Crystallography Open Database

Information card for entry 7246893

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Coordinates	7246893.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H79 Cl1.5 N13 O16.7 Zn3
Calculated formula	C78 H79 Cl1.5 N13 O16.702 Zn3
Title of publication	Anion-dependent dynamic structure and tunable luminescence of Zn-MOFs with carboxyphenyl-terpyridine ligands
Authors of publication	Guo, Runzhong; Liu, Yuchen; Wang, Zhibin; Wang, Haiying; Liu, Huiyan
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	29
Pages of publication	4157 - 4166
a	12.8121 ± 0.0019 Å
b	21.163 ± 0.003 Å
c	15.335 ± 0.002 Å
α	90°
β	113.952 ± 0.002°
γ	90°
Cell volume	3799.9 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0808
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1562
Weighted residual factors for all reflections included in the refinement	0.1703
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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