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Articles

Directed molecular recognition: furfurylamine appended ditopic receptor for succinic acid

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Pages 769-776 | Received 12 Sep 2013, Accepted 12 Nov 2013, Published online: 17 Jan 2014

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  • Crystal data: formula: C18H16N2O4, formula weight: 324.33, crystal system: tetragonal, space group: P 43 21 2 (No. 96), a, b, c (Å): 10.356, 10.356, 14.731, V (Å)3: 1579.9, Z: 4, D(calc) (g/cm3): 1.364, m(Mo Ka) (mm− 1): 0.098, F(0 0 0): 680, crystal size (mm): 0.30 × 0.30 × 0.20, temperature (K): 150, radiation (Å): Mo Ka 0.71073, θmin–max (°): 1.0, 1.0, data-set: − 13 ≤ h ≤ 8; − 11 ≤ k ≤ 12; − 17 ≤ l ≤ 19, tot., uniq. data, R(int): 7123, 1810, 0.0195, observed data [I>2.0 σ(I)]: 1608, refinement: Nref, Npar: 1810, 114, R, wR2, S: 0.0441, 0.1166, 1.058, max. & av. shift/error: 0.00, 0.00, Flack x: − 0.1(4), min. and max. resd. dens. [e/Å3]: − 0.25, 0.15.
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