1-Chloro-3-[2-(Hydroxymethyl)-5-Nitro-1H-Imidazol-1-Yl]-2-Propanol

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Properties Simple | Detailed

Formula C7H10ClN3O4
IUPAC Name (2s)-1-chloro-3-[2-(hydroxymethyl)-5-nitro-imidazol-1-yl]propan-2-ol
Molecular Mass 235.625 g·mol−1
Heat of Formation 658.9 ± 16.7 kJ·mol−1
Dipole Moment 2.51 ± 1.08 D
Volume 204.03 Å 3
Surface Area 188.9 Å 2
HOMO Energy -10.46 ± 0.55 eV
LUMO Energy -2.51 ± eV
Point Group Symmetry C1
InChIKey HQPDFZLULOWRMP-RXMQYKEDSA-N
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Elements C N O Cl