6-Nitro-2-Chromanone

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Properties Simple | Detailed

Formula C9H7NO4
IUPAC Name 6-nitrochroman-2-one
Molecular Mass 193.156 g·mol−1
Heat of Formation -270.5 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 204.86 Å 3
Surface Area 200.04 Å 2
HOMO Energy -10.23 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
Synonyms
  • 3,4-dihydro-6-nitrocoumarin
CAS Number(s)
  • 20920-99-4
InChIKey GOHGBRHKCJJPJO-UHFFFAOYSA-N
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