(2S)-1-(9H-Carbazol-4-Yloxy)-3-{[(3E)-4-Iodo-2-Methyl-3-Buten-2-Yl]Amino}-2-Propanol

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Properties Simple | Detailed

Formula C20H23IN2O2
IUPAC Name (2s)-1-carbazol-9-ium-4-yloxy-3-[[(e)-3-iodo-1,1-dimethyl-allyl]amino]propan-2-ol
Molecular Mass 450.313 g·mol−1
Heat of Formation -60.9 ± 16.7 kJ·mol−1
Dipole Moment 1.60 ± 1.08 D
Volume 459.55 Å 3
Surface Area 366.72 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1-(9h-carbazol-4-yloxy)-3-[[(e)-3-iodo-1,1-dimethyl-prop-2-enyl]amino]propan-2-ol
  • (2s)-1-(9h-carbazol-4-yloxy)-3-[[(e)-3-iodo-1,1-dimethylprop-2-enyl]amino]propan-2-ol
  • (2s)-1-(9h-carbazol-4-yloxy)-3-[[(e)-4-iodo-2-methyl-but-3-en-2-yl]amino]propan-2-ol
  • (2s)-1-(9h-carbazol-4-yloxy)-3-[[(e)-4-iodo-2-methylbut-3-en-2-yl]amino]propan-2-ol
InChIKey QIMLZCVAUNUVMI-VNDWYCCKSA-N
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