Formula |
C11H8FNO2S |
IUPAC Name |
(z)-3-(5-fluoro-1h-indol-3-yl)-2-sulfanyl-prop-2-enoic acid |
Molecular Mass |
237.250 g·mol−1 |
Heat of Formation |
-334.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.33 ± 1.08 D |
Volume |
258.04 Å 3 |
Surface Area |
241.21 Å 2 |
HOMO Energy |
-8.78 ± 0.55 eV |
LUMO Energy |
-1.00 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (z)-3-(5-fluoro-1h-indol-3-yl)-2-mercapto-acrylic acid
- (z)-3-(5-fluoro-1h-indol-3-yl)-2-mercaptoprop-2-enoic acid
- (z)-3-(5-fluoro-1h-indol-3-yl)-2-sulfanyl-prop-2-enoic acid
- (z)-3-(5-fluoro-1h-indol-3-yl)-2-sulfanylprop-2-enoic acid
- 3-(5-fluoro-1h-indol-3-yl)-2-mercapto-acrylic acid
- 3-(5-fluoro-1h-indol-3-yl)-2-mercaptoprop-2-enoic acid
- 3-(5-fluoro-1h-indol-3-yl)-2-sulfanyl-prop-2-enoic acid
- 3-(5-fluoro-1h-indol-3-yl)-2-sulfanylprop-2-enoic acid
- 3-(5-fluoro-3-indolyl)-2-mercapto-(z)-2-propenoic acid
- pd 151746
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InChIKey |
HWMQHECFXSVZGN-KMKOMSMNSA-N |
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Elements |
C
F
H
O
N
S
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