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The structure of 4e, which was recrystallized from MeOH, was determined by single-crystal X-ray diffraction analysis. Data collection: SMART (Bruker, 2001, cell refinement: SAINT (Bruker, 2001, data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997, program(s) used to refine structure: SHELXL97 (Sheldrick, 1997, molecular graphics: PLATON (Spek, 2003, Crystal data: C34H32N6O4, M, 558.66, Monoclinic, P2 (1)/c, a, 15.822(2) Å, b, 8.0024(7) Å, c, 23.7333(14) Å, α, 90°, β, 93.993(1)°, γ, 90°, V, 2997.6(5) Å3, Z, 4, Dcalcd, 1.304 g/cm3, 13493 collected reflections, 6514 independent Rint, 0.0617, R1, 0.0564, wR2, 0.1171. The crystal data has been deposited in the Cambridge Crystallographic Data Centre as supplementary publication No. CCDC 668066. Copies of the data can be obtained, free of charge, via the internet
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The structure of 4e, which was recrystallized from MeOH, was determined by single-crystal X-ray diffraction analysis. Data collection: SMART (Bruker, 2001); cell refinement: SAINT (Bruker, 2001); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: PLATON (Spek, 2003). Crystal data: C34H32N6O4, M = 558.66, Monoclinic, P2 (1)/c, a = 15.822(2) Å, b = 8.0024(7) Å, c = 23.7333(14) Å, α = 90°, β = 93.993(1)°, γ = 90°, V = 2997.6(5) Å3, Z = 4, Dcalcd = 1.304 g/cm3, 13493 collected reflections, 6514 independent (Rint = 0.0617), R1 = 0.0564, wR2 = 0.1171. The crystal data has been deposited in the Cambridge Crystallographic Data Centre as supplementary publication No. CCDC 668066. Copies of the data can be obtained, free of charge, via the internet (http://www.ccdc.cam.ac.uk/data_request/cif), by e-mail (data_request@ccdc.cam. ac.uk), or by fax (+44-1223-336033).
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