(2S)-2-[[(4-Bromophenyl)-Hydroxy-Phosphoryl]Methyl]-3-(3-Phenylisoxazol-5-Yl)Propanoic Acid

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Formula C19H17BrNO5P
IUPAC Name (2s)-2-[[(4-bromophenyl)-hydroxy-phosphoryl]methyl]-3-(3-phenylisoxazol-5-yl)propanoic acid
Molecular Mass 450.220 g·mol−1
Heat of Formation -631.7 ± 16.7 kJ·mol−1
Dipole Moment 2.50 ± 1.08 D
Volume 457.22 Å 3
Surface Area 402.12 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
InChIKey YMPWYPMPNHEEBQ-CQSZACIVSA-N
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Elements C H O N P Br