Crystallography Open Database

Information card for entry 7135320

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Coordinates	7135320.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H4 Cl2 Fe N2
Calculated formula	C4 H4 Cl2 Fe N2
Title of publication	A Stable Narrow-Bandgap 2D Iron–Pyrazine Framework Exhibiting High Photoconductivity and Spin–Charge Coupling
Authors of publication	Lassoued, Mohamed Saber; Huang, Xue-Qi; Hussain, Abid; Zheng, Yan-Zhen
Journal of publication	Chemical Communications
Year of publication	2026
a	12.015 ± 0.003 Å
b	7.2065 ± 0.0014 Å
c	3.5729 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	309.36 ± 0.12 Å³
Cell temperature	303 K
Ambient diffraction temperature	303.15 K
Number of distinct elements	5
Space group number	65
Hermann-Mauguin space group symbol	C m m m
Hall space group symbol	-C 2 2
Residual factor for all reflections	0.0623
Residual factor for significantly intense reflections	0.0598
Weighted residual factors for significantly intense reflections	0.1583
Weighted residual factors for all reflections included in the refinement	0.1594
Goodness-of-fit parameter for all reflections included in the refinement	1.415
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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