Formula |
C11H6N4O4S |
IUPAC Name |
7-nitro-4-(1-oxidopyridin-1-ium-2-yl)sulfanyl-2,1,3-benzoxadiazole |
Molecular Mass |
290.255 g·mol−1 |
Heat of Formation |
459.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.37 ± 1.08 D |
Volume |
291.22 Å 3 |
Surface Area |
267.97 Å 2 |
HOMO Energy |
-9.17 ± 0.55 eV |
LUMO Energy |
-0.33 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-nitro-7-[(1-oxido-2-pyridin-1-iumyl)thio]-2,1,3-benzoxadiazole
- 4-nitro-7-[(1-oxidopyridin-1-ium-2-yl)thio]benzofurazan
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InChIKey |
ICCFXXDUYSPKOL-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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