Crystallography Open Database

Information card for entry 7247887

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Coordinates	7247887.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H14 N12 O14 Zn
Calculated formula	C18 H14 N12 O14 Zn
Title of publication	Constructing energetic coordination polymers through mixed-ligand strategy: way to achieve reduced sensitivity with significant energetic performance
Authors of publication	Singla, Priyanka; Soni, Pramod Kumar; Singh, Arjun; Sahoo, Subash Chandra
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	4
Pages of publication	494 - 503
a	10.5932 ± 0.0002 Å
b	5.3285 ± 0.0001 Å
c	22.3376 ± 0.0005 Å
α	90°
β	92.928 ± 0.002°
γ	90°
Cell volume	1259.22 ± 0.04 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0419
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0902
Weighted residual factors for all reflections included in the refinement	0.094
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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