Topixantrone

Molecule SVG Image

Properties Simple | Detailed

Formula C21H26N6O2
IUPAC Name topixantrone
Molecular Mass 394.470 g·mol−1
Heat of Formation 108.7 ± 16.7 kJ·mol−1
Dipole Moment 7.22 ± 1.08 D
Volume 475.74 Å 3
Surface Area 430.28 Å 2
HOMO Energy -8.14 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
Synonyms
  • bbr 3576
  • d06190
  • indazolo(4,3-gh)isoquinolin-6(2h)-one, 5-((2-(dimethylamino)ethyl)amino)-2-(2-((2-hydroxyethyl)amino)ethyl)-
  • topixantrone (usan)
CAS Number(s)
  • 156090-18-5
InChIKey ZHAKYGFJVGCOAE-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N