Crystallography Open Database

Information card for entry 7222214

Preview

Coordinates	7222214.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H35 N6 Ni O5
Calculated formula	C33 H35 N6 Ni O5
Title of publication	A series of coordination polymers based on varied polycarboxylates and different imidazole-containing ligands: Syntheses, crystal structures and physical properties
Authors of publication	Wang, Xiao-Feng; Yu, Min; Liu, Guang-Xiang
Journal of publication	RSC Adv.
Year of publication	2015
a	8.9712 ± 0.0009 Å
b	10.0571 ± 0.001 Å
c	18.3348 ± 0.0019 Å
α	74.582 ± 0.001°
β	79.407 ± 0.001°
γ	83.071 ± 0.001°
Cell volume	1563 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0785
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.1029
Weighted residual factors for all reflections included in the refinement	0.118
Goodness-of-fit parameter for all reflections included in the refinement	1.065
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7222214.cif
157793	2015-09-18	cif/ Adding structures of 7222210, 7222211, 7222212, 7222213, 7222214, 7222215, 7222216 via cif-deposit CGI script.	7222214.cif