(2Xi)-2'-Chlorothymidine

Molecule SVG Image

Properties Simple | Detailed

Formula C10H13ClN2O5++
IUPAC Name 1-[(2s,3s,4r,5r)-3-chloro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 276.674 g·mol−1
Heat of Formation -941.3 ± 16.7 kJ·mol−1
Dipole Moment 4.69 ± 1.08 D
Volume 292.62 Å 3
Surface Area 261.42 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -0.40 ± eV
Point Group Symmetry C1
InChIKey WQMQACLYZYXSDZ-AYHNYZOXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl