1,6-Di-O-Phosphono-D-Mannitol

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Properties Simple | Detailed

Formula C6H16O12P2
IUPAC Name [(2r,3r,4r,5r)-2,3,4,5-tetrahydroxy-6-phosphonooxy-hexyl] dihydrogen phosphate
Molecular Mass 342.132 g·mol−1
Heat of Formation -2868.7 ± 16.7 kJ·mol−1
Dipole Moment 1.12 ± 1.08 D
Volume 339.93 Å 3
Surface Area 315.58 Å 2
HOMO Energy -10.11 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • d-mannitol-1,6-diphosphate
  • m2p
InChIKey WOYYTQHMNDWRCW-KVTDHHQDSA-N
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Elements P C O H