(2R)-6-Bromo-9-(2-{[(1R)-1-Carboxy-2-Phenylethyl]Amino}-2-Oxoethyl)-2,3,4,9-Tetrahydro-1H-Carbazole-2-Carboxylic Acid

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Formula C24H23BrN2O5
IUPAC Name (2r)-6-bromo-9-[2-[[(1s)-1-carboxy-2-phenyl-ethyl]amino]-2-oxo-ethyl]-1,2,3,4-tetrahydrocarbazol-9-ium-2-carboxylic acid
Molecular Mass 499.354 g·mol−1
Heat of Formation -746.8 ± 16.7 kJ·mol−1
Dipole Moment 0.70 ± 1.08 D
Volume 534.6 Å 3
Surface Area 391.59 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 2.45 ± eV
Point Group Symmetry C1
InChIKey VVKCJZLVMZAHBK-BEFAXECRSA-N
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Elements H C Br O N