| Formula |
C12H17N4O7P2S- |
| IUPAC Name |
[2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-3-ium-5-yl]ethoxy-oxido-phosphoryl] hydrogen phosphate |
| Molecular Mass |
423.299 g·mol−1 |
| Heat of Formation |
71.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.63 ± 1.08 D |
| Volume |
363.37 Å 3 |
| Surface Area |
313.87 Å 2 |
| HOMO Energy |
-9.02 ± 0.55 eV |
| LUMO Energy |
-1.93 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- [2-[3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-thiazol-3-iumyl]ethoxy-oxidophosphoryl] hydrogen phosphate
- [2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethoxy-oxido-phosphoryl] hydrogen phosphate
- [2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-3-ium-5-yl]ethoxy-oxido-phosphoryl] hydrogen phosphate
|
| InChIKey |
AYEKOFBPNLCAJY-UHFFFAOYSA-M |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
P
S
C
O
N
|
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