Aspergillitine
Properties
Property | Value |
---|---|
Formula | C15H13NO2 |
IUPAC Name | 2,3,8-trimethyl-7h-pyrano[3,2-h]isoquinolin-9-ium-7-id-4-one |
Molecular Mass | 239.269 g·mol−1 |
Heat of Formation | -151.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.28 ± 1.08 D |
Volume | 280.99 Å 3 |
Surface Area | 261.87 Å 2 |
HOMO Energy | -9.11 ± 0.55 eV |
LUMO Energy | 2.97 ± eV |
Point Group Symmetry | C1 |
InChIKey | UCURHOJUSAYQKR-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 |