Crystallography Open Database

Information card for entry 7245175

Preview

Coordinates	7245175.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H12 Co N6 O4
Calculated formula	C18 H12 Co N6 O4
Title of publication	Influence of reaction temperature and stoichiometry on the coordination mode of a multidentate pyridylpyrazole ligand in Co(ii) complexes: from a 0D mononuclear structure to 3D frameworks
Authors of publication	Zhang, Ling-Mei; Feng, Chao; Yang, Yu-Meng; Huang, Huan-Huan; Zhang, Guo-Ning; Wang, Yu-Cheng; Zhao, Hong
Journal of publication	CrystEngComm
Year of publication	2022
a	13.369 ± 0.002 Å
b	16.647 ± 0.002 Å
c	12.2989 ± 0.0018 Å
α	90°
β	115.706 ± 0.002°
γ	90°
Cell volume	2466.3 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
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	0.0295
Residual factor for significantly intense reflections	0.0285
Weighted residual factors for significantly intense reflections	0.0846
Weighted residual factors for all reflections included in the refinement	0.0854
Goodness-of-fit parameter for all reflections included in the refinement	1.083
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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