3-(4-Methoxyphenyl)-2-Propyn-1-Yl α-D-Mannopyranoside

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Properties Simple | Detailed

Formula C16H20O7
IUPAC Name (2r,3s,4s,5s,6s)-2-(hydroxymethyl)-6-[3-(4-methoxyphenyl)prop-2-ynoxy]tetrahydropyran-3,4,5-triol
Molecular Mass 324.326 g·mol−1
Heat of Formation -952.7 ± 16.7 kJ·mol−1
Dipole Moment 0.70 ± 1.08 D
Volume 375.13 Å 3
Surface Area 342.81 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
InChIKey UYJNIDIDTZJFNU-OWYFMNJBSA-N
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Elements H C O