Crystallography Open Database

Information card for entry 7249317

Preview

Coordinates	7249317.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H41 I4 N9 O9 Zn2
Calculated formula	C56 H41 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	25.493 ± 0.004 Å
b	13.949 ± 0.003 Å
c	16.199 ± 0.003 Å
α	90°
β	102.121 ± 0.006°
γ	90°
Cell volume	5632 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0791
Residual factor for significantly intense reflections	0.0426
Weighted residual factors for significantly intense reflections	0.0825
Weighted residual factors for all reflections included in the refinement	0.0939
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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