Formula |
C11H10O5S |
IUPAC Name |
(2s)-2-methyl-2-sulfo-tetralin-1,4-dione |
Molecular Mass |
254.259 g·mol−1 |
Heat of Formation |
-743.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.80 ± 1.08 D |
Volume |
263.01 Å 3 |
Surface Area |
232.87 Å 2 |
HOMO Energy |
-10.61 ± 0.55 eV |
LUMO Energy |
1.46 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-1,4-diketo-2-methyl-tetralin-2-sulfonic acid
- (2s)-2-methyl-1,4-dioxo-2-tetralinsulfonic acid
- (2s)-2-methyl-1,4-dioxo-3h-naphthalene-2-sulfonic acid
- (2s)-2-methyl-1,4-dioxo-tetralin-2-sulfonic acid
|
InChIKey |
WIXFIQKTHUVFDI-NSHDSACASA-N |
QR Code |
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Links |
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|
DOI |
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Downloads |
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Elements |
H
S
C
O
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