Crystallography Open Database

Information card for entry 7021525

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Coordinates	7021525.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H70 N6 Nb9 Ni O45
Calculated formula	C24.16 H69.76 N6.14 Nb9 Ni O44.957
Title of publication	Highly soluble iron- and nickel-substituted decaniobates with tetramethylammonium countercations.
Authors of publication	Son, Jung-Ho; Ohlin, C André; Casey, William H.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	21
Pages of publication	7529 - 7533
a	12.912 ± 0.0011 Å
b	16.1127 ± 0.0014 Å
c	18.4177 ± 0.0016 Å
α	75.726 ± 0.001°
β	74.247 ± 0.001°
γ	69.871 ± 0.001°
Cell volume	3412.5 ± 0.5 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0534
Residual factor for significantly intense reflections	0.0401
Weighted residual factors for significantly intense reflections	0.0795
Weighted residual factors for all reflections included in the refinement	0.0894
Goodness-of-fit parameter for all reflections included in the refinement	1.176
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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