2,2-Dibromo-N-[(1R,2R)-1,3-Dihydroxy-1-(4-Nitrophenyl)-2-Propanyl]Acetamide

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Formula C11H12Br2N2O5
IUPAC Name 2,2-dibromo-n-[(1r,2r)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide
Molecular Mass 412.031 g·mol−1
Heat of Formation -457.1 ± 16.7 kJ·mol−1
Dipole Moment 6.75 ± 1.08 D
Volume 354.19 Å 3
Surface Area 308.86 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy 1.64 ± eV
Point Group Symmetry C1
InChIKey UWOHGNMWBGIRAQ-RKDXNWHRSA-N
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Elements H C O Br N