(1S,3R,4S)-4-Hydroperoxyphosphonoyloxycyclohexane-1,3-Diol

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Properties Simple | Detailed

Formula C6H13O6P
IUPAC Name (1s,3r,4s)-4-hydroperoxyphosphonoyloxycyclohexane-1,3-diol
Molecular Mass 212.138 g·mol−1
Heat of Formation -1157.5 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 226.74 Å 3
Surface Area 204.69 Å 2
HOMO Energy -10.03 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
InChIKey RJESKQKDXOGILK-WLRKYHAWSA-N
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