Crystallography Open Database

Information card for entry 7044781

Preview

Coordinates	7044781.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6.66 H9.99 F2.67 Ga7 N3.33 O28 P6
Calculated formula	C6.664 H9.996 F2.666 Ga7 N3.332 O28 P6
Title of publication	A Gel Aging Effect in the Synthesis of Open-Framework Gallium Phosphates: Structure Solution and Solid-State NMR of a Large-Pore, Open-Framework Material
Authors of publication	Broom, Lucy; Clarkson, Guy J.; Guillou, Nathalie; Hooper, Joseph; Dawson, Daniel; Tang, Chiu; Ashbrook, Sharon Elizabeth; Walton, Richard I.
Journal of publication	Dalton Transactions
Year of publication	2017
a	5.0991 ± 0.0002 Å
b	12.0631 ± 0.0006 Å
c	13.8405 ± 0.0009 Å
α	104.626 ± 0.005°
β	100.346 ± 0.005°
γ	101.936 ± 0.004°
Cell volume	781.41 ± 0.08 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0854
Residual factor for significantly intense reflections	0.0607
Weighted residual factors for significantly intense reflections	0.1385
Weighted residual factors for all reflections included in the refinement	0.1472
Goodness-of-fit parameter for all reflections included in the refinement	1.105
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
203225 (current)	2017-11-16	cif/ Adding structures of 7044780, 7044781 via cif-deposit CGI script.	7044781.cif