3-Phenylpropyl (1R,2S)-1-(3-Nitrophenyl)Sulfonylpiperidine-2-Carboxylate

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Properties Simple | Detailed

Formula C21H24N2O6S
IUPAC Name 3-phenylpropyl (1r,2s)-1-(3-nitrophenyl)sulfonylpiperidine-2-carboxylate
Molecular Mass 432.490 g·mol−1
Heat of Formation -568.3 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 490.81 Å 3
Surface Area 424.69 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 1.62 ± eV
Point Group Symmetry C1
InChIKey UEYDPNKVTVTNGG-FQEVSTJZSA-N
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