6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1)
In the title molecular salt, C5H9N4+.C13H10NO2-.C5H8N4, the asymmetric unit consists of a 6-amino-3,4-dimethyl-1,2,4-triazin-1-ium cation, a 2-anilinobenzoate anion and a neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecule. The typical intramolecular N...H—O hydrogen bond is observed in the 2-anil...
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International Union of Crystallography
2017
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Online Access: | http://eprints.usm.my/37971/1/6-Amino-3%2C4-dimethyl-1%2C2%2C4-triazin-1-ium.pdf http://eprints.usm.my/37971/ https://doi.org/10.1107/S241431461700829X |
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my.usm.eprints.37971 http://eprints.usm.my/37971/ 6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) Sangeetha, Ramalingam Balasubramani, Kasthuri Thanigaimani, Kaliyaperumal Razak, Ibrahim Abdul QC1-999 Physics In the title molecular salt, C5H9N4+.C13H10NO2-.C5H8N4, the asymmetric unit consists of a 6-amino-3,4-dimethyl-1,2,4-triazin-1-ium cation, a 2-anilinobenzoate anion and a neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecule. The typical intramolecular N...H—O hydrogen bond is observed in the 2-anilinobenzoate anion. In the crystal, the protonated N atom and the 3-amino group are hydrogen bonded to the carboxylate oxygen atoms via a pair of N— H...O hydrogen bonds, forming an R2/2 (8) ring motif. These motifs are further linked with adjacent neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecules by N—H...O and N—H...N hydrogen bonds to produce centrosymmetric sixmembered units, enclosing R2/2(8) and R3/4(9) ring motifs. They are reinforced by a C—H...N hydrogen bond and stack up the b-axis direction. International Union of Crystallography 2017 Article PeerReviewed application/pdf en http://eprints.usm.my/37971/1/6-Amino-3%2C4-dimethyl-1%2C2%2C4-triazin-1-ium.pdf Sangeetha, Ramalingam and Balasubramani, Kasthuri and Thanigaimani, Kaliyaperumal and Razak, Ibrahim Abdul (2017) 6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1). IUCrData, 2017 (2). pp. 1-9. ISSN 2414-3146 https://doi.org/10.1107/S241431461700829X |
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QC1-999 Physics Sangeetha, Ramalingam Balasubramani, Kasthuri Thanigaimani, Kaliyaperumal Razak, Ibrahim Abdul 6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
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In the title molecular salt, C5H9N4+.C13H10NO2-.C5H8N4, the asymmetric unit consists of a 6-amino-3,4-dimethyl-1,2,4-triazin-1-ium cation, a 2-anilinobenzoate anion and a neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecule.
The typical intramolecular N...H—O hydrogen bond is observed in the 2-anilinobenzoate anion. In the crystal, the protonated N atom and the 3-amino group are hydrogen bonded to the carboxylate oxygen atoms via a pair of N—
H...O hydrogen bonds, forming an R2/2 (8) ring motif. These motifs are further linked with adjacent neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecules by N—H...O and N—H...N hydrogen bonds to produce centrosymmetric sixmembered units, enclosing R2/2(8) and R3/4(9) ring motifs. They are reinforced by a C—H...N hydrogen bond and stack up the b-axis direction. |
format |
Article |
author |
Sangeetha, Ramalingam Balasubramani, Kasthuri Thanigaimani, Kaliyaperumal Razak, Ibrahim Abdul |
author_facet |
Sangeetha, Ramalingam Balasubramani, Kasthuri Thanigaimani, Kaliyaperumal Razak, Ibrahim Abdul |
author_sort |
Sangeetha, Ramalingam |
title |
6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
title_short |
6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
title_full |
6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
title_fullStr |
6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
title_full_unstemmed |
6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
title_sort |
6-amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) |
publisher |
International Union of Crystallography |
publishDate |
2017 |
url |
http://eprints.usm.my/37971/1/6-Amino-3%2C4-dimethyl-1%2C2%2C4-triazin-1-ium.pdf http://eprints.usm.my/37971/ https://doi.org/10.1107/S241431461700829X |
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