can be explained in terms of a two-step process initiated by the radiative association of Mg~(+)with large cyanopolyynes and polyynes followed by the dissociative recombination of the ionic complexes.
机译:我们报告了在IRC +10216中检测到两个系列的谐波相关双峰的情况。从观察到的频率来看,第一系列的旋转常数为B 1 = 138.088MHz,第二系列的旋转常数为B 1 = 138.512MHz。这两个系列对应于具有a〜(2)Σ电子基态的两个物种。在考虑了所有可能的候选物之后,并基于量子化学计算,将第一个序列分配给MgC_(3)N,将第二个序列分配给MgC_(4)H。对于后一种,光谱学测量支持其鉴定。与含双原子金属的分子不同,这两个新分子的线轮廓表明它们形成在包膜的外层,就像MgNC和其他多原子金属氰化物一样。我们还确认了先前从观察到的两个双峰中报告的MgCCH检测。 MgC_(3)N相对于MgNC的相对丰度接近1,而MgC_(4)H相对于MgCCH的相对丰度约为10。这些氰化镁和乙炔化镁在IRC +10216中的合成可以通过两步过程来解释,该过程由Mg〜(+)与大型氰基多炔和多炔的辐射缔合引发,然后离子配合物解离重组。

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