6-(Methylsulfinyl)Hexyl Isothiocyanate
Properties
Property | Value |
---|---|
Formula | C8H15NOS2 |
IUPAC Name | 1-isothiocyanato-6-[(r)-methylsulfinyl]hexane |
Molecular Mass | 205.341 g·mol−1 |
Heat of Formation | -81.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.03 ± 1.08 D |
Volume | 264.91 Å 3 |
Surface Area | 262.62 Å 2 |
HOMO Energy | -8.77 ± 0.55 eV |
LUMO Energy | -0.32 ± eV |
Point Group Symmetry | C1 |
InChIKey | XQZVZULJKVALRI-GFCCVEGCSA-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 |