1-Deoxy-1-{[(1,5-Dimethyl-3-Oxo-2-Phenyl-2,3-Dihydro-1H-Pyrazol-4-Yl)Methyl]Amino}Hex-2-Ulofuranose
Properties
Property | Value |
---|---|
Formula | C18H25N3O6 |
IUPAC Name | 1,5-dimethyl-2-phenyl-4-[[[(2r,3r,4r,5s)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]methylamino]methyl]pyrazol-3-one |
Molecular Mass | 379.408 g·mol−1 |
Heat of Formation | -869.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.63 ± 1.08 D |
Volume | 449.07 Å 3 |
Surface Area | 387.37 Å 2 |
HOMO Energy | -8.75 ± 0.55 eV |
LUMO Energy | 2.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | IVQSHABPWKVXAU-LISAXSMJSA-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 |