3-{5-Methyl-2-[(5-Methyl-3-Oxo-2,3-Dihydro-1,2-Oxazol-4-Yl)Methyl]-3-Oxo-2,3-Dihydro-1,2-Oxazol-4-Yl}Alanine

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Properties Simple | Detailed

Formula C12H15N3O6
IUPAC Name (2s)-2-amino-3-[5-methyl-2-[(5-methyl-3-oxo-isoxazol-4-yl)methyl]-3-oxo-isoxazol-4-yl]propanoic acid
Molecular Mass 297.264 g·mol−1
Heat of Formation -721.6 ± 16.7 kJ·mol−1
Dipole Moment 3.02 ± 1.08 D
Volume 329.47 Å 3
Surface Area 262.0 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
InChIKey JVQZIHGOCREKGE-VIFPVBQESA-N
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