Crystallography Open Database

Information card for entry 7206314

7206313 << 7206314 >> 7206315

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Coordinates	7206314.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H17 Br N4 Ni O5
Calculated formula	C17 H17 Br N4 Ni O5
Title of publication	Syntheses and characterization of nickel(ii) and cobalt(ii) coordination polymers based on 5-bromoisophthalate anion and bis(imidazole) ligands
Authors of publication	Ma, Lu-Fang; Li, Xiu-Qin; Wang, Li-Ya; Hou, Hong-Wei
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	14
Pages of publication	4625
a	9.7514 ± 0.0013 Å
b	10.143 ± 0.0014 Å
c	11.2886 ± 0.0016 Å
α	108.396 ± 0.001°
β	106.263 ± 0.001°
γ	102.921 ± 0.001°
Cell volume	955.6 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0374
Residual factor for significantly intense reflections	0.0279
Weighted residual factors for significantly intense reflections	0.0603
Weighted residual factors for all reflections included in the refinement	0.065
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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