6-[(4-Methoxybenzyl)Sulfanyl]-2,4-Pyrimidinediamine
Properties
Property | Value |
---|---|
Formula | C12H14N4OS |
IUPAC Name | 6-[(4-methoxyphenyl)methylsulfanyl]pyrimidine-2,4-diamine |
Molecular Mass | 262.331 g·mol−1 |
Heat of Formation | 44.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.56 ± 1.08 D |
Volume | 304.33 Å 3 |
Surface Area | 289.75 Å 2 |
HOMO Energy | -8.53 ± 0.55 eV |
LUMO Energy | 2.97 ± eV |
Point Group Symmetry | C1 |
InChIKey | SMBANLHZRGNZKV-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |