4-(6-Hydroxy-1,2-Benzoxazol-3-Yl)-1,3-Benzenediol
Properties
Property | Value |
---|---|
Formula | C13H9NO4 |
IUPAC Name | 4-(6-hydroxy-1,2-benzoxazol-3-yl)benzene-1,3-diol |
Molecular Mass | 243.215 g·mol−1 |
Heat of Formation | -319.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.66 ± 1.08 D |
Volume | 261.2 Å 3 |
Surface Area | 246.15 Å 2 |
HOMO Energy | -9.11 ± 0.55 eV |
LUMO Energy | 2.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | NBTXJDAHLMMIGY-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |