Synthesis and crystal structure of 1H-1,2,4-triazole-3,5-diamine monohydrate
2024
Synthesis and crystal structure of 1H-1,2,4-triazole-3,5-diamine monohydrate
publication
Evidence: moderate
Author Information
Author(s): Inoue Kazuki, Nakami Shun, Kumasaki Mieko, Matsumoto Shinya
Primary Institution: Yokohama National University
Conclusion
The study successfully synthesized 1H-1,2,4-triazole-3,5-diamine monohydrate and determined its crystal structure, revealing significant hydrogen bonding interactions.
Supporting Evidence
- The crystal structure was determined using single-crystal X-ray diffraction.
- The synthesized hydrate crystallizes in the P21/c space group.
- Hirshfeld surface analysis showed that 8.5% of the intermolecular interactions are due to hydrogen bonds involving water molecules.
Takeaway
The researchers made a new type of crystal from a chemical called 1H-1,2,4-triazole-3,5-diamine and found out how it is structured.
Methodology
The compound was synthesized by dissolving 1 mmol of DATA and sodium perchlorate in deionized water, followed by evaporation to obtain needle-shaped crystals.
Digital Object Identifier (DOI)
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