6-Ethyl-5-[3-(4-Methoxy-3-Biphenylyl)-1-Propyn-1-Yl]-2,4-Pyrimidinediamine
Properties
Property | Value |
---|---|
Formula | C22H22N4O |
IUPAC Name | 6-ethyl-5-[3-(2-methoxy-5-phenyl-phenyl)prop-1-ynyl]pyrimidine-2,4-diamine |
Molecular Mass | 358.436 g·mol−1 |
Heat of Formation | 282.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.08 ± 1.08 D |
Volume | 443.35 Å 3 |
Surface Area | 391.08 Å 2 |
HOMO Energy | -8.32 ± 0.55 eV |
LUMO Energy | 2.88 ± eV |
Point Group Symmetry | C1 |
InChIKey | LBQMRSNKEUNXMT-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |