Crystallography Open Database

Information card for entry 7223409

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Coordinates	7223409.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H15 Cl5 N2 Zn
Calculated formula	C7 H15 Cl5 N2 Zn
Title of publication	Synthesis, characterization and disorder‒order phase transition of inorganic‒organic hybrid materials (H2dabco-CH2-Cl)[MIICl4] (M = Co, Zn)
Authors of publication	Chen, Chun-Hong; Xu, Guan-Cheng
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	4
Pages of publication	550
a	11.19 ± 0.006 Å
b	10.204 ± 0.006 Å
c	12.278 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	1401.9 ± 1.4 Å³
Cell temperature	363 ± 2 K
Ambient diffraction temperature	363 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0316
Residual factor for significantly intense reflections	0.0276
Weighted residual factors for significantly intense reflections	0.0646
Weighted residual factors for all reflections included in the refinement	0.0669
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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