1-(2,3,5-Tri-O-Butyl-β-D-Ribofuranosyl)-1H-1,2,4-Triazole-3-Carboxamide
Properties
Property | Value |
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Formula | C20H36N4O5 |
IUPAC Name | 1-[(2r,3r,4r,5r)-3,4-dibutoxy-5-(butoxymethyl)tetrahydrofuran-2-yl]-4-aza-1-azonia-2-azanidacyclopenta-3,5-diene-3-carboxamide |
Molecular Mass | 412.524 g·mol−1 |
Heat of Formation | -811.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.69 ± 1.08 D |
Volume | 525.47 Å 3 |
Surface Area | 443.98 Å 2 |
HOMO Energy | -9.97 ± 0.55 eV |
LUMO Energy | -0.19 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | PHGTXFGCUSQWBU-WOCWXWTJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |