Crystallography Open Database

Information card for entry 7109890

Preview

Coordinates	7109890.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25.33 H22 N4.67 Ni O8.67 W
Calculated formula	C25.32 H21.98 N4.66667 Ni O8.65 W
Title of publication	Pillar substitution modulates CO2 affinity in 'mmo' topology networks
Authors of publication	Mona H. Mohamed; Sameh K. Elsaidi; Tony Pham; Katherine A. Forrest; Brant Tudor; Lukasz Wojtas; Brian Space; Michael J. Zaworotko
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	9809
a	21.1295 ± 0.0003 Å
b	21.1295 ± 0.0003 Å
c	18.0194 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	6967.06 ± 0.18 Å³
Cell temperature	228 ± 2 K
Ambient diffraction temperature	228 ± 2 K
Number of distinct elements	6
Space group number	155
Hermann-Mauguin space group symbol	R 3 2 :H
Hall space group symbol	R 3 2"
Residual factor for all reflections	0.0188
Residual factor for significantly intense reflections	0.0187
Weighted residual factors for significantly intense reflections	0.0488
Weighted residual factors for all reflections included in the refinement	0.0488
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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