Crystallography Open Database

Information card for entry 4518401

Preview

Coordinates	4518401.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H20 I4 N2 O4 Pb
Calculated formula	C8 H20 I4 N2 O4 Pb
Title of publication	Low-Dimensional Hybrid Lead Iodide Perovskites Single Crystals via Bifunctional Amino Acid Cross-Linkage: Structural Diversity and Properties Controllability.
Authors of publication	Xie, Guanying; Wang, Lei; Li, Peizhou; Song, Shuang; Yao, Changlin; Wang, Shanpeng; Liu, Yang; Wang, Zhen; Wang, Xinyuan; Tao, Xutang
Journal of publication	ACS applied materials & interfaces
Year of publication	2021
Journal volume	13
Journal issue	2
Pages of publication	3325 - 3335
a	8.9064 ± 0.0004 Å
b	9.2796 ± 0.0005 Å
c	24.348 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	2012.31 ± 0.16 Å³
Cell temperature	302 ± 2 K
Ambient diffraction temperature	302 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0612
Residual factor for significantly intense reflections	0.0365
Weighted residual factors for significantly intense reflections	0.0708
Weighted residual factors for all reflections included in the refinement	0.0804
Goodness-of-fit parameter for all reflections included in the refinement	1.097
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
261495 (current)	2021-02-04	cif/ Updating files of 4518400, 4518401, 4518402, 4518403, 4518404 Original log message: Adding full bibliography for 4518400--4518404.cif.	4518401.cif
260579	2021-01-07	cif/ Adding structures of 4518401 via cif-deposit CGI script.	4518401.cif