(2E)-3-[2-(Dihydroxyboryl)-1-Benzothiophen-3-Yl]Acrylic Acid

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Properties Simple | Detailed

Formula C11H9BO4S
IUPAC Name (e)-3-(2-boronobenzothiophen-3-yl)prop-2-enoic acid
Molecular Mass 248.063 g·mol−1
Heat of Formation -805.8 ± 16.7 kJ·mol−1
Dipole Moment 2.54 ± 1.08 D
Volume 274.6 Å 3
Surface Area 254.78 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 1.82 ± eV
Point Group Symmetry C1
InChIKey IYRVQPJBSDCZBO-AATRIKPKSA-N
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Elements H C B S O