N-({(5S)-3-[3-Fluoro-4-(1-Pyrrolidinyl)Phenyl]-4,5-Dihydro-1,2-Oxazol-5-Yl}Methyl)Acetamide
Properties
Property | Value |
---|---|
Formula | C16H20FN3O2 |
IUPAC Name | n-[[(5s)-3-(3-fluoro-4-pyrrolidin-1-yl-phenyl)-4,5-dihydroisoxazol-5-yl]methyl]acetamide |
Molecular Mass | 305.347 g·mol−1 |
Heat of Formation | -300.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.86 ± 1.08 D |
Volume | 362.84 Å 3 |
Surface Area | 331.38 Å 2 |
HOMO Energy | -9.15 ± 0.55 eV |
LUMO Energy | 2.23 ± eV |
Point Group Symmetry | C1 |
InChIKey | DTWBPWINMUHOOF-ZDUSSCGKSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | H C F O N |