Crystallography Open Database

Information card for entry 7029841

Preview

Coordinates	7029841.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H12 Cd N5 O5 S
Calculated formula	C17 H12 Cd N5 O5 S
Title of publication	The structural diversity and photoluminescent properties of cadmium thiophenedicarboxylate coordination polymers.
Authors of publication	Xue, Li-Ping; Chang, Xin-Hong; Li, Shi-Hui; Ma, Lu-Fang; Wang, Li-Ya
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	19
Pages of publication	7219 - 7226
a	9.4643 ± 0.0012 Å
b	9.4643 ± 0.0012 Å
c	42.89 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	3841.8 ± 1.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	122
Hermann-Mauguin space group symbol	I -4 2 d
Hall space group symbol	I -4 2bw
Residual factor for all reflections	0.0381
Residual factor for significantly intense reflections	0.0367
Weighted residual factors for significantly intense reflections	0.0962
Weighted residual factors for all reflections included in the refinement	0.097
Goodness-of-fit parameter for all reflections included in the refinement	1.107
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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