Formula |
C13H15NO4S |
IUPAC Name |
3-(6-methoxyquinolin-1-ium-1-yl)propane-1-sulfonate |
Molecular Mass |
281.328 g·mol−1 |
Heat of Formation |
-384.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
15.28 ± 1.08 D |
Volume |
311.13 Å 3 |
Surface Area |
275.43 Å 2 |
HOMO Energy |
-9.05 ± 0.55 eV |
LUMO Energy |
1.58 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-(6-methoxy-1-quinolin-1-iumyl)propane-1-sulfonate
- 6-m-spq
- 6-methoxy-n-(3-sulfopropyl)quinolinium
- quinolinium, 6-methoxy-1-(3-sulfopropyl)-, hydroxide, inner salt
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CAS Number(s) |
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InChIKey |
ZVDGOJFPFMINBM-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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