Formula |
C10H9N3OS |
IUPAC Name |
6-anilino-2-thioxo-1h-pyrimidin-4-one |
Molecular Mass |
219.263 g·mol−1 |
Heat of Formation |
55.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.60 ± 1.08 D |
Volume |
247.59 Å 3 |
Surface Area |
236.97 Å 2 |
HOMO Energy |
-8.90 ± 0.55 eV |
LUMO Energy |
-1.36 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 6-(phenylamino)-2-sulfanylidene-1h-pyrimidin-4-one
- 6-(phenylamino)-2-thioxo-1h-pyrimidin-4-one
- 6-anilino-2-thiouracil
- atu-6,2
- oprea1_463217
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CAS Number(s) |
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InChIKey |
TUFAZQMRQMDSLB-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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