Formula |
C9H12N3O7P |
IUPAC Name |
1-[(2s,3ar,4s,6s,6ar)-2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-4-amino-pyrimidin-2-one |
Molecular Mass |
305.181 g·mol−1 |
Heat of Formation |
-1401.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.47 ± 1.08 D |
Volume |
301.72 Å 3 |
Surface Area |
263.8 Å 2 |
HOMO Energy |
-9.20 ± 0.55 eV |
LUMO Energy |
2.63 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-amino-1-[(1r,2s,4s,5r)-7-hydroxy-2-(hydroxymethyl)-7-oxo-3,6,8-trioxa-7$l^{5}-phosphabicyclo[3.3.0]octan-4-yl]-2-pyrimidinone
- 4-amino-1-[(1r,2s,4s,5r)-7-hydroxy-7-keto-2-methylol-3,6,8-trioxa-7$l^{5}-phosphabicyclo[3.3.0]octan-4-yl]pyrimidin-2-one
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InChIKey |
NMPZCCZXCOMSDQ-IHBLQFBFSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
P
C
H
O
N
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