4-[1-Decyl-6-(Sulfamoyloxy)-1H-Indol-2-Yl]Phenyl Sulfamate

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Properties Simple | Detailed

Formula C24H33N3O6S2
IUPAC Name [4-(1-decyl-6-sulfamoyloxy-indol-1-ium-2-ylium-2-yl)phenyl] sulfamate
Molecular Mass 523.665 g·mol−1
Heat of Formation -925.7 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 615.37 Å 3
Surface Area 533.58 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
Synonyms
  • [1-decyl-2-(4-sulfamoyloxyphenyl)indol-6-yl] sulfamate
  • sie
  • sulfamic acid [1-decyl-2-(4-sulfamoyloxyphenyl)-6-indolyl] ester
  • sulfamic acid [1-decyl-2-(4-sulfamoyloxyphenyl)indol-6-yl] ester
InChIKey MXTDPQJZUVFANV-UHFFFAOYSA-N
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