Formula |
C23H19FN2O7S |
IUPAC Name |
(2r)-2-[[6-[(4-cyano-2-fluoro-phenyl)methoxy]-2-naphthyl]sulfonylamino]pentanedioic acid |
Molecular Mass |
486.470 g·mol−1 |
Heat of Formation |
-1080.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.04 ± 1.08 D |
Volume |
521.67 Å 3 |
Surface Area |
458.03 Å 2 |
HOMO Energy |
-9.43 ± 0.55 eV |
LUMO Energy |
-1.45 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IRJUSGUHNFMVCK-OAQYLSRUSA-N |
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Elements |
C
F
H
O
N
S
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