(2R)-2-Ethyl-5-(3-Sulfonatophenyl)-3H-Isoxazol-3-Ide

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Properties Simple | Detailed

Formula C11H16NO4S+
IUPAC Name (2r)-2-ethyl-5-(3-sulfonatophenyl)-3h-isoxazol-3-ide
Molecular Mass 258.314 g·mol−1
Heat of Formation -131.0 ± 16.7 kJ·mol−1
Dipole Moment 24.54 ± 1.08 D
Volume 275.89 Å 3
Surface Area 261.41 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -3.39 ± eV
Point Group Symmetry C1
InChIKey SNBBOOIESYDRBQ-UHFFFAOYSA-N
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