(1Z)-3-({N-[(Benzyloxy)Carbonyl]Tyrosyl}Amino)-2-Hydroxy-1-Butene-1-Diazonium

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Formula C21H23N4O5
IUPAC Name (z,3s)-3-[[(2s)-2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-1-diazonio-but-1-en-2-olate
Molecular Mass 411.431 g·mol−1
Heat of Formation -511.9 ± 16.7 kJ·mol−1
Dipole Moment 1.59 ± 1.08 D
Volume 491.28 Å 3
Surface Area 411.68 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
InChIKey AUCPIJGDYBXJGH-FJLNVPPCSA-N
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