Crystallography Open Database





Information card for 1100770

1100769 << 1100770 >> 1100771

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Coordinates

1100770.cif

Structure parameters

Formula - C6 H8 N Ni O5 P -
Calculated formula - C6 H8 N Ni O5 P -
Title of publication Three-, Two-, and One-Dimensional Metal Phosphonates Based on [Hydroxy(4-pyridyl)methyl]phosphonate: M{(4-C5H4N)CH(OH)PO3}(H2O) (M = Ni, Cd) and Gd{(4-C5H4N)CH(OH)P(OH)O2}3.6H2O
Authors of publication Deng-Ke Cao; Yi-Zhi Li; You Song; Li-Min Zheng
Journal of publication Inorganic Chemistry
Year of publication 2005
Journal volume 44
Pages of publication 3599 - 3604
a 8.798 ± 0.0013 Å
b 10.1982 ± 0.0015 Å
c 17.945 ± 0.003 Å
α 90°
β 90°
γ 90°
Cell volume 1610.1 ± 0.4 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group P b c a
Hall symmetry space group -P 2ac 2ab
Residual factor for all reflections 0.1099
Residual factor for observed reflections 0.0541
Weighted residual factors for the observed reflections 0.0834
Weighted residual factors for all reflections included in the refinement 0.0958
Goodness-of-fit parameter for observed reflections 0.919
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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