Phenylalanyl-3-(2H-Thiopyran-3-Yl)Alanine

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Formula C17H20N2O3S
IUPAC Name (2s)-2-[[(2s)-2-amino-3-phenyl-propanoyl]amino]-3-(2h-thiopyran-3-yl)propanoic acid
Molecular Mass 332.417 g·mol−1
Heat of Formation -385.0 ± 16.7 kJ·mol−1
Dipole Moment 2.37 ± 1.08 D
Volume 405.92 Å 3
Surface Area 320.29 Å 2
HOMO Energy -8.28 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
InChIKey XIWSWUGXOUZCKQ-GJZGRUSLSA-N
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