2-Nitro-6H-Benzo[C]Chromen-6-One

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Properties Simple | Detailed

Formula C13H7NO4
IUPAC Name 2-nitrobenzo[c]chromen-6-one
Molecular Mass 241.199 g·mol−1
Heat of Formation -127.7 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 252.63 Å 3
Surface Area 238.1 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 1.38 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-biphenylcarboxylic acid, 2'-hydroxy-5'-nitro-, delta-lactone
  • 2-nitro-6-benzo[c]isochromenone
  • 2-nitro-6h-dibenzo(b,d)pyran-6-one
  • 2-nitro-6h-dibenzo[b,d]pyran-6-one
  • 6h-dibenzo(b,d)pyran-6-one, 2-nitro-
CAS Number(s)
  • 6623-66-1
InChIKey NSXRBWUONVTXSK-UHFFFAOYSA-N
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