(1R,6S)-7-Oxabicyclo[4.1.0]Hepta-2,4-Diene

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Properties Simple | Detailed

Formula C6H6O
IUPAC Name (1s,6r)-7-oxabicyclo[4.1.0]hepta-2,4-diene
Molecular Mass 94.111 g·mol−1
Heat of Formation 86.8 ± 16.7 kJ·mol−1
Dipole Moment 1.88 ± 1.08 D
Volume 117.35 Å 3
Surface Area 126.62 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry Cs
Synonyms
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InChIKey WDFZWSZNOFELJY-OLQVQODUSA-N
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Elements H C O