6-Nitrosocoumarin

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Properties Simple | Detailed

Formula C9H5NO3
IUPAC Name 6-nitrosochromen-2-one
Molecular Mass 175.141 g·mol−1
Heat of Formation -78.5 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 189.44 Å 3
Surface Area 188.25 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 1.44 ± eV
Point Group Symmetry Cs
Synonyms
  • 2h-1-benzopyran-2-one, 6-nitroso-
  • 6-nitroso-1,2-benzopyrone
  • 6-nitroso-2-chromenone
  • 6-no2bp
  • nobp
CAS Number(s)
  • 130506-22-8
InChIKey HXTDAUGEZTYMGP-UHFFFAOYSA-N
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