Formula |
C19H24N4O8P2S |
IUPAC Name |
2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-[hydroxy(phenyl)methyl]-4-methyl-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate |
Molecular Mass |
530.428 g·mol−1 |
Heat of Formation |
1553.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.59 ± 1.08 D |
Volume |
526.25 Å 3 |
Surface Area |
449.37 Å 2 |
HOMO Energy |
-8.46 ± 0.55 eV |
LUMO Energy |
-3.14 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZOLUTNQCUQSPSG-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
P
C
S
O
N
|
|
|