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6-(2-bromobenzylamino)purine monohydrate

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989592%3A15310%2F06%3A00002614" target="_blank" >RIV/61989592:15310/06:00002614 - isvavai.cz</a>

  • Result on the web

  • DOI - Digital Object Identifier

Alternative languages

  • Result language

    angličtina

  • Original language name

    6-(2-bromobenzylamino)purine monohydrate

  • Original language description

    The structure of the title compound, C12H12N5BrO.H2O, consists of discrete molecules connected by N-H ... N hydrogen bonds to form centrosymmetric dimers, with an N ...N distance of 2.839(4) A. The solvent water molecules are linked by intermolecular O-H... O hydrogen bonds into infinite chains along the [001] direction. The water molecules with disordered H atoms also participate in O-H ... O, N-H ... O and O-H ... N hydrogen bonds, with O ... O, N ... O and O ... N distances of 2.728(5) and 2.732(5),3.107(3) and 2.748(3) A, respectively. In addition to convetional hydrogen bonds, there are several weak ineratomic contacts of the type C ... Br, and pi-stacking interactions of the types C ... C and N ... C.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    CC - Organic chemistry

  • OECD FORD branch

Result continuities

  • Project

    <a href="/en/project/GA203%2F04%2F1168" target="_blank" >GA203/04/1168: Complexes of selected transition metals with cytokinin derivatives: synthesis, characterization and biological activity</a><br>

  • Continuities

    Z - Vyzkumny zamer (s odkazem do CEZ)

Others

  • Publication year

    2006

  • Confidentiality

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

Data specific for result type

  • Name of the periodical

    Acta Crystallographica Section E - Structure Reports Online

  • ISSN

    1600-5368

  • e-ISSN

  • Volume of the periodical

    62

  • Issue of the periodical within the volume

    8

  • Country of publishing house

    DK - DENMARK

  • Number of pages

    3

  • Pages from-to

  • UT code for WoS article

  • EID of the result in the Scopus database