[(3Ar,5As,8As,8Bs)-7,7-Dimethyl-2,2-Dioxidotetrahydro-5Ah-[1,3,2]Dioxathiolo[4,5-D][1,3]Dioxolo[4,5-B]Pyran-5A-Yl]Methyl Sulfamate

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Properties Simple | Detailed

Formula C9H15NO10S2
IUPAC Name [(1s,2s,6r,9s)-11,11-dimethyl-4,4-dioxo-3,5,8,10,12-pentaoxa-4λ6-thiatricyclo[7.3.0.02,6]dodecan-9-yl]methyl sulfamate
Molecular Mass 361.346 g·mol−1
Heat of Formation -1725.4 ± 16.7 kJ·mol−1
Dipole Moment 6.28 ± 1.08 D
Volume 345.26 Å 3
Surface Area 285.96 Å 2
HOMO Energy -10.63 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • sms
  • sulfamic acid 2,3-o-(1-methylethylidene)-4,5-o-sulfonyl-beta-fructopyranose ester
InChIKey GGOAQSGCBDRTHT-JAKMQLQISA-N
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