Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene
In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F......
Ausführliche Beschreibung
Autor*in: |
Sevim Türktekin Çelikesir [verfasserIn] Mehmet Akkurt [verfasserIn] Namiq Q. Shikhaliyev [verfasserIn] Naila A. Mammadova [verfasserIn] Gulnar T. Suleymanova [verfasserIn] Victor N. Khrustalev [verfasserIn] Ajaya Bhattarai [verfasserIn] |
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Format: |
E-Artikel |
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Sprache: |
Englisch |
Erschienen: |
2022 |
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Übergeordnetes Werk: |
In: Acta Crystallographica Section E: Crystallographic Communications - International Union of Crystallography, 2015, 78(2022), 4, Seite 404-408 |
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Übergeordnetes Werk: |
volume:78 ; year:2022 ; number:4 ; pages:404-408 |
Links: |
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DOI / URN: |
10.1107/S205698902200278X |
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Katalog-ID: |
DOAJ063222027 |
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520 | |a In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. | ||
650 | 4 | |a crystal structure | |
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700 | 0 | |a Ajaya Bhattarai |e verfasserin |4 aut | |
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10.1107/S205698902200278X doi (DE-627)DOAJ063222027 (DE-599)DOAJbbec5966647e4409a28a76d40689b23b DE-627 ger DE-627 rakwb eng QD901-999 Sevim Türktekin Çelikesir verfasserin aut Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. crystal structure c—f...π interaction π–π stacking interaction hirshfeld surface analysis Crystallography Mehmet Akkurt verfasserin aut Namiq Q. Shikhaliyev verfasserin aut Naila A. Mammadova verfasserin aut Gulnar T. Suleymanova verfasserin aut Victor N. Khrustalev verfasserin aut Ajaya Bhattarai verfasserin aut In Acta Crystallographica Section E: Crystallographic Communications International Union of Crystallography, 2015 78(2022), 4, Seite 404-408 (DE-627)845400835 (DE-600)2843762-7 20569890 nnns volume:78 year:2022 number:4 pages:404-408 https://doi.org/10.1107/S205698902200278X kostenfrei https://doaj.org/article/bbec5966647e4409a28a76d40689b23b kostenfrei http://scripts.iucr.org/cgi-bin/paper?S205698902200278X kostenfrei https://doaj.org/toc/2056-9890 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_2014 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 78 2022 4 404-408 |
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10.1107/S205698902200278X doi (DE-627)DOAJ063222027 (DE-599)DOAJbbec5966647e4409a28a76d40689b23b DE-627 ger DE-627 rakwb eng QD901-999 Sevim Türktekin Çelikesir verfasserin aut Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. crystal structure c—f...π interaction π–π stacking interaction hirshfeld surface analysis Crystallography Mehmet Akkurt verfasserin aut Namiq Q. Shikhaliyev verfasserin aut Naila A. Mammadova verfasserin aut Gulnar T. Suleymanova verfasserin aut Victor N. Khrustalev verfasserin aut Ajaya Bhattarai verfasserin aut In Acta Crystallographica Section E: Crystallographic Communications International Union of Crystallography, 2015 78(2022), 4, Seite 404-408 (DE-627)845400835 (DE-600)2843762-7 20569890 nnns volume:78 year:2022 number:4 pages:404-408 https://doi.org/10.1107/S205698902200278X kostenfrei https://doaj.org/article/bbec5966647e4409a28a76d40689b23b kostenfrei http://scripts.iucr.org/cgi-bin/paper?S205698902200278X kostenfrei https://doaj.org/toc/2056-9890 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_2014 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 78 2022 4 404-408 |
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10.1107/S205698902200278X doi (DE-627)DOAJ063222027 (DE-599)DOAJbbec5966647e4409a28a76d40689b23b DE-627 ger DE-627 rakwb eng QD901-999 Sevim Türktekin Çelikesir verfasserin aut Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. crystal structure c—f...π interaction π–π stacking interaction hirshfeld surface analysis Crystallography Mehmet Akkurt verfasserin aut Namiq Q. Shikhaliyev verfasserin aut Naila A. Mammadova verfasserin aut Gulnar T. Suleymanova verfasserin aut Victor N. Khrustalev verfasserin aut Ajaya Bhattarai verfasserin aut In Acta Crystallographica Section E: Crystallographic Communications International Union of Crystallography, 2015 78(2022), 4, Seite 404-408 (DE-627)845400835 (DE-600)2843762-7 20569890 nnns volume:78 year:2022 number:4 pages:404-408 https://doi.org/10.1107/S205698902200278X kostenfrei https://doaj.org/article/bbec5966647e4409a28a76d40689b23b kostenfrei http://scripts.iucr.org/cgi-bin/paper?S205698902200278X kostenfrei https://doaj.org/toc/2056-9890 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_2014 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 78 2022 4 404-408 |
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10.1107/S205698902200278X doi (DE-627)DOAJ063222027 (DE-599)DOAJbbec5966647e4409a28a76d40689b23b DE-627 ger DE-627 rakwb eng QD901-999 Sevim Türktekin Çelikesir verfasserin aut Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. crystal structure c—f...π interaction π–π stacking interaction hirshfeld surface analysis Crystallography Mehmet Akkurt verfasserin aut Namiq Q. Shikhaliyev verfasserin aut Naila A. Mammadova verfasserin aut Gulnar T. Suleymanova verfasserin aut Victor N. Khrustalev verfasserin aut Ajaya Bhattarai verfasserin aut In Acta Crystallographica Section E: Crystallographic Communications International Union of Crystallography, 2015 78(2022), 4, Seite 404-408 (DE-627)845400835 (DE-600)2843762-7 20569890 nnns volume:78 year:2022 number:4 pages:404-408 https://doi.org/10.1107/S205698902200278X kostenfrei https://doaj.org/article/bbec5966647e4409a28a76d40689b23b kostenfrei http://scripts.iucr.org/cgi-bin/paper?S205698902200278X kostenfrei https://doaj.org/toc/2056-9890 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_2014 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 78 2022 4 404-408 |
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10.1107/S205698902200278X doi (DE-627)DOAJ063222027 (DE-599)DOAJbbec5966647e4409a28a76d40689b23b DE-627 ger DE-627 rakwb eng QD901-999 Sevim Türktekin Çelikesir verfasserin aut Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene 2022 Text txt rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. crystal structure c—f...π interaction π–π stacking interaction hirshfeld surface analysis Crystallography Mehmet Akkurt verfasserin aut Namiq Q. Shikhaliyev verfasserin aut Naila A. Mammadova verfasserin aut Gulnar T. Suleymanova verfasserin aut Victor N. Khrustalev verfasserin aut Ajaya Bhattarai verfasserin aut In Acta Crystallographica Section E: Crystallographic Communications International Union of Crystallography, 2015 78(2022), 4, Seite 404-408 (DE-627)845400835 (DE-600)2843762-7 20569890 nnns volume:78 year:2022 number:4 pages:404-408 https://doi.org/10.1107/S205698902200278X kostenfrei https://doaj.org/article/bbec5966647e4409a28a76d40689b23b kostenfrei http://scripts.iucr.org/cgi-bin/paper?S205698902200278X kostenfrei https://doaj.org/toc/2056-9890 Journal toc kostenfrei GBV_USEFLAG_A SYSFLAG_A GBV_DOAJ GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_39 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_63 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_95 GBV_ILN_105 GBV_ILN_110 GBV_ILN_151 GBV_ILN_161 GBV_ILN_170 GBV_ILN_213 GBV_ILN_230 GBV_ILN_285 GBV_ILN_293 GBV_ILN_370 GBV_ILN_602 GBV_ILN_2014 GBV_ILN_4012 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4126 GBV_ILN_4249 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4338 GBV_ILN_4367 GBV_ILN_4700 AR 78 2022 4 404-408 |
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Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene |
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Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene |
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Sevim Türktekin Çelikesir Mehmet Akkurt Namiq Q. Shikhaliyev Naila A. Mammadova Gulnar T. Suleymanova Victor N. Khrustalev Ajaya Bhattarai |
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crystal structure and hirshfeld surface analysis of (e)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene |
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Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene |
abstract |
In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. |
abstractGer |
In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. |
abstract_unstemmed |
In the title compound, C14H8Br2FN3O2, the nitro-substituted benzene ring and the 4-fluorophenyl ring form a dihedral angle of 65.73 (7)°. In the crystal, molecules are linked into chains by C—H...O hydrogen bonds running parallel to the c-axis direction. The crystal packing is consolidated by C—F...π interactions and π–π stacking interactions, and short Br...O [2.9828 (13) Å] contacts are observed. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions to the crystal packing are from H...H (17.4%), O...H/H...O (16.3%), Br...H/H...Br (15.5%), Br...C/C...Br (10.1%) and F...H/H...F (8.1%) contacts. |
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Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene |
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https://doi.org/10.1107/S205698902200278X https://doaj.org/article/bbec5966647e4409a28a76d40689b23b http://scripts.iucr.org/cgi-bin/paper?S205698902200278X https://doaj.org/toc/2056-9890 |
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