N-Acetyl-S-(3-Methyl-1,4-Dioxo-1,4-Dihydro-2-Naphthalenyl)-L-Cysteine

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Properties Simple | Detailed

Formula C16H15NO5S
IUPAC Name (2r)-2-acetamido-3-[(3-methyl-1,4-dioxo-2-naphthyl)sulfanyl]propanoic acid
Molecular Mass 333.359 g·mol−1
Heat of Formation -706.9 ± 16.7 kJ·mol−1
Dipole Moment 4.13 ± 1.08 D
Volume 374.07 Å 3
Surface Area 328.06 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 1.22 ± eV
Point Group Symmetry C1
InChIKey CZCOZSQOAXORPX-GFCCVEGCSA-N
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