2-[5-[[[(3R,4R)-4-Bromotetrahydropyran-3-Yl]Amino]Methyl]-2-Nitro-4H-Imidazol-1-Ium-4-Id-3-Yl]Ethanol

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Properties Simple | Detailed

Formula C11H18BrN4O4
IUPAC Name 2-[5-[[[(3r,4r)-4-bromotetrahydropyran-3-yl]amino]methyl]-2-nitro-4h-imidazol-1-ium-4-id-3-yl]ethanol
Molecular Mass 350.189 g·mol−1
Heat of Formation -224.7 ± 16.7 kJ·mol−1
Dipole Moment 3.88 ± 1.08 D
Volume 345.28 Å 3
Surface Area 307.3 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
InChIKey OMCNKRMFXIHKQM-NXEZZACHSA-N
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Elements H C O Br N