Crystallography Open Database

Information card for entry 7712042

7712041 << 7712042 >> 7712043

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Coordinates	7712042.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H12 Co N16 O
Calculated formula	C8 H12 Co N16 O
Title of publication	Coordination polymerization of nitrogen-rich linkers and dicyanamide anions toward energetic coordination polymers with low sensitivities.
Authors of publication	Xie, Hao-Hui; Wang, Qin; Weng, Jiao-Lin; Yan, Yun-Fan; Bian, Hong-Yi; Huang, Ying; Zheng, Fa-Kun; Qiu, Ren-Hui; Xu, Jian-Gang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
Journal volume	52
Journal issue	3
Pages of publication	818 - 824
a	7.3406 ± 0.0004 Å
b	15.4425 ± 0.0007 Å
c	14.667 ± 0.0009 Å
α	90°
β	102.687 ± 0.006°
γ	90°
Cell volume	1622.02 ± 0.16 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 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	0.047
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.1002
Weighted residual factors for all reflections included in the refinement	0.1036
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation probe	x-ray
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
283335 (current)	2023-05-05	cif/ Updating files of 7712042, 7712043, 7712044, 7712045 Original log message: Adding full bibliography for 7712042--7712045.cif.	7712042.cif
280084	2023-01-04	cif/ Adding structures of 7712042, 7712043, 7712044, 7712045 via cif-deposit CGI script.	7712042.cif