Crystallography Open Database

Information card for entry 7230456

Preview

Coordinates	7230456.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H48 Fe3 N4 O14 Sm2
Calculated formula	C62 H48 Fe3 N4 O14 Sm2
Title of publication	General strategy for lanthanide coordination polymers constructed from 1,1′-ferrocenedicarboxylic acid under hydrothermal conditions
Authors of publication	Du, Xue-Dong; Zheng, Weiwei; Yi, Xiao-Hong; Zhao, Jiong-Peng; Wang, Peng; Wang, Chong-Chen
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	18
Pages of publication	2608
a	10.6942 ± 0.0009 Å
b	17.7327 ± 0.0016 Å
c	15.3367 ± 0.0014 Å
α	90°
β	108.478 ± 0.002°
γ	90°
Cell volume	2758.5 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298.15 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0512
Residual factor for significantly intense reflections	0.0302
Weighted residual factors for significantly intense reflections	0.0612
Weighted residual factors for all reflections included in the refinement	0.0698
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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