| Formula |
C14H13N3OS2 |
| IUPAC Name |
5,6-dimethyl-3-(4-methyl-2-pyridyl)-2-sulfanyl-thieno[2,3-d]pyrimidine-3,7-diium-4-one |
| Molecular Mass |
303.403 g·mol−1 |
| Heat of Formation |
68.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.66 ± 1.08 D |
| Volume |
336.79 Å 3 |
| Surface Area |
302.2 Å 2 |
| HOMO Energy |
-8.45 ± 0.55 eV |
| LUMO Energy |
-1.40 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- hts 12825
- sr-01000638223-1
|
| InChIKey |
NYDQMBWQPMNQIZ-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
C
S
O
N
|
| |
|
