(3S,5S,7S)-N-(5-Sulfamoyl-1,3,4-Thiadiazol-2-Yl)-1-Adamantanecarboxamide

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Properties Simple | Detailed

Formula C13H18N4O3S2
IUPAC Name n-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide
Molecular Mass 342.437 g·mol−1
Heat of Formation -321.3 ± 16.7 kJ·mol−1
Dipole Moment 7.96 ± 1.08 D
Volume 363.29 Å 3
Surface Area 318.91 Å 2
HOMO Energy -9.68 ± 0.55 eV
LUMO Energy -1.82 ± eV
Point Group Symmetry C1
Synonyms
  • n-(5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl)-1-adamantanecarboxamide
  • n-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)-1-adamantanecarboxamide
InChIKey NBKDQESIWDNDOT-LZFPZTGBSA-N
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