A Diamidocarbene-Supported Aminoborylene: Characterization and Discussion of the Elusive Crystal Structure

A Diamidocarbene-Supported Aminoborylene: Characterization and Discussion of the Elusive Crystal Structure
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二氨基卡宾负载的氨基硼烯:难以捉摸的晶体结构的表征和讨论

DOI:
10.1007/s10870-022-00950-4
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发表时间:
2022
影响因子:
0.8
通讯作者:
Hudnall, Todd W.
Hudnall, Todd W.
中科院分区:
化学4区
文献类型:
--
作者:
Ledet, Anthony D.;Reinheimer, Eric W.;Hudnall, Todd W.

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在我们发表了第一个二胺碳烯(DAC)负载的氨基乙烯4的合成五年后,我们现在报告了难以理解的单晶x射线结构。4的x射线结构证实了我们之前的计算研究,表明硼烯采用近线性C(carbene)= B = N单元(175.88(18)◦)的异聚几何结构,C = B和B = N距离分别为1.416(3)和1.344(3)Å。此外,我们进一步提供了关于用于制备4以及已知环(烷基)氨基卡宾(CAAC)类似物2的前体化合物的所述结构的定性和定量论述。
Five years after we published the synthesis of the first diamidocarbene (DAC)-supported amino borylene4, we now report the elusive single crystal X-ray structure. The X-ray structure of4was found to corroborate our previous computational studies which indicated that the borylene adopted a heterocumulenic geometry with a near linear C(carbene)= B = N unit (175.88(18)◦) as well as short C = B and B = N distances of 1.416(3) and 1.344(3) Å, respectively. Additionally, we further provide a qualitative and quantitative discourse on said structure with respect to the precursor compounds used to prepare4as well as to the known cyclic (alkyl) amino carbene (CAAC) analog2.
DOI: 10.1126/science.aav9593
发表时间: 2019-03-22
期刊: SCIENCE
影响因子: 56.9
作者:
Legare, Marc-Andre;Rang, Maximilian;Braunschweig, Holger
通讯作者: Braunschweig, Holger