Formula |
C10H12BrN5O4 |
IUPAC Name |
2-(15n)azanyl-8-bromo-9-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purin-6-one |
Molecular Mass |
349.118 g·mol−1 |
Heat of Formation |
994.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
10.08 ± 1.08 D |
Volume |
281.13 Å 3 |
Surface Area |
263.03 Å 2 |
HOMO Energy |
-9.14 ± 0.55 eV |
LUMO Energy |
-4.26 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MKDXZFVCXWXGBQ-VPENINKCSA-P |
QR Code |
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Links |
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DOI |
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Elements |
C
O
Br
N
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