(9S)-6'-Methoxycinchonan-3,9-Diol

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Properties Simple | Detailed

Formula C20H24N2O3
IUPAC Name (1s,3s,4s,6s)-6-[(s)-hydroxy-(6-methoxy-4-quinolyl)methyl]-3-vinyl-quinuclidin-3-ol
Molecular Mass 340.416 g·mol−1
Heat of Formation -267.5 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 413.03 Å 3
Surface Area 339.15 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
InChIKey BSRUJCFCZKMFMB-XCXWGBRNSA-N
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