[(3S)-3-Hydroxy-2,2-Dimethyl-4-Oxo-4-[[3-Oxo-3-(2-Tetradecanoylsulfanylethylamino)Propyl]Amino]Butoxy]-Oxido-Oxo-Phosphonium

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Properties Simple | Detailed

Formula C25H49N2O7PS
IUPAC Name [(3s)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-tetradecanoylsulfanylethylamino)propyl]amino]butoxy]-oxido-oxo-phosphonium
Molecular Mass 552.705 g·mol−1
Heat of Formation -1806.5 ± 16.7 kJ·mol−1
Dipole Moment 5.59 ± 1.08 D
Volume 701.58 Å 3
Surface Area 629.2 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
InChIKey CPBOIOQDLLCRLI-HSZRJFAPSA-N
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