(1R)-1-Cyclohexyl-1-Phenyl-4-(1-Piperidinyl)-2-Butyn-1-Ol

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Properties Simple | Detailed

Formula C21H29NO
IUPAC Name (1r)-1-cyclohexyl-1-phenyl-4-(1-piperidyl)but-2-yn-1-ol
Molecular Mass 311.461 g·mol−1
Heat of Formation 14.2 ± 16.7 kJ·mol−1
Dipole Moment 3.14 ± 1.08 D
Volume 414.42 Å 3
Surface Area 353.25 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 0.24 ± eV
Point Group Symmetry C1
Synonyms
  • pdsp1_000960
  • pdsp2_000945
InChIKey IXXCPZGOFVCPCH-NRFANRHFSA-N
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