Please use this identifier to cite or link to this item:
http://doi.org/10.25358/openscience-7760
Authors: | Resch, Sebastian Quell, Thomas Schollmeyer, Dieter Waldvogel, Siegfried R. |
Title: | Crystal structure of 12-benzylsulfanyl-2,9-dibromo-6H-dibenzo[b,g][1,8]naphthyridin-11-one |
Online publication date: | 14-Sep-2022 |
Year of first publication: | 2015 |
Language: | english |
Abstract: | The heterotetracene skeleton of the title molecule, C23H14Br2N2OS, is defined by linear annulation of four six-membered rings, including two N heteroatoms. This moiety is nearly planar (r.m.s. deviation = 0.055 Å), with a slight twist of 4.1 (2)° between the two halves of the aromatic system. The dihedral angle between the least-squares plane of the skeleton and the benzyl group is 24.5 (3)°; the C-S-C angle involving the benzylsulfanyl group is 99.2 (4)°. In the crystal, molecules are [pi]-stacked in an antiparallel fashion along [110], with a distance between the aromatic planes of 3.47 (2) Å. Intermolecular N-H...O hydrogen bonds form chains extending parallel to [001] and bridge the antiparallel interdigitated stacks of molecules. |
DDC: | 540 Chemie 540 Chemistry and allied sciences |
Institution: | Johannes Gutenberg-Universität Mainz |
Department: | FB 09 Chemie, Pharmazie u. Geowissensch. |
Place: | Mainz |
ROR: | https://ror.org/023b0x485 |
DOI: | http://doi.org/10.25358/openscience-7760 |
Version: | Published version |
Publication type: | Zeitschriftenaufsatz |
License: | CC BY |
Information on rights of use: | https://creativecommons.org/licenses/by/2.0/uk |
Journal: | Acta crystallographica : Section E, Structure reports online 71 9 |
Pages or article number: | o675 o676 |
Publisher: | Wiley-Blackwell |
Publisher place: | Oxford |
Issue date: | 2015 |
Publisher URL: | http://dx.doi.org/10.1107/S2056989015014541 |
Publisher DOI: | 10.1107/S2056989015014541 |
Appears in collections: | DFG-OA-Publizieren (2012 - 2017) |
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File | Description | Size | Format | ||
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crystal_structure_of_12benzyl-20220914000215055.pdf | 408.22 kB | Adobe PDF | View/Open |