Formula |
C6H8F3N3O7P2 |
IUPAC Name |
[4-amino-2-(trifluoromethyl)pyrimidin-5-yl]methyl phosphono hydrogen phosphate |
Molecular Mass |
353.086 g·mol−1 |
Heat of Formation |
-2376.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.68 ± 1.08 D |
Volume |
317.29 Å 3 |
Surface Area |
293.33 Å 2 |
HOMO Energy |
-9.89 ± 0.55 eV |
LUMO Energy |
-1.52 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 4-amino-2-trifluoromethyl-5-hydroxymethylpyrimidine pyrophosphate
- [4-amino-2-(trifluoromethyl)-5-pyrimidinyl]methyl phosphono hydrogen phosphate
- fqp
|
InChIKey |
UKNJCTHTCAKKNG-UHFFFAOYSA-N |
QR Code |
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Links |
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|
DOI |
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Downloads |
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|
Elements |
C
F
H
O
N
P
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