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3-Nitrobenzonitrile
The crystal structure of 3-nitrobenzonitrile, C(7)H(4)N(2)O(2), was elucidated by low-temperature single-crystal X-ray diffraction. The compound crystallizes in the Sohncke space group P2(1) and features two molecules in the unit cell. Aromatic π–π stacking leads to stacks of molecules in the [100...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10561223/ https://www.ncbi.nlm.nih.gov/pubmed/37818464 http://dx.doi.org/10.1107/S2414314623008143 |
| _version_ | 1785117874747080704 |
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| author | Virant, Miha Siljanovska, Ana Cerkovnik, Janez Lozinšek, Matic |
| author_facet | Virant, Miha Siljanovska, Ana Cerkovnik, Janez Lozinšek, Matic |
| author_sort | Virant, Miha |
| collection | PubMed |
| description | The crystal structure of 3-nitrobenzonitrile, C(7)H(4)N(2)O(2), was elucidated by low-temperature single-crystal X-ray diffraction. The compound crystallizes in the Sohncke space group P2(1) and features two molecules in the unit cell. Aromatic π–π stacking leads to stacks of molecules in the [100] direction. The absolute structure was established from anomalous dispersion. [Image: see text] |
| format | Online Article Text |
| id | pubmed-10561223 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2023 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-105612232023-10-10 3-Nitrobenzonitrile Virant, Miha Siljanovska, Ana Cerkovnik, Janez Lozinšek, Matic IUCrdata Data Reports The crystal structure of 3-nitrobenzonitrile, C(7)H(4)N(2)O(2), was elucidated by low-temperature single-crystal X-ray diffraction. The compound crystallizes in the Sohncke space group P2(1) and features two molecules in the unit cell. Aromatic π–π stacking leads to stacks of molecules in the [100] direction. The absolute structure was established from anomalous dispersion. [Image: see text] International Union of Crystallography 2023-09-22 /pmc/articles/PMC10561223/ /pubmed/37818464 http://dx.doi.org/10.1107/S2414314623008143 Text en © Virant et al. 2023 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
| spellingShingle | Data Reports Virant, Miha Siljanovska, Ana Cerkovnik, Janez Lozinšek, Matic 3-Nitrobenzonitrile |
| title | 3-Nitrobenzonitrile |
| title_full | 3-Nitrobenzonitrile |
| title_fullStr | 3-Nitrobenzonitrile |
| title_full_unstemmed | 3-Nitrobenzonitrile |
| title_short | 3-Nitrobenzonitrile |
| title_sort | 3-nitrobenzonitrile |
| topic | Data Reports |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10561223/ https://www.ncbi.nlm.nih.gov/pubmed/37818464 http://dx.doi.org/10.1107/S2414314623008143 |
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