Crystallography Open Database

Information card for entry 4340722

Preview

Coordinates	4340722.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H48 Cd3 Cl10 N4
Calculated formula	C20 H48 Cd3 Cl10 N4
Title of publication	Structural Phase Transitions of a Layered Organic-Inorganic Hybrid Compound: Tetra(cyclopentylammonium) Decachlorotricadmate(II), [C5H9NH3]4Cd3Cl10.
Authors of publication	Liao, Wei-Qiang; Mei, Guang-Quan; Ye, Heng-Yun; Mei, Ying-Xuan; Zhang, Yi
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	17
Pages of publication	8913 - 8918
a	19.44 ± 0.004 Å
b	7.5603 ± 0.0015 Å
c	24.644 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	3622 ± 1.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0758
Residual factor for significantly intense reflections	0.0613
Weighted residual factors for significantly intense reflections	0.1621
Weighted residual factors for all reflections included in the refinement	0.1691
Goodness-of-fit parameter for all reflections included in the refinement	1.133
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179510 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/07.	4340722.cif
122953	2014-09-06	cif/ Updating files of 4340722, 4340723, 4340724 Original log message: Adding full bibliography for 4340722--4340724.cif.	4340722.cif
122023	2014-08-18	cif/ Adding structures of 4340722 via cif-deposit CGI script.	4340722.cif