N-(2-Amino-2-Methylpropyl)-2-[(1S,4S,5'S,5''R)-5''-Hydroxydispiro[Cyclohexane-1,3'-[1,2,4]Trioxolane-5',2''-Tricyclo[3.3.1.1~3,7~]Decan]-4-Yl]Acetamide
Properties
Property | Value |
---|---|
Formula | C22H36N2O5 |
IUPAC Name | n-(2-amino-2-methylpropyl)-2-[(1s,4s,5'r,5''s)-5''-hydroxydispiro[cyclohexane-1,3'-[1,2,4]trioxolane-5',2''-tricyclo[3.3.1.1 3,7 ]decan]-4-yl]acetamide |
Molecular Mass | 408.532 g·mol−1 |
Heat of Formation | -895.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.92 ± 1.08 D |
Volume | 506.1 Å 3 |
Surface Area | 391.52 Å 2 |
HOMO Energy | -9.36 ± 0.55 eV |
LUMO Energy | 0.54 ± eV |
Point Group Symmetry | C1 |
InChIKey | OKSIVAIYFNVYGK-NJMHLXRQSA-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 |