Crystallography Open Database

Information card for entry 4303271

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Coordinates	4303271.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C87 H108 F3 N10 Na Ni3 O22 S
Calculated formula	C87 H108 F3 N10 Na Ni3 O22 S
Title of publication	Sodium and Potassium Ion Directed Self-Assembled Multinuclear Assembly of Divalent Nickel or Copper and l-Leucine Derived Ligand
Authors of publication	Mrigendra Dubey; Rik Rani Koner; Manabendra Ray
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	9294 - 9302
a	17.5336 ± 0.0006 Å
b	21.0148 ± 0.0006 Å
c	27.5553 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	10153.2 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	8
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.0518
Residual factor for significantly intense reflections	0.0383
Weighted residual factors for significantly intense reflections	0.0952
Weighted residual factors for all reflections included in the refinement	0.1035
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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