Crystallography Open Database

Information card for entry 7125604

Preview

Coordinates	7125604.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H52 Cd Cl6 F12 N6 O20 P2
Calculated formula	C52 H32 Cd Cl6 F12 N6 O20 P2
Title of publication	Modulation of breathing behavior of layered coordination polymers via a solid solution approach: the influence of metal ions on sorption behavior.
Authors of publication	Mukherjee, Gargi; Biradha, Kumar
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2014
Journal volume	50
Journal issue	6
Pages of publication	670 - 672
a	10.3591 ± 0.0004 Å
b	19.0085 ± 0.0008 Å
c	16.9399 ± 0.0007 Å
α	90°
β	101.516 ± 0.001°
γ	90°
Cell volume	3268.5 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0942
Residual factor for significantly intense reflections	0.0871
Weighted residual factors for significantly intense reflections	0.2834
Weighted residual factors for all reflections included in the refinement	0.2887
Goodness-of-fit parameter for all reflections included in the refinement	2.526
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
244389 (current)	2019-11-28	cif/ Adding structures of 7125603, 7125604, 7125605, 7125606 via cif-deposit CGI script.	7125604.cif