6-[2-(Hydroxymethyl)Phenyl]-1(2H)-Isoquinolinone
Properties
Property | Value |
---|---|
Formula | C16H13NO2 |
IUPAC Name | 6-[2-(hydroxymethyl)phenyl]isoquinolin-2-ium-1-one |
Molecular Mass | 251.280 g·mol−1 |
Heat of Formation | -134.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.12 ± 1.08 D |
Volume | 296.15 Å 3 |
Surface Area | 270.62 Å 2 |
HOMO Energy | -8.95 ± 0.55 eV |
LUMO Energy | 3.31 ± eV |
Point Group Symmetry | C1 |
InChIKey | UYPQNXCIONEUFC-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |