1-{[(4S)-4-Bromotetrahydro-2H-Pyran-3-Yl]Amino}-3-(2-Nitro-1H-Imidazol-1-Yl)-2-Propanol

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Formula C11H18BrN4O4
IUPAC Name (2r)-1-[[(3s,4s)-4-bromotetrahydropyran-3-yl]amino]-3-(2-nitro-4h-imidazol-1-ium-4-id-3-yl)propan-2-ol
Molecular Mass 350.189 g·mol−1
Heat of Formation -218.6 ± 16.7 kJ·mol−1
Dipole Moment 7.31 ± 1.08 D
Volume 343.37 Å 3
Surface Area 291.21 Å 2
HOMO Energy -10.00 ± 0.55 eV
LUMO Energy 1.93 ± eV
Point Group Symmetry C1
InChIKey BKORDMXMGXPXFW-OPRDCNLKSA-N
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Elements H C Br O N