| Formula |
C17H28N4O8P2S |
| IUPAC Name |
2-[(2e)-3-[(4-amino-2-methyl-pyrimidine-1,3-diium-5-id-5-yl)methyl]-2-[(2s)-1-hydroxy-2-methyl-butylidene]-4-methyl-thiazol-5-yl]ethyl phosphono hydrogen phosphate |
| Molecular Mass |
510.439 g·mol−1 |
| Heat of Formation |
-1995.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.21 ± 1.08 D |
| Volume |
559.35 Å 3 |
| Surface Area |
454.43 Å 2 |
| HOMO Energy |
-7.59 ± 0.55 eV |
| LUMO Energy |
-1.41 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
YPBGUNFLCGKRQP-QNYHXWQBSA-N |
| QR Code |
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| DOI |
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|
| Elements |
C
H
O
N
P
S
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