Crystallography Open Database

Information card for entry 7219737

7219736 << 7219737 >> 7219738

Preview

Coordinates	7219737.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H19 N2 Ni1.5 O9 P2
Calculated formula	C9 H19 N2 Ni1.5 O9 P2
Title of publication	Mixed‒solvothermal synthesis, structures, surface photovoltage, luminescence and molecular recognition properties of three new transition metal phosphonates with 3D framework and supramolecular structures
Authors of publication	Sun, Tong; Jiao, Cheng‒Qi; Li, Wen-Zhu; Sun, Zhen-Gang; Ma, Chao; Zhu, Yanyu; Ma, Ming-Xue; Luo, Hui; Zhang, Xiao-Wen; Wang, Mei-Ling
Journal of publication	RSC Adv.
Year of publication	2015
a	18.7958 ± 0.0009 Å
b	8.2622 ± 0.0004 Å
c	18.855 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	2928.1 ± 0.2 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0931
Residual factor for significantly intense reflections	0.067
Weighted residual factors for significantly intense reflections	0.1568
Weighted residual factors for all reflections included in the refinement	0.186
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7219737.cif
133067	2015-03-05	cif/ Adding structures of 7219737, 7219738 via cif-deposit CGI script.	7219737.cif