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Chiu, C.-W.1
Gabbaï, F.P.2
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84869520312
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Data for 4a·BF41: 1HNMR (400 MHZ, CDC13, δ 3.78 (s, 6H, 4.90 (s, 3H, 7.12 (d, 2H, 3J, 8Hz, 7.20-7.22 (m, 2H, 7.34-7.36 (m, 2H, 8.19 (d, 2H, 3J, 8 Hz, 8.33 (t, 2H, 3J, 8 Hz, HRMS m/z: calcd for C22H19BNO4, M, 372.1407; found: 372.1411. Data for 4b·BF 4, 1HNMR (400MHz, CD3CN, δ 1.53 (s, 12H, 4.22 (s, 6H, 4.58 (s, 3H, 7.33 (d, 2H, 3J, 8 Hz, 7.96 (d, 2H, 3J, 9 Hz, 8.25 dd, 2H, 3J, 8 and 9Hz, HRMS m/z: calcd for C22 H28 BNO4, M, H], 381.2111; found: 381.2115
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+), 381.2111; found: 381.2115.
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12
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84869549105
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Crystal Data for 4a·BF4- · CH3CN: C3J H22 B2F 4N2O4, Mr: 500.06, mono-clinic, P 2 1/n (No. 14, a, 11.2300(7, b, 11.4590(7, c, 18.1700(12) Å, V, 2337.5(3)Å3, Z, 4, Dcalcd, 1.421 g cm3, R, 0.1021 (I > 2σ(1, Rw, 0.3754 (all data, GOF, 1.113 for 4460 reflections and 357 parameters (CCDC-733927, Crystal Data for 4b·PF6, C22H27BF 6-NO4P, Mr. 525.23, monoclinic, P 2 1/c (No. 14, a, 7.1230(6, b, 27.711(2, c, 11.8230(12)Å, V, 2320.8(4)Å3, Z, 4, Dcalcd, 1.503g cm-3, R, 0.0917 (I > 2σI, Rw
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-) using a Mac Science DIP 2030 imaging plate equipped with graphite-monochro-mated Mo Kα radiation (λ = 0.71073 Å).
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13
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0004204702
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3rd ed, Oxford University Press
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J. Emsley, The Elements, 3rd ed., Oxford University Press, 1998.
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(1998)
The Elements
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Emsley, J.1
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