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N (1),N (4),3,6-Tetramethyl-1,2,4,5-tetrazine-1,4-dicarboxamide
The asymmetric unit of the title compound, C(8)H(14)N(6)O(2), contains two independent molecules. In one molecule, the amide-substituted N atoms of the tetrazine ring deviate from the plane [maximum deviation = 0.028 (1) Å] through the four other atoms in the ring by 0.350 (2) and 0.344 (2) Å, fo...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379411/ https://www.ncbi.nlm.nih.gov/pubmed/22719609 http://dx.doi.org/10.1107/S1600536812022519 |
Sumario: | The asymmetric unit of the title compound, C(8)H(14)N(6)O(2), contains two independent molecules. In one molecule, the amide-substituted N atoms of the tetrazine ring deviate from the plane [maximum deviation = 0.028 (1) Å] through the four other atoms in the ring by 0.350 (2) and 0.344 (2) Å, forming a boat conformation, and the mean planes of the two carboxamide groups form dihedral angles of 10.46 (13) and 20.41 (12)° with the four approximtely planar atoms in the tetrazine ring. In the other molecule, the amide-substituted N atoms of the tetrazine ring deviate from the plane [maximum deviation = 0.033 (1) Å] through the four other atoms in the ring by 0.324 (2) and 0.307 (2) Å, forming a boat conformation, and the mean planes of the two carboxamide groups form dihedral angles of 14.66 (11) and 17.08 (10)° with the four approximately planar atoms of the tetrazine ring. In the crystal, N—H⋯O hydrogen bonds connect molecules to form a two-dimensional network parallel to (1-1-1). Intramolecular N—H⋯N hydrogen bonds are observed. |
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