(E)-N~5~-({3-Hydroxy-2-Methyl-5-[(Phosphonooxy)Methyl]-4-Pyridinyl}Methylene)-L-Ornithine

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Properties Simple | Detailed

Formula C13H20N3O7P
IUPAC Name (2s)-2-amino-5-[(e)-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methyleneamino]pentanoic acid
Molecular Mass 361.288 g·mol−1
Heat of Formation -1461.6 ± 16.7 kJ·mol−1
Dipole Moment 1.71 ± 1.08 D
Volume 401.37 Å 3
Surface Area 374.71 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
InChIKey RMKYDMCVWSLEGI-DMSFABOWSA-N
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