| Formula |
C16H17N3O4S2 |
| IUPAC Name |
[5,7-dimethyl-2-(methylamino)-4-(3-pyridylmethyl)-1,3-benzothiazol-6-yl] hydrogen sulfate |
| Molecular Mass |
379.454 g·mol−1 |
| Heat of Formation |
-451.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.32 ± 1.08 D |
| Volume |
411.81 Å 3 |
| Surface Area |
346.5 Å 2 |
| HOMO Energy |
-8.60 ± 0.55 eV |
| LUMO Energy |
-0.83 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- [5,7-dimethyl-2-methylamino-4-(3-pyridylmethyl)-1,3-benzothiazol-6-yl] hydrogen sulfate
- [5,7-dimethyl-2-methylamino-4-(pyridin-3-ylmethyl)-1,3-benzothiazol-6-yl] hydrogen sulfate
|
| InChIKey |
LPZDTQCWCMPFND-UHFFFAOYSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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