(1S)-1-Methoxy-4-Methyl-3-Nitro-1-Oxo-2H-1Λ5-Phosphol-5-Imine Oxide

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Properties Simple | Detailed

Formula C6H11N2O5P+
IUPAC Name (1s)-1-methoxy-4-methyl-3-nitro-1-oxo-2h-1λ5-phosphol-5-imine oxide
Molecular Mass 222.136 g·mol−1
Heat of Formation -445.4 ± 16.7 kJ·mol−1
Dipole Moment 5.02 ± 1.08 D
Volume 227.0 Å 3
Surface Area 214.26 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy -1.98 ± eV
Point Group Symmetry C1
InChIKey XLABOOHCGFJTPP-AFNCTOJWSA-N
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