[2.1.1]Cryptand

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Properties Simple | Detailed

Formula C14H28N2O4
IUPAC Name 4,7,13,18-tetraoxa-1,10-diazabicyclo[8.5.5]icosane
Molecular Mass 288.383 g·mol−1
Heat of Formation -605.7 ± 16.7 kJ·mol−1
Dipole Moment 1.94 ± 1.08 D
Volume 360.3 Å 3
Surface Area 279.35 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 2.32 ± eV
Point Group Symmetry C1
Synonyms
  • 4,7,13,18-tetraoxa-1,10-diazabicyclo(8.5.5)icosane
  • 4,7,13,18-tetraoxa-1,10-diazabicyclo[8.5.5]eicosane
  • cryptating agent 211
  • kryptofix 211
CAS Number(s)
  • 31250-06-3
InChIKey LVNQVIZBPSRXAN-UHFFFAOYSA-N
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