Crystallography Open Database

Information card for entry 7135005

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Coordinates	7135005.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H34 Ag Cl Fe N12 O6
Calculated formula	C32 H34 Ag Cl Fe N12 O6
Title of publication	Large dielectric modulation triggered by spin crossover in polar Hofmann-type polymers.
Authors of publication	Yao, Nian-Tao; Jiang, Jiao-Jiao; Qian, Bing-Yuan; Sun, Hui-Ying; Yi, Cheng; Zhao, Liang
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	85
Pages of publication	16640 - 16643
a	13.4233 ± 0.0019 Å
b	16.051 ± 0.002 Å
c	17.725 ± 0.003 Å
α	90°
β	95.291 ± 0.002°
γ	90°
Cell volume	3802.7 ± 1 Å³
Cell temperature	295.01 K
Ambient diffraction temperature	295.01 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0843
Residual factor for significantly intense reflections	0.0511
Weighted residual factors for significantly intense reflections	0.1577
Weighted residual factors for all reflections included in the refinement	0.1795
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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