6-(1-Aziridinyl)-7-Methyl-5,8-Dioxo-2,3,5,8-Tetrahydro-1H-Pyrrolo[1,2-A]Benzimidazol-3-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C15H15N3O4 |
IUPAC Name | [(3r)-6-(aziridin-1-yl)-7-methyl-5,8-dioxo-2,3-dihydro-1h-pyrrolo[1,2-a]benzimidazol-3-yl] acetate |
Molecular Mass | 301.297 g·mol−1 |
Heat of Formation | -248.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.35 ± 1.08 D |
Volume | 339.9 Å 3 |
Surface Area | 307.9 Å 2 |
HOMO Energy | -9.29 ± 0.55 eV |
LUMO Energy | -1.50 ± eV |
Point Group Symmetry | C1 |
InChIKey | FFUXDQVPXSUWDA-SECBINFHSA-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 |