(1R)-3-(2,4-Diamino-6-Methyl-5-Pyrimidinyl)-1-(3,4,5-Trimethoxyphenyl)-2-Propyn-1-Ol
Properties
Property | Value |
---|---|
Formula | C17H20N4O4 |
IUPAC Name | (1r)-3-(2,4-diamino-6-methyl-pyrimidin-5-yl)-1-(3,4,5-trimethoxyphenyl)prop-2-yn-1-ol |
Molecular Mass | 344.365 g·mol−1 |
Heat of Formation | -251.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.37 ± 1.08 D |
Volume | 411.97 Å 3 |
Surface Area | 366.36 Å 2 |
HOMO Energy | -8.78 ± 0.55 eV |
LUMO Energy | -0.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | MRGVCWULZNEIIL-LBPRGKRZSA-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 |