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The Na...B Bond in NaBH3-: A Different Type of Bond

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216224%3A14310%2F20%3A00118008" target="_blank" >RIV/00216224:14310/20:00118008 - isvavai.cz</a>

  • Result on the web

    <a href="https://doi.org/10.1002/anie.202010024" target="_blank" >https://doi.org/10.1002/anie.202010024</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1002/anie.202010024" target="_blank" >10.1002/anie.202010024</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    The Na...B Bond in NaBH3-: A Different Type of Bond

  • Original language description

    A newly introduced Na-B bond in NaBH(3)(-)has been a challenge for the chemical bonding community. Here, a series of MBH3-(M=Li, Na, K) species and NaB(CN)(3)(-)are studied within the context of quantum chemical topology approaches. The analyses suggest that M-B interaction cannot be classified as an ordinary covalent, dative, or even simple ionic interaction. The interactions are controlled by coulombic forces between the metals and the substituents on boron, for example, H or CN, more than the direct M-B interaction. On the other hand, while the characteristics of the (3, -1) critical points of the bonds are comparable to weak hydrogen bonds, not covalent bonds, the metal and boron share a substantial sum of electrons. To the best of the author's knowledge, the characteristics of these bonds are unprecedented among known molecules. Considering all paradoxical properties of these bonds, they are herein described as ionic-enforced covalent bonds.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database

  • CEP classification

  • OECD FORD branch

    10403 - Physical chemistry

Result continuities

  • Project

    <a href="/en/project/LM2015085" target="_blank" >LM2015085: CERIT Scientific Cloud</a><br>

  • Continuities

    P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace

Others

  • Publication year

    2020

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Angewandte Chemie International Edition

  • ISSN

    1433-7851

  • e-ISSN

    1521-3773

  • Volume of the periodical

    59

  • Issue of the periodical within the volume

    47

  • Country of publishing house

    DE - GERMANY

  • Number of pages

    4

  • Pages from-to

    20900-20903

  • UT code for WoS article

    000566555900001

  • EID of the result in the Scopus database

    2-s2.0-85090309127