Formula |
C9H9N2O2S+ |
IUPAC Name |
5-[(5-methyl-3-thienyl)oxy]-1h-pyrimidin-1-ium-2-one |
Molecular Mass |
209.245 g·mol−1 |
Heat of Formation |
-68.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.00 ± 1.08 D |
Volume |
229.63 Å 3 |
Surface Area |
222.03 Å 2 |
HOMO Energy |
-8.85 ± 0.55 eV |
LUMO Energy |
1.96 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2(1h)-pyrimidinone, 5-((5-methyl-3-thienyl)oxy)-
- 2(1h)-pyrimidinone, 5-[(5-methyl-3-thienyl)oxy]-
- 2(1h)-pyrimidinone, {5-[(5-methyl-3-thienyl)oxy]-}
- 5-((5-methyl-3-thienyl)oxy)-2(1h)-pyrimidinone
- 5-((5-methyl-3-thienyl)oxy)-2-pyrimidinol
- 5-[(5-methyl-3-thienyl)oxy]-1h-pyrimidin-2-one
- mtop
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CAS Number(s) |
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InChIKey |
DRBJAKLMKNARRC-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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