Crystallography Open Database

Information card for entry 7218290

Preview

Coordinates	7218290.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H44 N6 Ni3 O22 P4
Calculated formula	C28 H44 N6 Ni3 O22 P4
Title of publication	Synthesis, structures, surface photovoltage and luminescent properties of two new nickel(II) carboxyphosphonates with a 3D framework structure
Authors of publication	Luo, Hui; Zhu, Yanyu; Sun, Zhen-Gang; Jiao, Cheng‒Qi; Zhang, Guang-Ning; Sun, Tong; Ma, Ming-Xue; Li, Wen-Zhu
Journal of publication	RSC Adv.
Year of publication	2014
a	27.79 ± 0.003 Å
b	8.1036 ± 0.0007 Å
c	22.617 ± 0.002 Å
α	90°
β	123.129 ± 0.001°
γ	90°
Cell volume	4265.4 ± 0.7 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0764
Residual factor for significantly intense reflections	0.064
Weighted residual factors for significantly intense reflections	0.1945
Weighted residual factors for all reflections included in the refinement	0.2091
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
180513 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/82.	7218290.cif
124304	2014-09-27	cif/ Adding structures of 7218290 via cif-deposit CGI script.	7218290.cif