(2S)-6-({[2-(Benzylcarbamoyl)Benzyl]Amino}Methyl)-2-(2-Carboxyethyl)-2,3-Dihydro-1,4-Benzodioxine-5-Carboxylic Acid

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Formula C28H28N2O7
IUPAC Name (2s)-6-[[[2-(benzylcarbamoyl)phenyl]methylamino]methyl]-2-(2-carboxyethyl)-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid
Molecular Mass 504.531 g·mol−1
Heat of Formation -975.1 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 597.04 Å 3
Surface Area 503.26 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 2.67 ± eV
Point Group Symmetry C1
InChIKey XIYPVINZCFCPIP-NRFANRHFSA-N
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