(3-(Chloromethylene)-2,3-Dihydro-1-Benzoxepin-7-Yl)Methanol

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Properties Simple | Detailed

Formula C12H11ClO2
IUPAC Name [(3z)-3-(chloromethylene)-1-benzoxepin-7-yl]methanol
Molecular Mass 222.668 g·mol−1
Heat of Formation -166.2 ± 16.7 kJ·mol−1
Dipole Moment 1.51 ± 1.08 D
Volume 251.05 Å 3
Surface Area 236.4 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.25 ± eV
Point Group Symmetry C1
Synonyms
  • [(3z)-3-(chloromethylene)-1-benzoxepin-7-yl]methanol
  • [(3z)-3-(chloromethylidene)-1-benzoxepin-7-yl]methanol
InChIKey VKTZUNYCRLMMMT-POHAHGRESA-N
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Elements H C O Cl