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Crystal data for, MnIIH2O2}{Mn II(pyrazine)(H2O)2, NbIV(CN) 8)]·4H2O: C12H20N 10O8Mn2Nb, Mr, 635.13, monoclinic, space group P21, a, 7.3785(3, b=14.4288(7, c, 11.7625(5)Å, β, 98.9990(18)°, V, 1236.86(9) Å3 dcalcd, 1.705g cm-3 T, 90(1) K, Z, 2, μ(Mo Kα, 15.160 cm-1, 5686 independent (Rint, 0.031) with 19701 observed data, R1 =0.0321, and wR2, 0.0871, goodness of fit= 1.005. A yellow-red-brown crystal having approximate dimension of 0.37 × 0.17 × 0.10 mm3 was mounted on a glass fiber. All measurements were made on a Rigaku RAXIS imaging plate area detector with graphite monochromated MoKa radiation. The data were collected at a temperature of 90 ± 1 K
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12 expanded using Fourier techniques, and refined by full-matrix least-squares techniques by CRYSTALS. All non-hydrogen atoms were refined anisotropically. The hydrogen atoms of pyrazine were refined using riding model. The hydrogen atoms of water molecule were not included during refinement. All calculations were performed using Crystal Structure crystallographic software package.
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SIR97, Program for the Solution of Crystal Structures: A. Altomare, M. C. Burla, M. Camalli, G. L. Cascarano, C. Giacovazzo, A. Guagliardi, A. G. G. Moliterni, G. Polidori, R. Spagna, J. Appl. Crystallogr. 1999, 32, 115.
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SIR97, Program for the Solution of Crystal Structures: A. Altomare, M. C. Burla, M. Camalli, G. L. Cascarano, C. Giacovazzo, A. Guagliardi, A. G. G. Moliterni, G. Polidori, R. Spagna, J. Appl. Crystallogr. 1999, 32, 115.
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