Crystallography Open Database

Information card for entry 7116177

Preview

Coordinates	7116177.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	1-D
Formula	C48 H36 Cd3 N10 O18
Calculated formula	C48 H36 Cd3 N10 O18
Title of publication	Integration of rigid and flexible organic parts for the construction of a homochiral metal-organic framework with high porosity.
Authors of publication	Xu, Zhong-Xuan; Tan, Yan-Xi; Fu, Hong-Ru; Kang, Yao; Zhang, Jian
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2015
Journal volume	51
Journal issue	13
Pages of publication	2565 - 2568
a	29.5955 ± 0.0001 Å
b	29.5955 ± 0.0001 Å
c	29.5955 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	25922.5 ± 0.15 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	212
Hermann-Mauguin space group symbol	P 43 3 2
Hall space group symbol	P 4acd 2ab 3
Residual factor for all reflections	0.0816
Residual factor for significantly intense reflections	0.0557
Weighted residual factors for significantly intense reflections	0.1518
Weighted residual factors for all reflections included in the refinement	0.1663
Goodness-of-fit parameter for all reflections included in the refinement	0.982
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180275 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/61.	7116177.cif
130909	2015-02-04	cif/ Updating files of 7116177 Original log message: Adding full bibliography for 7116177.cif.	7116177.cif
129282	2015-01-01	cif/ Adding structures of 7116177 via cif-deposit CGI script.	7116177.cif