Crystallography Open Database

Information card for entry 4135367

Preview

Coordinates	4135367.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H22 Mn2 Ni O10 S4
Calculated formula	C32 H20 Mn2 Ni O10 S4
Title of publication	A Metal-Organic Framework Based on a Nickel Bis(dithiolene) Connector: Synthesis, Crystal Structure, and Application as an Electrochemical Glucose Sensor.
Authors of publication	Zhou, Yan; Hu, Qin; Yu, Fei; Ran, Guang-Ying; Wang, Hai-Ying; Shepherd, Nicholas D.; D'Alessandro, Deanna M; Kurmoo, Mohamedally; Zuo, Jing-Lin
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
Journal volume	142
Journal issue	48
Pages of publication	20313 - 20317
a	19.3198 ± 0.0009 Å
b	19.3198 ± 0.0009 Å
c	20.7955 ± 0.0013 Å
α	90°
β	90°
γ	120°
Cell volume	6722.1 ± 0.6 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
Space group number	169
Hermann-Mauguin space group symbol	P 61
Hall space group symbol	P 61
Residual factor for all reflections	0.098
Residual factor for significantly intense reflections	0.0673
Weighted residual factors for significantly intense reflections	0.1688
Weighted residual factors for all reflections included in the refinement	0.1874
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
259522 (current)	2020-12-04	cif/ Updating files of 4135367 Original log message: Adding full bibliography for 4135367.cif.	4135367.cif
259136	2020-11-14	cif/ Adding structures of 4135367 via cif-deposit CGI script.	4135367.cif