4',5'-Dibromo-3',6'-Dihydroxy-2',7'-Dinitro-Spiro[Isobenzofuran-3,9'-Xanthene]-1-One

Molecule SVG Image

Properties Simple | Detailed

Formula C20H8Br2N2O9
IUPAC Name 4',5'-dibromo-3',6'-dihydroxy-2',7'-dinitro-spiro[isobenzofuran-3,9'-xanthene]-1-one
Molecular Mass 580.093 g·mol−1
Heat of Formation -472.9 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 475.78 Å 3
Surface Area 398.22 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 0.90 ± eV
Point Group Symmetry C1
InChIKey YOLAKSFSRIKURH-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O Br N