Tandospirone

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Formula C21H29N5O2
IUPAC Name (1s,2r,6s,7r)-4-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
Molecular Mass 383.487 g·mol−1
Heat of Formation -191.9 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 470.74 Å 3
Surface Area 406.9 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 87760-53-0
InChIKey CEIJFEGBUDEYSX-FZDBZEDMSA-N
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