Crystallography Open Database

Information card for entry 4342269

Preview

Coordinates	4342269.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C106 H76 Cd Cl6 N16 Ni2
Calculated formula	C106 H76 Cd Cl6 N16 Ni2
Title of publication	Assembly, disassembly, and reassembly: conversion of homometallic coordination networks into mixed metal-organic frameworks.
Authors of publication	Béziau, Antoine; Baudron, Stéphane A; Rogez, Guillaume; Hosseini, Mir Wais
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	2032 - 2039
a	32.2015 ± 0.0009 Å
b	9.389 ± 0.0003 Å
c	38.2629 ± 0.0012 Å
α	90°
β	106.859 ± 0.001°
γ	90°
Cell volume	11071.2 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.1011
Residual factor for significantly intense reflections	0.0651
Weighted residual factors for significantly intense reflections	0.1745
Weighted residual factors for all reflections included in the refinement	0.189
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
179525 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/22.	4342269.cif
132824	2015-03-04	cif/ Updating files of 4342263, 4342264, 4342265, 4342266, 4342267, 4342268, 4342269, 4342270 Original log message: Adding full bibliography for 4342263--4342270.cif.	4342269.cif
130490	2015-02-04	cif/ Adding structures of 4342263, 4342264, 4342265, 4342266, 4342267, 4342268, 4342269, 4342270 via cif-deposit CGI script.	4342269.cif