3-Quinuclidinyl P-Azidobenzilate

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Properties Simple | Detailed

Formula C21H22N4O3
IUPAC Name [(3r)-quinuclidin-3-yl] (2s)-2-(4-azidophenyl)-2-hydroxy-2-phenyl-acetate
Molecular Mass 378.424 g·mol−1
Heat of Formation 3683.3 ± 16.7 kJ·mol−1
Dipole Moment 3.25 ± 1.08 D
Volume 430.5 Å 3
Surface Area 366.09 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -2.48 ± eV
Point Group Symmetry C1
InChIKey CVSURLUCVFEDOO-FPOVZHCZSA-N
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