4-(Dimethylamino)-1-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Sulfamoyl)Pyridinium

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Properties Simple | Detailed

Formula C12H21N3O4S
IUPAC Name tert-butoxycarbonyl-[[4-(dimethylamino)-2h-pyridin-2-id-1-yl]sulfonyl]azanide
Molecular Mass 303.378 g·mol−1
Heat of Formation -616.1 ± 16.7 kJ·mol−1
Dipole Moment 10.45 ± 1.08 D
Volume 344.99 Å 3
Surface Area 306.56 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
Synonyms
  • n-(4-dimethylaminopyridin-1-ium-1-yl)sulfonylcarbamic acid tert-butyl ester
  • n-[(4-dimethylamino-1-pyridin-1-iumyl)sulfonyl]carbamic acid tert-butyl ester
  • tert-butyl n-(4-dimethylaminopyridin-1-ium-1-yl)sulfonylcarbamate
InChIKey KEQQONPVAQQBHG-UHFFFAOYSA-O
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