(9R,14As)-9-Benzyl-5-Hydroxy-6-Methyl-3-(7-Oxo-2-Octanyl)Decahydro-1H-Pyrrolo[2,1-C][1,4,7]Oxadiazacyclododecine-1,7,10-Trione
Properties
Property | Value |
---|---|
Formula | C28H40N2O6 |
IUPAC Name | 3-benzyl-7-hydroxy-6-methyl-9-(1-methyl-6-oxo-heptyl)-10-oxa-1,4-diazabicyclo[10.3.0]pentadecane-2,5,11-trione |
Molecular Mass | 500.627 g·mol−1 |
Heat of Formation | -1176.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.40 ± 1.08 D |
Volume | 630.49 Å 3 |
Surface Area | 459.64 Å 2 |
HOMO Energy | -9.50 ± 0.55 eV |
LUMO Energy | 3.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | AOQQOEQINNPMNK-MWXQHUHWSA-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 |