1-Azabicyclo[2.2.2]Oct-3-Yl 2,2-Diphenylpropanoate

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Properties Simple | Detailed

Formula C22H25NO2
IUPAC Name [(3s)-quinuclidin-3-yl] 2,2-diphenylpropanoate
Molecular Mass 335.439 g·mol−1
Heat of Formation -187.9 ± 16.7 kJ·mol−1
Dipole Moment 2.20 ± 1.08 D
Volume 420.95 Å 3
Surface Area 345.97 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -0.17 ± eV
Point Group Symmetry C1
InChIKey WOPPGGGGQFNBFL-HXUWFJFHSA-N
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