(1E)-1-{[1,3-Dihydroxy-2-(Hydroxymethyl)-2-Propanyl]Imino}-8,9-Dihydroxy-4-Methoxy-2,3,6A,8,9,9A-Hexahydrocyclopenta[C]Furo[3',2':4,5]Furo[2,3-H]Chromen-11(1H)-One

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Properties Simple | Detailed

Formula C21H61NO10
IUPAC Name 4-ethyl-5-methoxy-benzene-6-ide-1,3-diolate; hydron; λ1-carbane; λ2-carbane; 2-methanidyl-2-(methyleneamino)propan-1-one; oxygen; pentahydroxide
Molecular Mass 489.726 g·mol−1
Heat of Formation -705.6 ± 16.7 kJ·mol−1
Dipole Moment 10.93 ± 1.08 D
Volume 505.08 Å 3
Surface Area 419.76 Å 2
HOMO Energy -7.05 ± 0.55 eV
LUMO Energy -1.26 ± eV
Point Group Symmetry C1
InChIKey FDHBXCJFVVNQKW-LVIQQYCWSA-N
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