1-(2,2-Diphosphonoethyl)-3-Dodecyl-1H-Imidazol-3-Ium

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Properties Simple | Detailed

Formula C17H35N2O6P2+
IUPAC Name [2-(3-dodecylimidazol-3-ium-1-yl)-1-phosphono-ethyl]phosphonic acid
Molecular Mass 425.417 g·mol−1
Heat of Formation 1376.5 ± 16.7 kJ·mol−1
Dipole Moment 21.80 ± 1.08 D
Volume 367.13 Å 3
Surface Area 336.05 Å 2
HOMO Energy -8.02 ± 0.55 eV
LUMO Energy -2.74 ± eV
Point Group Symmetry C1
InChIKey LPGGFVFFIYFOME-UHFFFAOYSA-O
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