Crystallography Open Database

Information card for entry 7211411

Preview

Coordinates	7211411.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H17 Cu N4 O4
Calculated formula	C16 H17 Cu N4 O4
Title of publication	Construction of coordination polymers based on methylenebis(3,5-dimethylpyrazole) and varied aromatic carboxylic acids
Authors of publication	Guo, Xiang-Guang; Yang, Wen-Bin; Wu, Xiao-Yuan; Zhang, Qi-Kai; Lu, Can-Zhong
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	46
Pages of publication	10107
a	12.412 ± 0.005 Å
b	16.372 ± 0.007 Å
c	31.497 ± 0.013 Å
α	90°
β	90°
γ	90°
Cell volume	6400 ± 5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	70
Hermann-Mauguin space group symbol	F d d d :2
Hall space group symbol	-F 2uv 2vw
Residual factor for all reflections	0.0454
Residual factor for significantly intense reflections	0.0364
Weighted residual factors for significantly intense reflections	0.1247
Weighted residual factors for all reflections included in the refinement	0.1379
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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