(10R)-N-[(2E)-3-(2-Amino-1H-Imidazol-5-Yl)-2-Propen-1-Yl]-7,9-Dibromo-10-Hydroxy-8-Methoxy-1-Oxa-2-Azaspiro[4.5]Deca-2,6,8-Triene-3-Carboxamide
Properties
Property | Value |
---|---|
Formula | C16H17Br2N5O4 |
IUPAC Name | (5s,6r)-n-[(e)-3-(2-aminoimidazol-3-ium-4-ylium-4-yl)allyl]-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide |
Molecular Mass | 503.145 g·mol−1 |
Heat of Formation | -112.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.24 ± 1.08 D |
Volume | 455.54 Å 3 |
Surface Area | 402.51 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -1.36 ± eV |
Point Group Symmetry | C1 |
InChIKey | RPBHRSIJJYCYKG-NHLIRNCOSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Br N |