(R)-[3,6-Bis(Trifluoromethyl)-9-Phenanthryl][(2S)-2-Piperidinyl]Methanol

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Properties Simple | Detailed

Formula C22H19F6NO
IUPAC Name (r)-[3,6-bis(trifluoromethyl)-9-phenanthryl]-[(2s)-2-piperidyl]methanol
Molecular Mass 427.383 g·mol−1
Heat of Formation -1356.8 ± 16.7 kJ·mol−1
Dipole Moment 5.67 ± 1.08 D
Volume 451.1 Å 3
Surface Area 390.39 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -1.68 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-erythro-[3,6-bis(trifluoromethyl)-phenanthren-9-yl]-piperidin-2-yl-methanol
  • (+/-)-erythro-[3,6-bis(trifluoromethyl)-phenanthren-9-yl]-piperidin-2-yl-methanol
  • (r)-[3,6-bis(trifluoromethyl)-9-phenanthryl]-[(2s)-2-piperidinyl]methanol
  • (r)-[3,6-bis(trifluoromethyl)-9-phenanthryl]-[(2s)-2-piperidyl]methanol
  • (r)-[3,6-bis(trifluoromethyl)phenanthren-9-yl]-[(2s)-piperidin-2-yl]methanol
  • rti1163-1-1
  • rti1165-2-1
InChIKey FVVWTCZWVDUHPH-VQTJNVASSA-N
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