(1Z,3S)-3-{[(Benzyloxy)Carbonyl]Amino}-1-Diazonio-4-Phenyl-1-Buten-2-Olate

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Properties Simple | Detailed

Formula C18H21N3O3
IUPAC Name [(3s)-3-(benzyloxycarbonylamino)-2-oxo-4-phenyl-butyl]-λ1-azanyl-azanide
Molecular Mass 327.378 g·mol−1
Heat of Formation -99.3 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 392.2 Å 3
Surface Area 353.6 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
InChIKey SVQYKTNGIRZHCC-BQGMYUGNSA-N
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