Formula |
C16H19FN2O7S |
IUPAC Name |
(2s)-2-[[(1r)-1-carboxy-2-[(4-fluorophenyl)methylsulfanyl]ethyl]carbamoylamino]pentanedioic acid |
Molecular Mass |
402.395 g·mol−1 |
Heat of Formation |
-1454.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.41 ± 1.08 D |
Volume |
447.57 Å 3 |
Surface Area |
404.31 Å 2 |
HOMO Energy |
-9.02 ± 0.55 eV |
LUMO Energy |
-0.53 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IDTMSHGCAZPVLC-RYUDHWBXSA-N |
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Links |
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Elements |
C
F
H
O
N
S
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