2-[(3-Fluorobenzyl)Amino]Ethanesulfonic Acid

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Formula C9H12FNO3S
IUPAC Name 2-[(3-fluorophenyl)methylamino]ethanesulfonic acid
Molecular Mass 233.260 g·mol−1
Heat of Formation -645.3 ± 16.7 kJ·mol−1
Dipole Moment 2.64 ± 1.08 D
Volume 256.57 Å 3
Surface Area 250.37 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
InChIKey YAVXRLCPJYFRHJ-UHFFFAOYSA-N
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