2-(2-Hydroxy-3-{[1-(5-Hydroxy-1H-Indol-3-Yl)-2-Methyl-2-Propanyl]Amino}Propoxy)Benzonitrile

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Properties Simple | Detailed

Formula C22H25N3O3
IUPAC Name 2-[(2r)-2-hydroxy-3-[[2-(5-hydroxy-2h-indol-1-ium-2-ylium-3-yl)-1,1-dimethyl-ethyl]amino]propoxy]benzonitrile
Molecular Mass 379.452 g·mol−1
Heat of Formation -242.9 ± 16.7 kJ·mol−1
Dipole Moment 4.08 ± 1.08 D
Volume 473.02 Å 3
Surface Area 342.93 Å 2
HOMO Energy -8.35 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
InChIKey RLHZDXDBSDXXNX-GOSISDBHSA-N
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