5-(2-Bromoethyl)-1-(2-Deoxypentofuranosyl)-2,4(1H,3H)-Pyrimidinedione

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Formula C11H15BrN2O5
IUPAC Name 5-(2-bromoethyl)-1-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 335.151 g·mol−1
Heat of Formation -914.0 ± 16.7 kJ·mol−1
Dipole Moment 6.74 ± 1.08 D
Volume 324.31 Å 3
Surface Area 291.45 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey ARAPHVJYXVDNPN-HRDYMLBCSA-N
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Elements H C O Br N