Crystallography Open Database

Information card for entry 4514459

Preview

Coordinates	4514459.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C331.78 H313.34 Cu48 O278.78 P14.59
Calculated formula	C331.52 H313.92 Cu48 O278.4 P14.4
Title of publication	Simultaneous Improvement of Mechanical and Fire-Safety Properties of Polymer Composites with Phosphonate-Loaded MOF Additives.
Authors of publication	Qi, Xiao-Lin; Zhou, Dong-Dong; Zhang, Jing; Hu, Shuang; Haranczyk, Maciej; Wang, De-Yi
Journal of publication	ACS applied materials & interfaces
Year of publication	2019
Journal volume	11
Journal issue	22
Pages of publication	20325 - 20332
a	26.326 ± 0.0013 Å
b	26.326 Å
c	26.326 Å
α	90°
β	90°
γ	90°
Cell volume	18245.5 ± 0.9 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	5
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.0749
Residual factor for significantly intense reflections	0.0722
Weighted residual factors for significantly intense reflections	0.2466
Weighted residual factors for all reflections included in the refinement	0.2487
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.82657 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4514459.html