Crystallography Open Database

Information card for entry 7221581

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Coordinates	7221581.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H21 Cd N5 O6 S
Calculated formula	C19 H21 Cd N5 O6 S
Title of publication	Crystal engineering of cadmium coordination polymers decorated with nitro-functionalized thiophene-2,5-dicarboxylate and structurally related bis(imidazole) ligands with varying flexibility
Authors of publication	Xue, Li-Ping; Li, Zhao-Hao; Ma, Lu-Fang; Wang, Li-Ya
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	33
Pages of publication	6441
a	12.7557 ± 0.0005 Å
b	15.4715 ± 0.0005 Å
c	22.2958 ± 0.0008 Å
α	90°
β	96.906 ± 0.001°
γ	90°
Cell volume	4368.1 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0363
Residual factor for significantly intense reflections	0.0298
Weighted residual factors for significantly intense reflections	0.0634
Weighted residual factors for all reflections included in the refinement	0.0663
Goodness-of-fit parameter for all reflections included in the refinement	1.062
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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