Please use this identifier to cite or link to this item:
http://hdl.handle.net/2289/7461
Full metadata record
DC Field | Value | Language |
---|---|---|
dc.contributor.author | Leela, Sundararaman | - |
dc.contributor.author | Subashini, A. | - |
dc.contributor.author | Philip, Reji | - |
dc.contributor.author | Ramamurthi, Kandasamy | - |
dc.contributor.author | Stoeckli-Evans, Helen | - |
dc.date.accessioned | 2020-04-27T09:26:19Z | - |
dc.date.available | 2020-04-27T09:26:19Z | - |
dc.date.issued | 2020-03 | - |
dc.identifier.citation | Acta Crystallographica section E, 2020, Vol.76, p417–422 | en_US |
dc.identifier.issn | 2056-9890 | - |
dc.identifier.uri | http://hdl.handle.net/2289/7461 | - |
dc.description | Open Access | en_US |
dc.description.abstract | In the crystal of the title Schiff base compound, C13H9ClN2O2, [CNBA; systematic name: (E)-N-(4-chlorophenyl)-1-(4-nitrophenyl)methanimine], the CNBA molecule shows whole-molecule disorder (occupancy ratio 0.65:0.35), with the disorder components related by a twofold rotation about the shorter axis of the molecule. The aromatic rings are inclined to each other by 39.3 (5)° in the major component and by 35.7 (9)° in the minor component. In the crystal, C—H...O hydrogen bonds predominate in linking the major components, while weak C—H...Cl interactions predominate in linking the minor components. The result is the formation of corrugated layers lying parallel to the ac plane. The crystal packing was analysed using Hirshfeld surface analysis and compared with related structures | en_US |
dc.language.iso | en | en_US |
dc.publisher | International Union of Crystallography | en_US |
dc.relation.uri | https://doi.org/10.1107/S2056989020002212 | en_US |
dc.rights | 2020 International Union of Crystallography | en_US |
dc.subject | crystal structure | en_US |
dc.subject | Schiff bases | en_US |
dc.subject | non-linear optical properties | en_US |
dc.subject | disorder | en_US |
dc.subject | hydrogen bonding | en_US |
dc.subject | Hirshfeld surface analysis | en_US |
dc.title | Whole-molecule disorder of the Schiff base compound 4-chloro-N-(4-nitrobenzylidene)aniline: crystal structure and Hirshfeld surface analysis | en_US |
dc.type | Dataset | en_US |
Appears in Collections: | Research Papers (LAMP) |
Files in This Item:
File | Description | Size | Format | |
---|---|---|---|---|
2020_Acta Cryst E_Vol.76_p417-422.pdf | Open Access | 998.71 kB | Adobe PDF | View/Open |
Items in RRI Digital Repository are protected by copyright, with all rights reserved, unless otherwise indicated.