Crystallography Open Database

Information card for entry 1574282

Preview

Coordinates	1574282.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H8 Fe I2 O5 Pb3
Calculated formula	C12 H8 Fe I2 O5 Pb3
Title of publication	Coordination-driven assembly of a ferrocene-functionalized lead iodide framework with enhanced stability and charge transfer for photocatalytic CO2-to-CH3OH conversion
Authors of publication	Yin, Jinlin; He, Yani; Sun, Chen; Jiang, Yilin; Fei, Honghan
Journal of publication	Chemical Science
Year of publication	2025
Journal volume	16
Journal issue	19
Pages of publication	8327 - 8337
a	18.3688 ± 0.0007 Å
b	10.6562 ± 0.0007 Å
c	21.9752 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	4301.5 ± 0.4 Å³
Cell temperature	297 K
Ambient diffraction temperature	297 K
Number of distinct elements	6
Space group number	64
Hermann-Mauguin space group symbol	C m c e
Hall space group symbol	-C 2ac 2
Residual factor for all reflections	0.1418
Residual factor for significantly intense reflections	0.1395
Weighted residual factors for significantly intense reflections	0.3051
Weighted residual factors for all reflections included in the refinement	0.3058
Goodness-of-fit parameter for all reflections included in the refinement	1.116
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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