Formula |
C16H19FN2O7S |
IUPAC Name |
(2s)-2-[[(1r)-1-carboxy-2-[(4-(18f)fluoranylphenyl)methylsulfanyl]ethyl]carbamoylamino]pentanedioic acid |
Molecular Mass |
401.397 g·mol−1 |
Heat of Formation |
-1455.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.00 ± 1.08 D |
Volume |
447.43 Å 3 |
Surface Area |
401.97 Å 2 |
HOMO Energy |
-9.02 ± 0.55 eV |
LUMO Energy |
2.46 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IDTMSHGCAZPVLC-STUNTBJNSA-N |
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Elements |
C
F
H
O
N
S
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