| Formula |
C23H23N5OS |
| IUPAC Name |
(1s,2s)-2-[4-[(dimethylamino)methyl]phenyl]-n-[6-(3h-pyrazol-2-ium-3-ylium-4-yl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide |
| Molecular Mass |
417.527 g·mol−1 |
| Heat of Formation |
414.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.25 ± 1.08 D |
| Volume |
495.63 Å 3 |
| Surface Area |
446.15 Å 2 |
| HOMO Energy |
-8.66 ± 0.55 eV |
| LUMO Energy |
2.10 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
WIUYFJQWJMBTCE-MOPGFXCFSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
S
O
N
|
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