Formula |
C6H5NO6 |
IUPAC Name |
(6s)-6-hydroperoxy-6-hydroxy-4-nitro-cyclohexa-2,4-dien-1-one |
Molecular Mass |
187.107 g·mol−1 |
Heat of Formation |
-288.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.91 ± 1.08 D |
Volume |
186.83 Å 3 |
Surface Area |
185.43 Å 2 |
HOMO Energy |
-10.77 ± 0.55 eV |
LUMO Energy |
0.85 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- (6s)-6-hydroperoxy-6-hydroxy-4-nitro-1-cyclohexa-2,4-dienone
- (6s)-6-hydroperoxy-6-hydroxy-4-nitro-cyclohexa-2,4-dien-1-one
- xx3
|
InChIKey |
FWUJUIQFDWUIAR-LURJTMIESA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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