3-Nitrilo-L-Alanine

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Properties Simple | Detailed

Formula C3H4N2O2
IUPAC Name (2s)-2-amino-2-cyano-acetic acid
Molecular Mass 100.076 g·mol−1
Heat of Formation -222.6 ± 16.7 kJ·mol−1
Dipole Moment 1.85 ± 1.08 D
Volume 116.1 Å 3
Surface Area 129.7 Å 2
HOMO Energy -10.78 ± 0.55 eV
LUMO Energy -0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-2-cyano-acetic acid
  • (2s)-2-amino-2-cyano-ethanoic acid
  • (2s)-2-amino-2-cyanoacetic acid
  • acetic acid, aminocyano-
  • alpha-cyanoglycine
InChIKey RQMFZXWHCJWDQQ-REOHCLBHSA-N
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