(2R)-2-Acetamido-3-[(2S)-2-{[2-(1H-Indol-3-Yl)Ethyl]Carbamoyl}-1-Pyrrolidinyl]Propyl Dihydrogen Phosphate

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Formula C20H29N4O6P
IUPAC Name [(2r)-2-acetamido-3-[(1s,2s)-2-[2-(2h-indol-1-ium-2-ylium-3-yl)ethylcarbamoyl]pyrrolidin-1-yl]propyl] dihydrogen phosphate
Molecular Mass 452.441 g·mol−1
Heat of Formation -1273.6 ± 16.7 kJ·mol−1
Dipole Moment 9.19 ± 1.08 D
Volume 530.8 Å 3
Surface Area 452.61 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
InChIKey FDBFLFSQEGXOJR-APWZRJJASA-N
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