Benzyl (1-Oxido-1,3-Benzothiazol-3(2H)-Yl)Acetate
Properties
Property | Value |
---|---|
Formula | C16H15NO3S |
IUPAC Name | benzyl 2-[(1r,3s)-1-oxo-2h-1,3-benzothiazol-3-yl]acetate |
Molecular Mass | 301.360 g·mol−1 |
Heat of Formation | -250.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.14 ± 1.08 D |
Volume | 341.91 Å 3 |
Surface Area | 263.7 Å 2 |
HOMO Energy | -8.67 ± 0.55 eV |
LUMO Energy | -0.22 ± eV |
Point Group Symmetry | C1 |
InChIKey | NYJPEPLUJURLCQ-NRFANRHFSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H S C O N |