| Formula |
C8H15NS2 |
| IUPAC Name |
1-isothiocyanato-6-methylsulfanyl-hexane |
| Molecular Mass |
189.341 g·mol−1 |
| Heat of Formation |
39.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.22 ± 1.08 D |
| Volume |
254.33 Å 3 |
| Surface Area |
248.99 Å 2 |
| HOMO Energy |
-8.60 ± 0.55 eV |
| LUMO Energy |
-0.12 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-isothiocyanato-6-(methylthio)hexane
- 1-isothiocyanato-6-methylsulfanylhexane
- hexane, 1-isothiocyanato-6-(methylthio)-
|
| CAS Number(s) |
|
| InChIKey |
YIBXPFAXPUDDTK-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
S
C
N
|
| |
|
