(5Ar,9Ar)-N-[(3S)-1-Azabicyclo[2.2.2]Oct-3-Yl]-2-Chloro-5A,6,7,8,9,9A-Hexahydrodibenzo[B,D]Furan-4-Carboxamide

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Properties Simple | Detailed

Formula C20H25ClN2O2
IUPAC Name (5ar,9ar)-2-chloro-n-[(3s)-quinuclidin-3-yl]-5a,6,7,8,9,9a-hexahydrodibenzofuran-4-carboxamide
Molecular Mass 360.878 g·mol−1
Heat of Formation -338.2 ± 16.7 kJ·mol−1
Dipole Moment 6.16 ± 1.08 D
Volume 423.04 Å 3
Surface Area 354.14 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
InChIKey LDYMIBZOCSHLBG-ZTFGCOKTSA-N
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Elements H C N O Cl