2-Nitrobenzo[De]Chromene

Molecule SVG Image

Properties Simple | Detailed

Formula C12H7NO3
IUPAC Name 3-nitro-2-oxatricyclo[7.3.1.05,13]trideca-1(12),3,5,7,9(13),10-hexaene
Molecular Mass 213.189 g·mol−1
Heat of Formation 89.2 ± 16.7 kJ·mol−1
Dipole Moment 4.92 ± 1.08 D
Volume 228.04 Å 3
Surface Area 218.68 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -1.63 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-nitronaphtho(1,8-bc)pyran
  • naphtho(1,8-bc)pyran, 2-nitro-
  • r 7780
CAS Number(s)
  • 105052-38-8
InChIKey GGXRZUFEHAUOEV-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N