Taurolidine

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Properties Simple | Detailed

Formula C7H16N4O4S2
IUPAC Name (4s)-4-[[(4s)-1,1-dioxo-1,2,4-thiadiazinan-4-yl]methyl]-1,2,4-thiadiazinane 1,1-dioxide
Molecular Mass 284.356 g·mol−1
Heat of Formation -574.9 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 300.87 Å 3
Surface Area 261.97 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C2
Synonyms
  • 2h-1,2,4-thiadiazine, 4,4'-methylenebis[tetrahydro-, 1,1,1',1'-tetraoxide
  • 4,4'-methylenebis(tetrahydro-1,2,4-thiadiazine 1,1-dioxide)
  • 4-[(1,1-diketo-1,2,4-thiadiazinan-4-yl)methyl]-1,2,4-thiadiazinane 1,1-dioxide
  • 4-[(1,1-dioxo-1,2,4-thiadiazinan-4-yl)methyl]-1,2,4-thiadiazinane 1,1-dioxide
CAS Number(s)
  • 19388-87-5
InChIKey AJKIRUJIDFJUKJ-UHFFFAOYSA-N
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