Perfragilin A
Properties
Property | Value |
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Formula | C11H10N2O3S |
IUPAC Name | 7-amino-2-methyl-6-methylsulfanyl-isoquinoline-3,5,8-trione |
Molecular Mass | 250.274 g·mol−1 |
Heat of Formation | -315.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.93 ± 1.08 D |
Volume | 270.13 Å 3 |
Surface Area | 249.12 Å 2 |
HOMO Energy | -8.24 ± 0.55 eV |
LUMO Energy | -1.49 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | ODKVUEQLYLYTFC-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |