(2R)-2-[4'-({Dimethyl[2-(Phosphonooxy)Ethyl]Ammonio}Acetyl)-4-Biphenylyl]-2-Hydroxy-4,4-Dimethylmorpholin-4-Ium

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Properties Simple | Detailed

Formula C24H35N2O7P++
IUPAC Name [2-[4-[4-[(2s)-2-hydroxy-4,4-dimethyl-morpholin-4-ium-2-yl]phenyl]phenyl]-2-oxo-ethyl]-dimethyl-(2-phosphonooxyethyl)ammonium
Molecular Mass 494.518 g·mol−1
Heat of Formation -984.9 ± 16.7 kJ·mol−1
Dipole Moment 13.98 ± 1.08 D
Volume 578.62 Å 3
Surface Area 490.78 Å 2
HOMO Energy -4.10 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
InChIKey MERLSFHNUMSODQ-XMMPIXPASA-P
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