N~2~-(1-Cyanoethyl)-L-Glutamine

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Properties Simple | Detailed

Formula C8H13N3O3
IUPAC Name (2s)-5-amino-2-[[(1s)-1-cyanoethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 199.207 g·mol−1
Heat of Formation -498.7 ± 16.7 kJ·mol−1
Dipole Moment 5.86 ± 1.08 D
Volume 245.44 Å 3
Surface Area 232.03 Å 2
HOMO Energy -9.90 ± 0.55 eV
LUMO Energy 0.40 ± eV
Point Group Symmetry C1
InChIKey FAQAZBKSKXWMNA-WDSKDSINSA-N
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