5-Amino-N-(2,6-Difluorophenyl)-3-[(4-Sulfamoylphenyl)Amino]-1H-1,2,4-Triazole-1-Carbothioamide
Properties
Property | Value |
---|---|
Formula | C15H13F2N7O2S2 |
IUPAC Name | 5-amino-n-(2,6-difluorophenyl)-3-(4-sulfamoylanilino)-1,2,4-triazole-1-carbothioamide |
Molecular Mass | 425.436 g·mol−1 |
Heat of Formation | -142.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.70 ± 1.08 D |
Volume | 431.53 Å 3 |
Surface Area | 389.52 Å 2 |
HOMO Energy | -8.83 ± 0.55 eV |
LUMO Energy | -1.53 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | ARIOBGGRZJITQX-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H O N S |