(1R,2S,3S,4R,5R)-4-[(4-Bromobenzyl)Amino]-5-(Hydroxymethyl)-1,2,3-Cyclopentanetriol

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Formula C13H18BrNO4
IUPAC Name (1r,2s,3s,4r,5r)-4-[(4-bromophenyl)methylamino]-5-(hydroxymethyl)cyclopentane-1,2,3-triol
Molecular Mass 332.190 g·mol−1
Heat of Formation -669.0 ± 16.7 kJ·mol−1
Dipole Moment 2.29 ± 1.08 D
Volume 343.52 Å 3
Surface Area 302.61 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy 2.63 ± eV
Point Group Symmetry C1
InChIKey BSQKACVWQISROJ-QWQWKMKNSA-N
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Elements H C O Br N