(1S)-2-Benzoyl-1-Benzyl-1-[(2S)-2-Hydroxy-3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-4-Phenylbutyl]-1-Methylhydrazinium

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Properties Simple | Detailed

Formula C30H38N3O4+
IUPAC Name benzoyl-[(s)-benzyl-[(2s,3r)-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-methyl-ammonio]azanide
Molecular Mass 504.640 g·mol−1
Heat of Formation -465.4 ± 16.7 kJ·mol−1
Dipole Moment 3.34 ± 1.08 D
Volume 636.9 Å 3
Surface Area 461.08 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.22 ± eV
Point Group Symmetry C1
InChIKey KTCIZECZUWZDHY-LIUDWSNTSA-O
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