2-(2-Hydroxyethoxy)-6-(2H-Tetrazol-5-Yl)-9H-Xanthen-9-One

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Properties Simple | Detailed

Formula C16H12N4O4
IUPAC Name 2-(2-hydroxyethoxy)-6-(2h-tetrazol-5-yl)xanthen-9-one
Molecular Mass 324.291 g·mol−1
Heat of Formation -96.8 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 346.74 Å 3
Surface Area 324.04 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(2-hydroxyethoxy)-6-(2h-1,2,3,4-tetrazol-5-yl)xanthen-9-one
  • 2-(2-hydroxyethoxy)-6-(2h-tetrazol-5-yl)-9-xanthenone
  • 2-(2-hydroxyethoxy)-6-(2h-tetrazol-5-yl)xanthone
  • 9h-xanthen-9-one, 2-(2-hydroxyethoxy)-6-(1h-tetrazol-5-yl)-
  • bw a440c
  • bwa 440c
  • bwa-440c
CAS Number(s)
  • 89217-37-8
InChIKey IVXIHYJYORUTFH-UHFFFAOYSA-N
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