Desmethylenylnocardamine

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Properties Simple | Detailed

Formula C26H46N6O9
IUPAC Name 1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone
Molecular Mass 586.678 g·mol−1
Heat of Formation -1603.5 ± 16.7 kJ·mol−1
Dipole Moment 9.01 ± 1.08 D
Volume 738.69 Å 3
Surface Area 482.9 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy 0.31 ± eV
Point Group Symmetry C1
Synonyms
  • 1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-triquinone
  • acon0_001492
  • acon1_001337
  • megxm0_000271
InChIKey SXTGVXKFOVZYIK-UHFFFAOYSA-N
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