2-(2,4-Dinitrophenyl)Sulfanyl-5H-Pyrimidine-1,3-Diium-5-Ide
Properties
Property | Value |
---|---|
Formula | C10H6N4O4S |
IUPAC Name | 2-(2,4-dinitrophenyl)sulfanyl-5h-pyrimidine-1,3-diium-5-ide |
Molecular Mass | 278.244 g·mol−1 |
Heat of Formation | 279.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.92 ± 1.08 D |
Volume | 282.86 Å 3 |
Surface Area | 264.16 Å 2 |
HOMO Energy | -9.52 ± 0.55 eV |
LUMO Energy | -2.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | SSPWQCCPUPKIKM-UHFFFAOYSA-N |
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Elements | H S C O N |