6-Ethyl-5-{3-[3-(5-Pyrimidinyl)Phenyl]-1-Propyn-1-Yl}-2,4-Pyrimidinediamine
Properties
Property | Value |
---|---|
Formula | C19H18N6 |
IUPAC Name | 6-ethyl-5-[3-(3-pyrimidin-5-ylphenyl)prop-1-ynyl]pyrimidine-2,4-diamine |
Molecular Mass | 330.386 g·mol−1 |
Heat of Formation | 535.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.53 ± 1.08 D |
Volume | 403.35 Å 3 |
Surface Area | 362.47 Å 2 |
HOMO Energy | -8.55 ± 0.55 eV |
LUMO Energy | -1.11 ± eV |
Point Group Symmetry | C1 |
InChIKey | UEZKDWYIIOOENX-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |