Clavatadine D
Properties
Property | Value |
---|---|
Formula | C15H19Br2N5O3 |
IUPAC Name | 7,9-dibromo-n-(5-guanidinopentyl)-8-oxo-1-oxa-2-azaspiro[4.5]deca-2,6,9-triene-3-carboxamide |
Molecular Mass | 477.151 g·mol−1 |
Heat of Formation | -93.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.15 ± 1.08 D |
Volume | 443.87 Å 3 |
Surface Area | 406.11 Å 2 |
HOMO Energy | -9.45 ± 0.55 eV |
LUMO Energy | -1.61 ± eV |
Point Group Symmetry | C1 |
InChIKey | OTXDUXAJSDNSCU-UHFFFAOYSA-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 |