Crystallography Open Database

Information card for entry 7026595

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Coordinates	7026595.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H32 N4 O16 P2 Zn3
Calculated formula	C22 H32 N4 O16 P2 Zn3
Title of publication	Systematic exploration of a rutile-type zinc(II)-phosphonocarboxylate open framework: the factors that influence the structure.
Authors of publication	Ling, Yun; Liao, Teng-Biao; Chen, Zhen-Xia; Zhou, Ya-Ming; Weng, Lin-Hong
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	44
Pages of publication	10712 - 10718
a	32.84 ± 0.02 Å
b	9.599 ± 0.007 Å
c	20.209 ± 0.013 Å
α	90°
β	106.71 ± 0.009°
γ	90°
Cell volume	6101 ± 7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0564
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0704
Weighted residual factors for all reflections included in the refinement	0.0739
Goodness-of-fit parameter for all reflections included in the refinement	0.869
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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