Crystallography Open Database

Information card for entry 7711412

Preview

Coordinates	7711412.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C172.5 H311 Cl Cu20 N10 O20 Si20
Calculated formula	C172.5 H311 Cl Cu20 N10 O20 Si20
Title of publication	Cuproussiloxane as two self-assemblies, Cu<sub>20</sub>O<sub>20</sub>Si<sub>10</sub>Me<sub>10</sub>R<sub>10</sub> and Cu<sub>24</sub>O<sub>24</sub>Si<sub>12</sub>Me<sub>12</sub>R<sub>12</sub>, with catalytic property.
Authors of publication	Jiang, Wenjun; Wang, Jinjin; Chen, Yilin; Chen, Zhikang; Li, Jiancheng; Jiang, Liuyin; Peng, Yanbo; Zhu, Hongping
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
Journal volume	51
Journal issue	33
Pages of publication	12432 - 12435
a	17.9559 ± 0.0004 Å
b	34.2763 ± 0.0008 Å
c	39.5585 ± 0.001 Å
α	90°
β	101.029 ± 0.002°
γ	90°
Cell volume	23897.1 ± 1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	7
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	0.1065
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1217
Weighted residual factors for all reflections included in the refinement	0.1389
Goodness-of-fit parameter for all reflections included in the refinement	1.004
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
278361 (current)	2022-10-05	cif/ Adding structures of 7711410, 7711411, 7711412, 7711413 via cif-deposit CGI script.	7711412.cif