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@ARTICLE{Domingos:454844,
      author       = {Domingos, Sérgio R. and Pérez, Cristóbal and Kreienborg,
                      Nora M. and Merten, Christian and Schnell, Melanie},
      title        = {{D}ynamic chiral self-recognition in aromatic dimers of
                      styrene oxide revealed by rotational spectroscopy},
      journal      = {Communications chemistry},
      volume       = {4},
      number       = {1},
      issn         = {2399-3669},
      address      = {[London]},
      publisher    = {Macmillan Publishers Limited, part of Springer Nature},
      reportid     = {PUBDB-2021-00777},
      pages        = {32},
      year         = {2021},
      abstract     = {Chiral molecular recognition is a pivotal phenomenon in
                      biomolecular science, governed by subtle balances of
                      intermolecular forces that are difficult to quantify.
                      Non-covalent interactions involving aromatic moieties are
                      particularly important in this realm, as recurring motifs in
                      biomolecular aggregation. In this work, we use
                      high-resolution broadband rotational spectroscopy to probe
                      the dynamic conformational landscape enclosing the
                      self-pairing topologies of styrene oxide, a chiral aromatic
                      system. We reach a definite assignment of four homochiral
                      and two heterochiral dimers using auxiliary quantum
                      chemistry calculations as well as structure-solving methods
                      based on experimental isotopic information. A complete
                      picture of the dimer conformational space is obtained, and
                      plausible routes for conformational relaxation are derived.
                      Molecular structures are discussed in terms of
                      conformational flexibility, the concerted effort of weak
                      intermolecular interactions, and their role in the
                      expression of the molecular fit.},
      cin          = {FS-SMP / CFEL-SDCCM},
      ddc          = {540},
      cid          = {I:(DE-H253)FS-SMP-20171124 /
                      I:(DE-H253)CFEL-SDCCM-20160915},
      pnm          = {631 - Matter – Dynamics, Mechanisms and Control
                      (POF4-631)},
      pid          = {G:(DE-HGF)POF4-631},
      experiment   = {EXP:(DE-MLZ)NOSPEC-20140101},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000626585700003},
      doi          = {10.1038/s42004-021-00468-4},
      url          = {https://bib-pubdb1.desy.de/record/454844},
}