Formula |
C10H8N2O2S |
IUPAC Name |
6-(4-hydroxyphenyl)-2-thioxo-pyrimidin-4-one |
Molecular Mass |
220.248 g·mol−1 |
Heat of Formation |
-147.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.60 ± 1.08 D |
Volume |
243.93 Å 3 |
Surface Area |
235.79 Å 2 |
HOMO Energy |
-8.97 ± 0.55 eV |
LUMO Energy |
1.75 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 6-(4-hydroxy-phenyl)-2-thioxo-2,3-dihydro-1h-pyrimidin-4-one
- 6-(4-hydroxyphenyl)-2-sulfanylidene-1h-pyrimidin-4-one
- 6-(4-hydroxyphenyl)-2-thioxo-1h-pyrimidin-4-one
- bas 02927278
- oprea1_281197
- oprea1_346353
- sdccgmls-0065098.p001
|
InChIKey |
WPNGNGKVFAIABV-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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