Formula |
C8H10N4O2S |
IUPAC Name |
3-(2-methoxyethyl)-2-thioxo-7,8-dihydropurine-4,5,8,9-tetraid-6-one |
Molecular Mass |
226.256 g·mol−1 |
Heat of Formation |
-86.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.87 ± 1.08 D |
Volume |
250.57 Å 3 |
Surface Area |
231.59 Å 2 |
HOMO Energy |
-8.70 ± 0.55 eV |
LUMO Energy |
2.07 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 3-(2-methoxyethyl)-2-thioxo-7h-purin-6-one
|
InChIKey |
VXTADZREIUKIHH-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
S
C
O
N
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