2,5,6-Trichloro-1-.β.-D-Ribofuranosylbenzimidazole

Molecule SVG Image

Properties Simple | Detailed

Formula C12H11Cl3N2O4
IUPAC Name (2r,3s,4r,5r)-2-(hydroxymethyl)-5-(2,5,6-trichlorobenzimidazol-1-yl)tetrahydrofuran-3,4-diol
Molecular Mass 353.586 g·mol−1
Heat of Formation -591.9 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 347.48 Å 3
Surface Area 293.11 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-(2,5,6-trichloro-1-benzimidazolyl)tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-(2,5,6-trichlorobenzimidazol-1-yl)oxolane-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-(2,5,6-trichlorobenzimidazol-1-yl)tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-methylol-5-(2,5,6-trichlorobenzimidazol-1-yl)tetrahydrofuran-3,4-diol
  • tcrb
InChIKey BSDCIRGNJKZPFV-GWOFURMSSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl