Formula |
C26H28FNO5 |
IUPAC Name |
(2s)-2-tert-butoxy-2-[4-(8-fluoro-5-methyl-chroman-6-yl)-2-methyl-1-oxo-3-isoquinolyl]acetic acid |
Molecular Mass |
453.503 g·mol−1 |
Heat of Formation |
-1011.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.99 ± 1.08 D |
Volume |
527.75 Å 3 |
Surface Area |
407.02 Å 2 |
HOMO Energy |
-8.48 ± 0.55 eV |
LUMO Energy |
2.45 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LDALHHGVIZRJPA-QHCPKHFHSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
N
O
F
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