2-(4-Oxido-4-{3-[2-(Trifluoromethyl)-10H-Phenothiazin-10-Yl]Propyl}-1-Piperazinyl)Ethanol

Molecule SVG Image

Properties Simple | Detailed

Formula C22H26F3N3O2S
IUPAC Name 2-[4-oxido-4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-4-ium-1-yl]ethanol
Molecular Mass 453.521 g·mol−1
Heat of Formation -604.2 ± 16.7 kJ·mol−1
Dipole Moment 1.34 ± 1.08 D
Volume 514.18 Å 3
Surface Area 427.73 Å 2
HOMO Energy -8.04 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-oxido-4-[3-[2-(trifluoromethyl)-10-phenothiazinyl]propyl]-1-piperazin-4-iumyl]ethanol
InChIKey PBNZPYCNNDPELA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S