Crystallography Open Database

Information card for entry 8104931

Preview

Coordinates	8104931.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H40 Cl4 N4 O16 Pb2
Calculated formula	C52 H40 Cl4 N4 O16 Pb2
Title of publication	Crystal structure of diaqua-bis(μ2-5-chloro-salicylato-κ3 O,O′:O′)-bis(5-chloro-salicylato-κ2 O,O′)-bis(1,10-phenanthroline-κ2 N,N′) dilead(II) – water (1/2), C52H36C14N4O14Pb2·2(H2O)
Authors of publication	Tang, Zhiwei; Wen, Decai
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2021
Journal volume	236
Journal issue	1
Pages of publication	235 - 237
a	9.1186 ± 0.0004 Å
b	12.8031 ± 0.0006 Å
c	13.0111 ± 0.0006 Å
α	63.504 ± 0.004°
β	79.4 ± 0.004°
γ	77.198 ± 0.004°
Cell volume	1319.34 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0438
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0523
Weighted residual factors for all reflections included in the refinement	0.0554
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation probe	x-ray
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
274085 (current)	2022-03-29	cif/ Adding structures of 8104931 via cif-deposit CGI script.	8104931.cif