7-Azatryptophan

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Properties Simple | Detailed

Formula C10H12N3O2
IUPAC Name (2s)-2-amino-3-(1h-pyrrolo[2,3-b]pyridin-7-ium-3a-id-3-yl)propanoic acid
Molecular Mass 206.221 g·mol−1
Heat of Formation -186.6 ± 16.7 kJ·mol−1
Dipole Moment 2.45 ± 1.08 D
Volume 240.99 Å 3
Surface Area 224.78 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-(1h-pyrrolo[5,4-b]pyridin-3-yl)propanoic acid
  • (2s)-2-amino-3-(1h-pyrrolo[5,4-b]pyridin-3-yl)propionic acid
InChIKey SNLOIIPRZGMRAB-QMMMGPOBSA-N
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