Crystallography Open Database

Information card for entry 7004507

Preview

Coordinates	7004507.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H46 Cu2 N8 Na2 Nd2 O37
Calculated formula	C20 H46 Cu2 N8 Na2 Nd2 O37
Title of publication	Unprecedented NaI‒CuII‒LnIII heterometallic coordination polymers based on 3,5-pyrazoledicarboxylate with both infinite cationic and anionic chains
Authors of publication	Wang, Yan; Song, You; Pan, Zhao-Rui; Shen, Ying-Zhong; Hu, Zheng; Guo, Zi-Jian; Zheng, He-Gen
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	41
Pages of publication	5588 - 5592
a	24.542 ± 0.01 Å
b	13.429 ± 0.01 Å
c	13.701 ± 0.01 Å
α	90°
β	92.42 ± 0.1°
γ	90°
Cell volume	4511 ± 5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
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	0.0423
Residual factor for significantly intense reflections	0.0314
Weighted residual factors for significantly intense reflections	0.0676
Weighted residual factors for all reflections included in the refinement	0.0732
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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