Startseite Crystal structure of 9,10-bis-((perchloro-phenyl)-ethynyl)anthracene determined from three-dimensional electron diffraction data
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Crystal structure of 9,10-bis-((perchloro-phenyl)-ethynyl)anthracene determined from three-dimensional electron diffraction data

  • Tatiana E. Gorelik EMAIL logo , Andreas Ulmer , A. Lennart Schleper und Alexander J.C. Kuehne
Veröffentlicht/Copyright: 1. Juni 2023
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Zeitschrift für Kristallographie - Crystalline Materials
Aus der Zeitschrift Zeitschrift für Kristallographie - Crystalline Materials Band 238 Heft 7-8

Abstract

The crystal structure of the title compound was determined using electron diffraction data collected in continuous rotation mode. The structure was successfully solved and refined kinematically in the monoclinic space group P21/c, with a Z value of 2 and Z′ value of 0.5. Within the crystal structure, the entire molecule is predominantly flat. The molecular packing exhibits a herringbone pattern, distinct from that of the unchlorinated analogue molecule. The largest facet of the crystals, which faces the supporting carbon film, is designated as (0 1 ‾ 1 ‾ ).

Keywords: 3D electron diffraction; continuous rotation; crystal morphology; electron crystallography; molecular packing
Corresponding author: Tatiana E. Gorelik, Helmholtz Centre for Infection Research, SFPR, Inhoffenstraße 7, 38124, Braunschweig, Germany; and Helmholtz Institute for Pharmaceutical Research Saarland, MINS, Universitätscampus E8 1, 66123 Saarbrücken, Germany, E-mail:

  1. Author contributions: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.

  2. Research funding: None declared.

  3. Conflict of interest statement: The authors declare no conflicts of interest regarding this article.

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Supplementary Material

This article contains supplementary material (https://doi.org/10.1515/zkri-2023-0009).

Received: 2023-02-14
Accepted: 2023-05-15
Published Online: 2023-06-01
Published in Print: 2023-07-26

© 2023 Walter de Gruyter GmbH, Berlin/Boston

Artikel in diesem Heft

  1. Frontmatter
  2. In this issue
  3. Inorganic Crystal Structures (Original Paper)
  4. Crown ether complexes as a possible template for hybrid organic–inorganic borates
  5. Artefacts from Ban Chiang, Thailand: Pre-metal Age cord-marked pottery
  6. The versatility of 1,4,8,11-tetraazacyclotetradecane (cyclam) in the formation of compounds of Co2+, Ni2+, Cu2+, and Zn2+ with metal ions in and out of the cyclic ligand ring
  7. Organic and Metalorganic Crystal Structures (Original Paper)
  8. Crystal structure of 9,10-bis-((perchloro-phenyl)-ethynyl)anthracene determined from three-dimensional electron diffraction data
  9. Structure determination through powder X-ray diffraction, Hirshfeld surface analysis, and DFT studies of 2- and 4-(methylthio)benzoic acid
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https://doi.org/10.1515/zkri-2023-0009
Schlagwörter für diesen Artikel
3D electron diffraction; continuous rotation; crystal morphology; electron crystallography; molecular packing

Artikel in diesem Heft

  1. Frontmatter
  2. In this issue
  3. Inorganic Crystal Structures (Original Paper)
  4. Crown ether complexes as a possible template for hybrid organic–inorganic borates
  5. Artefacts from Ban Chiang, Thailand: Pre-metal Age cord-marked pottery
  6. The versatility of 1,4,8,11-tetraazacyclotetradecane (cyclam) in the formation of compounds of Co2+, Ni2+, Cu2+, and Zn2+ with metal ions in and out of the cyclic ligand ring
  7. Organic and Metalorganic Crystal Structures (Original Paper)
  8. Crystal structure of 9,10-bis-((perchloro-phenyl)-ethynyl)anthracene determined from three-dimensional electron diffraction data
  9. Structure determination through powder X-ray diffraction, Hirshfeld surface analysis, and DFT studies of 2- and 4-(methylthio)benzoic acid
  10. Crystallographic Computing (Original Paper)
  11. Jana2020 – a new version of the crystallographic computing system Jana
  12. Structural basis for fluorine substitution on a new naphthalene–chalcone analog
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