1-(5H-Pyrimidine-1,3-Diium-5-Id-2-Yl)Piperidine-2,3,5,6-Tetraid-4-Imine
Properties
Property | Value |
---|---|
Formula | C9H19N4+ |
IUPAC Name | 1-hexahydropyrimidin-2-ylpiperidin-1-ium-4-imine |
Molecular Mass | 183.274 g·mol−1 |
Heat of Formation | 394.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.98 ± 1.08 D |
Volume | 201.42 Å 3 |
Surface Area | 200.49 Å 2 |
HOMO Energy | -8.66 ± 0.55 eV |
LUMO Energy | 1.80 ± eV |
Point Group Symmetry | Cs |
InChIKey | MEMGSCXLWCDFDB-UHFFFAOYSA-O |
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Elements | H C N |