2-C-[3-(4-Methoxyspiro[1,2-Dioxetane-3,2'-Tricyclo[3.3.1.1~3,7~]Decan]-4-Yl)Phenyl]-D-Galactopyranose

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Properties Simple | Detailed

Formula C24H32O9
IUPAC Name (2r,3r,4s,5r,6r)-6-(hydroxymethyl)-3-[3-[(3's)-3'-methoxyspiro[adamantane-2,4'-dioxetane]-3'-yl]phenyl]tetrahydropyran-2,3,4,5-tetrol
Molecular Mass 464.505 g·mol−1
Heat of Formation -1309.0 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 519.49 Å 3
Surface Area 368.06 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
InChIKey ZIOCTOWDUYBVCA-VQLZMOSMSA-N
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Elements H C O