1-(3,4-Dihydroxybenzyl)-7-Hydroxy-6(2H)-Isoquinolinone
Properties
Property | Value |
---|---|
Formula | C16H13NO4 |
IUPAC Name | 1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxy-2h-isoquinolin-6-one |
Molecular Mass | 283.279 g·mol−1 |
Heat of Formation | -419.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 11.06 ± 1.08 D |
Volume | 318.54 Å 3 |
Surface Area | 288.22 Å 2 |
HOMO Energy | -8.08 ± 0.55 eV |
LUMO Energy | 2.06 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | HGZKLOLFPCXWBE-UHFFFAOYSA-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 |