Crystallography Open Database

Information card for entry 7701220

Preview

Coordinates	7701220.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H110 Co3 N22 O44
Calculated formula	C80 H110 Co3 N22 O44
Title of publication	Water adsorption and proton conduction of a cobalt(ii) complex assembled by triazine-based polycarboxylate.
Authors of publication	Feng, Lu; Zhou, Min; Ye, Fan; Chen, Chang; Hou, Haobo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	40
Pages of publication	15192 - 15197
a	11.485 ± 0.0006 Å
b	15.4909 ± 0.0009 Å
c	28.1342 ± 0.0016 Å
α	90°
β	95.484 ± 0.002°
γ	90°
Cell volume	4982.5 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
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	0.1094
Residual factor for significantly intense reflections	0.0573
Weighted residual factors for significantly intense reflections	0.134
Weighted residual factors for all reflections included in the refinement	0.1524
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
224254 (current)	2019-11-08	cif/ Updating files of 7701220 Original log message: Adding full bibliography for 7701220.cif.	7701220.cif
218654	2019-09-21	cif/ Adding structures of 7701220 via cif-deposit CGI script.	7701220.cif