Formula |
C7H10N6O |
IUPAC Name |
2-(2,3-diaza-1-azonia-4-azanidacyclopenta-2,5-dien-5-yl)-4-ethyl-5-methyl-pyrazol-1-ium-4-id-3-one |
Molecular Mass |
194.194 g·mol−1 |
Heat of Formation |
293.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
10.39 ± 1.08 D |
Volume |
224.25 Å 3 |
Surface Area |
216.74 Å 2 |
HOMO Energy |
-9.84 ± 0.55 eV |
LUMO Energy |
2.13 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-ethyl-5-methyl-2-(2h-1,2,3,4-tetrazol-5-yl)-1h-pyrazol-3-one
- 4-ethyl-5-methyl-2-(2h-tetrazol-5-yl)-1h-pyrazol-3-one
|
InChIKey |
WAVWUEFMWJZZFB-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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