Thymectacin

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Properties Simple | Detailed

Formula C21H25BrN3O9P++
IUPAC Name methyl (2r)-2-[[[(2s,3r,5s)-5-[5-[(e)-2-bromovinyl]-2,4-dioxo-pyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methoxy-phenoxy-phosphoryl]amino]propanoate
Molecular Mass 574.316 g·mol−1
Heat of Formation -1674.0 ± 16.7 kJ·mol−1
Dipole Moment 6.52 ± 1.08 D
Volume 590.92 Å 3
Surface Area 441.98 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy 2.14 ± eV
Point Group Symmetry C1
InChIKey CFBLUORPOFELCE-YYYQGIHCSA-N
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Elements C H O N P Br