4-[(1R,4S,5R,8S,9R,10R,12R,13R)-1,5,9-Trimethyl-11,14,15,16-Tetraoxatetracyclo[10.3.1.0~4,13~.0~8,13~]Hexadec-10-Yl]Thiomorpholine 1,1-Dioxide
Properties
Property | Value |
---|---|
Formula | C19H31NO6S |
IUPAC Name | 4-[(1r,4s,5r,8s,9r,10r,12r,13r)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]-1,4-thiazinane 1,1-dioxide |
Molecular Mass | 401.518 g·mol−1 |
Heat of Formation | -912.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.89 ± 1.08 D |
Volume | 459.06 Å 3 |
Surface Area | 356.83 Å 2 |
HOMO Energy | -9.37 ± 0.55 eV |
LUMO Energy | 0.52 ± eV |
Point Group Symmetry | C1 |
InChIKey | FDMUNKXWYMSZIR-NQWKWHCYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |