(3Ar,13Ar)-6,7,10,11,12-Pentamethoxy-3A,4,13,13A-Tetrahydrodibenzo[4,5:6,7]Cycloocta[1,2-C]Furan-1(3H)-One

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Formula C23H26O7
IUPAC Name (3ar,13ar)-6,7,10,11,12-pentamethoxy-3a,4,13,13a-tetrahydrodibenzo[4,5:6,7]cycloocta[1,2-c]furan-1(3h)-one
Molecular Mass 414.448 g·mol−1
Heat of Formation -947.6 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 481.63 Å 3
Surface Area 400.47 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
Synonyms
  • neoisostegane
CAS Number(s)
  • 87084-98-8
InChIKey UAFHDDGMOVOBAW-DZGCQCFKSA-N
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Elements H C O