| Formula |
C11H12N2S2 |
| IUPAC Name |
methyl n-(indol-1-ium-3-ylmethyl)carbamodithioate |
| Molecular Mass |
236.356 g·mol−1 |
| Heat of Formation |
244.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.72 ± 1.08 D |
| Volume |
279.32 Å 3 |
| Surface Area |
260.76 Å 2 |
| HOMO Energy |
-8.30 ± 0.55 eV |
| LUMO Energy |
2.47 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (1h-indol-3-ylmethylamino)methanedithioic acid methyl ester
- brassinin
- brassinine
- carbamodithioic acid, (1h-indol-3-ylmethyl)-, methyl ester
- methyl (1h-indol-3-ylmethyl)dithiocarbamate
- methyl (1h-indol-3-ylmethylamino)methanedithioate
- smp2_000288
|
| CAS Number(s) |
|
| InChIKey |
QYKQWFZDEDFELK-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
|
| |
|
