Hydroxy{[4-(Hydroxymethyl)-6-Methyl-5-Oxido-3-Pyridiniumyl]Methoxy}Acetate

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Properties Simple | Detailed

Formula C10H13NO6
IUPAC Name (2r)-2-hydroxy-2-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methoxy]acetic acid
Molecular Mass 243.213 g·mol−1
Heat of Formation -1003.3 ± 16.7 kJ·mol−1
Dipole Moment 3.61 ± 1.08 D
Volume 271.75 Å 3
Surface Area 251.23 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
InChIKey IZMRUZYKDJYBTG-SNVBAGLBSA-N
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