(3S,4R,5R,6S)-1-(2-Hydroxyethyl)-3,4,5,6-Azepanetetrol

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Formula C8H17NO5
IUPAC Name (3s,4r,5r,6s)-1-(2-hydroxyethyl)azepane-3,4,5,6-tetrol
Molecular Mass 207.224 g·mol−1
Heat of Formation -957.2 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 243.0 Å 3
Surface Area 218.01 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 1.31 ± eV
Point Group Symmetry C1
Synonyms
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InChIKey VWGJHYNWDXVPIU-RULNZFCNSA-N
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