% IMPORTANT: The following is UTF-8 encoded.  This means that in the presence
% of non-ASCII characters, it will not work with BibTeX 0.99 or older.
% Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or
% “biber”.

@ARTICLE{QuesadaMoreno:454612,
      author       = {Quesada Moreno, María Mar and Pinacho, Pablo and Pérez,
                      Cristóbal and Šekutor, Marina and Schreiner, Peter R. and
                      Schnell, Melanie},
      title        = {{L}ondon {D}ispersion and {H}ydrogen‐{B}onding
                      {I}nteractions in {B}ulky {M}olecules: {T}he {C}ase of
                      {D}iadamantyl {E}ther {C}omplexes},
      journal      = {Chemistry - a European journal},
      volume       = {26},
      number       = {47},
      issn         = {1521-3765},
      address      = {Weinheim},
      publisher    = {Wiley-VCH},
      reportid     = {PUBDB-2021-00614},
      pages        = {10817 - 10825},
      year         = {2020},
      abstract     = {Diadamantyl ether (DAE, C20H30O) represents a good model to
                      study the interplay between London dispersion and
                      hydrogen‐bond interactions. By using broadband rotational
                      spectroscopy, an accurate experimental structure of the
                      diadamantyl ether monomer is obtained and its aggregates
                      with water and a variety of aliphatic alcohols of increasing
                      size are analyzed. In the monomer, C−H⋅⋅⋅H−C
                      London dispersion attractions between the two adamantyl
                      subunits further stabilize its structure. Water and the
                      alcohol partners bind to diadamantyl ether through hydrogen
                      bonding and non‐covalent Owater/alcohol⋅⋅⋅H−CDAE
                      and C−Halcohol⋅⋅⋅H−CDAE interactions.
                      Electrostatic contributions drive the stabilization of all
                      the complexes, whereas London dispersion interactions become
                      more pronounced with increasing size of the alcohol.
                      Complexes with dominant dispersion contributions are
                      significantly higher in energy and were not observed in the
                      experiment. The results presented herein shed light on the
                      first steps of microsolvation and aggregation of molecular
                      complexes with London dispersion energy donor (DED) groups
                      and the kind of interactions that control them.},
      cin          = {FS-SMP / CFEL-SDCCM},
      ddc          = {540},
      cid          = {I:(DE-H253)FS-SMP-20171124 /
                      I:(DE-H253)CFEL-SDCCM-20160915},
      pnm          = {6211 - Extreme States of Matter: From Cold Ions to Hot
                      Plasmas (POF3-621)},
      pid          = {G:(DE-HGF)POF3-6211},
      experiment   = {EXP:(DE-MLZ)NOSPEC-20140101},
      typ          = {PUB:(DE-HGF)16},
      pubmed       = {pmid:32428323},
      UT           = {WOS:000552348600001},
      doi          = {10.1002/chem.202001444},
      url          = {https://bib-pubdb1.desy.de/record/454612},
}