(5Z)-13-Chloro-14,16-Dihydroxy-1,11-Dioxo-3,4,7,8,9,10,11,12-Octahydro-1H-2-Benzoxacyclotetradecine-6-Carbaldehyde

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Properties Simple | Detailed

Formula C18H19ClO6
IUPAC Name (8z)-18-chloro-15,17-dihydroxy-3,13-dioxo-12-oxabicyclo[12.4.0]octadeca-1(18),8,14,16-tetraene-8-carbaldehyde
Molecular Mass 366.793 g·mol−1
Heat of Formation -1015.9 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 405.2 Å 3
Surface Area 324.06 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 2.21 ± eV
Point Group Symmetry C1
InChIKey XRPZFFJMSSNWNE-WZUFQYTHSA-N
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Elements H C O Cl