(2S,5S)-5-(Hydroxymethyl)-2-Isopropyl-1-Methyl-8-Octyl-1,2,4,5,6,7-Hexahydro-3H-1,4-Benzodiazonin-3-One
Properties
Property | Value |
---|---|
Formula | C24H40N2O2 |
IUPAC Name | (2s,5s)-5-(hydroxymethyl)-2-isopropyl-1-methyl-8-octyl-4,5,6,7-tetrahydro-2h-1,4-benzodiazonin-3-one |
Molecular Mass | 388.587 g·mol−1 |
Heat of Formation | -530.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.20 ± 1.08 D |
Volume | 530.83 Å 3 |
Surface Area | 441.1 Å 2 |
HOMO Energy | -8.70 ± 0.55 eV |
LUMO Energy | 0.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | IDVIOLNZWSXZGL-REWPJTCUSA-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 |