4-(1,2,4-Triazol-1-yl)aniline
Copyright policy )4-(1,2,4-Triazol-1-yl)aniline
En el compuesto del título, C(8)H(8)N(4), el ángulo diedro entre el anillo de triazol [desviación máxima = 0.003 (1) Å] y el anillo de benceno es 34.57 (7) °. En el cristal, las mol-éculas están unidas en láminas que se encuentran paralelas al plano de CA a través de enlaces de hidrógeno N-H N y C-H N intermoleculares. También se observan el apilamiento aromático π-π [distancia centroide-centroide = 3,6750 (8) Å] y las interacciones N-H... π.
Dans le composé du titre, C(8)H(8)N(4), l'angle dièdre entre le cycle triazole [déviation maximale = 0,003 (1) Å] et le cycle benzène est de 34,57 (7) °. Dans le cristal, les mol-écules sont liées en feuilles parallèles au plan ac via des liaisons hydrogènes intermoléculaires N-H N et C-H N. On observe également un empilement aromatique π-π [distance centroïde-centroïde = 3,6750 (8) Å] et des interactions N-H ≃ π.
In the title compound, C(8)H(8)N(4), the dihedral angle between the triazole ring [maximum deviation = 0.003 (1) Å] and the benzene ring is 34.57 (7) °. In the crystal, mol-ecules are linked into sheets lying parallel to the ac plane via inter-molecular N-H⋯N and C-H⋯N hydrogen bonds. Aromatic π-π [centroid-centroid distance = 3.6750 (8) Å] stacking and N-H⋯π inter-actions are also observed.
In the title compound, C(8)H(8)N(4), the dihedral angle between the triazole ring [maximum deviation = 0.003 (1) Å] and the benzene ring is 34.57 (7)°. In the crystal, mol-ecules are linked into sheets lying parallel to the ac plane via inter-molecular N-H⋯N and C-H⋯N hydrogen bonds. Aromatic π-π [centroid-centroid distance = 3.6750 (8) Å] stacking and N-H⋯π inter-actions are also observed.
في مركب العنوان، C(8)H(8)N(4)، الزاوية الثنائية السطوح بين حلقة التريازول [أقصى انحراف = 0.003 (1) Å] وحلقة البنزين هي 34.57 (7) °. في البلورة، ترتبط جزيئات المول في صفائح تقع موازية لمستوى التيار المتردد عبر الروابط الهيدروجينية بين الجزيئات N - H - N و C-H- N. كما لوحظ التراص العطري π - π [المسافة المركزية المركزية = 3.6750 (8) Å] والتفاعلات N - H π π.
- Manipal Institute of Technology India
- Manipal University India
- National Institute of Technology Karnataka India
- Universiti Sains Malaysia Malaysia
FOS: Computer and information sciences, Recent Advances in Triazine Chemistry, Bioinformatics, Organic chemistry, Crystal (programming language), Organic Papers, Inorganic Chemistry, FOS: Chemical sciences, Biology, Heterocyclic Compounds for Drug Discovery, Hydrogen bond, Crystallography, Organic Chemistry, Molecule, Benzene, Ring (chemistry), Computer science, Chemical Crystallography, Programming language, Hydrogen Bonding Interactions, Chemistry, Aniline, Stacking, QD901-999, Physical Sciences, Dihedral angle, Triazole
FOS: Computer and information sciences, Recent Advances in Triazine Chemistry, Bioinformatics, Organic chemistry, Crystal (programming language), Organic Papers, Inorganic Chemistry, FOS: Chemical sciences, Biology, Heterocyclic Compounds for Drug Discovery, Hydrogen bond, Crystallography, Organic Chemistry, Molecule, Benzene, Ring (chemistry), Computer science, Chemical Crystallography, Programming language, Hydrogen Bonding Interactions, Chemistry, Aniline, Stacking, QD901-999, Physical Sciences, Dihedral angle, Triazole
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