[1-Acetamido-2-(4-Chlorophenyl)Ethyl](Dihydroxy)(Serinato-Kappao~3~)Borate(1-)

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Properties Simple | Detailed

Formula C13H19BClN2O6-
IUPAC Name [1-(acetylammonio)-2-(4-chlorophenyl)ethyl]-[(2s)-2-amino-2-carboxy-ethoxy]-dihydroxy-boranuide
Molecular Mass 345.564 g·mol−1
Heat of Formation 981.0 ± 16.7 kJ·mol−1
Dipole Moment 1.37 ± 1.08 D
Volume 379.99 Å 3
Surface Area 308.46 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -2.07 ± eV
Point Group Symmetry C1
InChIKey RJXOEUFRQATKAB-NWDGAFQWSA-N
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Elements C Cl B O N