| Formula |
C14H21N4O7P2+ |
| IUPAC Name |
2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethyl phosphono hydrogen phosphate |
| Molecular Mass |
419.287 g·mol−1 |
| Heat of Formation |
854.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.45 ± 1.08 D |
| Volume |
371.18 Å 3 |
| Surface Area |
325.9 Å 2 |
| HOMO Energy |
-9.54 ± 0.55 eV |
| LUMO Energy |
-2.67 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-3-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-2-methylpyridinium
- 2-[1-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-2-methyl-3-pyridin-1-iumyl]ethyl phosphono hydrogen phosphate
- 2-[1-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-pyridin-1-ium-3-yl]ethyl phosphono hydrogen phosphate
- 2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethyl phosphono hydrogen phosphate
- pyi
- pyrithiamin pyrophosphate
|
| InChIKey |
ZHKSTKOYQKNDSJ-UHFFFAOYSA-O |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
P
C
O
N
|
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