Diethyl (2-Methyl-1-Oxido-3,4-Dihydro-2H-Pyrrol-2-Yl)Phosphonate

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Properties Simple | Detailed

Formula C9H18NO4P
IUPAC Name (2r)-2-diethoxyphosphoryl-2-methyl-1-oxido-3,4-dihydropyrrol-1-ium
Molecular Mass 235.217 g·mol−1
Heat of Formation -797.3 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 283.97 Å 3
Surface Area 246.21 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
InChIKey OKCDBZSDRSXFIB-SECBINFHSA-N
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