Methyl (2S)-2-[[(2S)-2,5-Diaminopentanoyl]Amino]-3-[1-(2-Nitrophenyl)Sulfanyl-7H-Indol-1-Ium-7-Id-3-Yl]Propanoate

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Formula C23H27N5O5S
IUPAC Name methyl (2s)-2-[[(2s)-2,5-diaminopentanoyl]amino]-3-[1-(2-nitrophenyl)sulfanyl-7h-indol-1-ium-7-id-3-yl]propanoate
Molecular Mass 485.556 g·mol−1
Heat of Formation -300.8 ± 16.7 kJ·mol−1
Dipole Moment 2.41 ± 1.08 D
Volume 573.94 Å 3
Surface Area 427.84 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -1.52 ± eV
Point Group Symmetry C1
InChIKey AEQKXLOXFUQBRY-ROUUACIJSA-N
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