(7S)-7-[(4-Azido-2-Nitrophenyl)Amino]-1,2,3,10-Tetramethoxy-6,7-Dihydrobenzo[A]Heptalen-9(5H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C26H28N5O7
IUPAC Name (7s)-7-[(4-azido-2-nitrophenyl)amino]-1,2,3,10-tetramethoxy-6,7-dihydro-5h-benzo[g]heptalen-9-one
Molecular Mass 522.530 g·mol−1
Heat of Formation -118.2 ± 16.7 kJ·mol−1
Dipole Moment 8.78 ± 1.08 D
Volume 587.68 Å 3
Surface Area 477.88 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.23 ± eV
Point Group Symmetry C1
Synonyms
  • (2-nitro-4-azidophenyl)deacetylcolchicine
  • (7s)-7-[(4-azido-2-nitro-phenyl)amino]-1,2,3,10-tetramethoxy-6,7-dihydro-5h-benzo[g]heptalen-9-one
  • nap-dac
CAS Number(s)
  • 111348-67-5
InChIKey YCPQIXRBKDPYIA-SFHVURJKSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N