Methyl (3R)-3-(7-Amino-4,5-Dioxo-1,4,5,6-Tetrahydropyrimido[4,5-C]Pyridazin-3-Yl)Butanoate

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Formula C11H13N5O4
IUPAC Name methyl (3r)-3-(7-amino-4,5-dioxo-1,8-dihydropyrimido[4,5-c]pyridazin-3-yl)butanoate
Molecular Mass 279.252 g·mol−1
Heat of Formation -409.7 ± 16.7 kJ·mol−1
Dipole Moment 10.64 ± 1.08 D
Volume 304.4 Å 3
Surface Area 284.15 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
InChIKey JEWNFTGWEYCQGA-SCSAIBSYSA-N
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