Crystallography Open Database

Information card for entry 7048820

Preview

Coordinates	7048820.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H118 K12 La4 N8 O67
Calculated formula	C60 H72 K12 La4 N8 O67
Title of publication	Carbonate and phosphite encaged in the frameworks constructed by square lanthanum aminopolycarboxylates and sodium chlorides
Authors of publication	Wang, Si-Yuan; Gao, Song; Dai, Jun-Wei; Shi, Yan-Ru; Dong, Xin; Weng, Weizheng; Zhou, Zhao-Hui
Journal of publication	Dalton Transactions
Year of publication	2019
a	32.8933 ± 0.001 Å
b	9.4679 ± 0.0004 Å
c	34.2291 ± 0.0014 Å
α	90°
β	102.532 ± 0.004°
γ	90°
Cell volume	10406 ± 0.7 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173.15 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	0.097
Residual factor for significantly intense reflections	0.0748
Weighted residual factors for significantly intense reflections	0.1435
Weighted residual factors for all reflections included in the refinement	0.1529
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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