Formula |
C11H9N3O3S |
IUPAC Name |
4,6-dioxo-n-phenyl-2-thioxo-hexahydropyrimidine-5-carboxamide |
Molecular Mass |
263.272 g·mol−1 |
Heat of Formation |
-303.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.09 ± 1.08 D |
Volume |
282.73 Å 3 |
Surface Area |
268.25 Å 2 |
HOMO Energy |
-9.32 ± 0.55 eV |
LUMO Energy |
-1.64 ± eV |
Point Group Symmetry |
Cs
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Synonyms
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- 4,6-diketo-n-phenyl-2-thioxo-hexahydropyrimidine-5-carboxamide
- 4,6-dioxo-n-phenyl-2-thioxo-5-hexahydropyrimidinecarboxamide
- 4,6-dioxo-n-phenyl-2-thioxo-hexahydropyrimidine-5-carboxamide
- 5-(n-phenylcarbamoyl)-2-thiobarbituric acid
- hsci1_000067
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InChIKey |
JARCFMKMOFFIGZ-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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