Iso-Mallotochromanol

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Properties Simple | Detailed

Formula C24H28O9
IUPAC Name 5-[(3,4-dioxofuro[3,4-g]benzofuran-5-ylidene)methylene]-7-(2-hydroxyethynyl)-3ah-benzofuran-3,4,6-trione; prop-1-yne
Molecular Mass 460.474 g·mol−1
Heat of Formation 1303.2 ± 16.7 kJ·mol−1
Dipole Moment 4.43 ± 1.08 D
Volume 474.96 Å 3
Surface Area 407.87 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy -1.12 ± eV
Point Group Symmetry C1
InChIKey XBXKUYYCBXJGEN-HNNXBMFYSA-N
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