1-[(1R,3S,4R)-3-Hydroxy-4-(Hydroxymethyl)Cyclopentyl]-5-[(E)-2-Iodovinyl]-2,4(1H,3H)-Pyrimidinedione

Molecule SVG Image

Properties Simple | Detailed

Formula C12H15IN2O4++
IUPAC Name 1-[(1r,3s,4r)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-[(e)-2-iodovinyl]pyrimidine-2,4-dione
Molecular Mass 378.163 g·mol−1
Heat of Formation -606.7 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 333.14 Å 3
Surface Area 296.23 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
Synonyms
  • 1-((1r,3s,4r)-3-hydroxy-4-hydroxymethyl-cyclopentyl)-5-((e)-2-iodo-vinyl)-1h-pyrimidine-2,4-dione
  • c-ivdu
InChIKey IVPBYJXSUIEMOB-CTNBOOGPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements I H C O N