Crystallography Open Database

Information card for entry 4305678

Preview

Coordinates	4305678.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H25 Cl N2 O6 P2 Zn2
Calculated formula	C18 H25 Cl N2 O6 P2 Zn2
Title of publication	Polymorphism in Homochiral Zinc Phosphonates
Authors of publication	Xun-Gao Liu; Song-Song Bao; Yi-Zhi Li; Li-Min Zheng
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	5525 - 5527
a	9.9812 ± 0.0011 Å
b	8.961 ± 0.002 Å
c	13.9031 ± 0.0014 Å
α	90°
β	107.504 ± 0.002°
γ	90°
Cell volume	1185.9 ± 0.3 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0775
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.137
Weighted residual factors for all reflections included in the refinement	0.1414
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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