Crystallography Open Database

Information card for entry 7249315

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Coordinates	7249315.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H39 I4 N9 O9 Zn2
Calculated formula	C55 H39 I4 N9 O9 Zn2
Title of publication	Effect of iodide on the electronic and photoresponsive behaviors of 1D naphthalenediimide-based zinc coordination polymers
Authors of publication	Zhang, Yifang; Kang, Ming; Zhang, Shimin; Gao, Bohong; Hao, Pengfei; Shen, Junju; Li, Gaopeng; Fu, Yunlong
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	40
Pages of publication	5757 - 5766
a	25.3483 ± 0.0017 Å
b	13.9149 ± 0.0008 Å
c	16.2708 ± 0.001 Å
α	90°
β	103.754 ± 0.003°
γ	90°
Cell volume	5574.5 ± 0.6 Å³
Cell temperature	293.15 K
Ambient diffraction temperature	293.15 K
Number of distinct elements	6
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	0.087
Residual factor for significantly intense reflections	0.0445
Weighted residual factors for significantly intense reflections	0.1268
Weighted residual factors for all reflections included in the refinement	0.1501
Goodness-of-fit parameter for all reflections included in the refinement	0.961
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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