N-(3-Nitrobenzoyl)-L-Alanine

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Properties Simple | Detailed

Formula C10H10N2O5
IUPAC Name (2s)-2-[(3-nitrobenzoyl)amino]propanoic acid
Molecular Mass 238.197 g·mol−1
Heat of Formation 1188.4 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 253.71 Å 3
Surface Area 245.53 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -3.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[(3-nitrobenzoyl)amino]propanoic acid
  • (2s)-2-[(3-nitrobenzoyl)amino]propionic acid
  • (2s)-2-[(3-nitrophenyl)carbonylamino]propanoic acid
  • (2s)-2-[[(3-nitrophenyl)-oxomethyl]amino]propanoic acid
  • t5267655
InChIKey CDBXKLYOJGRINM-LURJTMIESA-N
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