Crystallography Open Database

Information card for entry 7230676

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Coordinates	7230676.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H26 Cd Cl2 N2 O7
Calculated formula	C20 H16 Cd Cl2 N2 O7
Title of publication	Vapour-driven crystal-to-crystal transformation showing an interlocking switch of the coordination polymer chains between 1D and 3D
Authors of publication	Sun, Li; Guo, Rui-Yun; Yang, Xiao-Dong; Ma, Shuai; Zhang, Jie
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	24
Pages of publication	3297
a	29.9946 ± 0.0012 Å
b	12.7727 ± 0.0009 Å
c	13.3844 ± 0.0006 Å
α	90°
β	98.122 ± 0.004°
γ	90°
Cell volume	5076.3 ± 0.5 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	0.0712
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1387
Weighted residual factors for all reflections included in the refinement	0.1609
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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