Crystallography Open Database

Information card for entry 4120106

4120105 << 4120106 >> 4120107

Preview

Coordinates	4120106.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H19 Co2 N3 O8
Calculated formula	C25 H19 Co2 N3 O8
Title of publication	Ferroelectric Switchable Behavior through Fast Reversible De/adsorption of Water Spirals in a Chiral 3D Metal-Organic Framework
Authors of publication	Xi-Yan Dong; Bo Li; Bin-Bin Ma; Shi-Jun Li; Ming-Ming Dong; Yan-Yan Zhu; Shuang-Quan Zang; You Song; Hong-Wei Hou; Thomas. C. W. Mak
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	10214 - 10217
a	15.6888 ± 0.0007 Å
b	15.6888 ± 0.0007 Å
c	21.7323 ± 0.0017 Å
α	90°
β	90°
γ	120°
Cell volume	4632.5 ± 0.5 Å³
Cell temperature	400 K
Ambient diffraction temperature	400 K
Number of distinct elements	5
Space group number	169
Hermann-Mauguin space group symbol	P 61
Hall space group symbol	P 61
Residual factor for all reflections	0.0498
Residual factor for significantly intense reflections	0.0451
Weighted residual factors for significantly intense reflections	0.1241
Weighted residual factors for all reflections included in the refinement	0.13
Goodness-of-fit parameter for all reflections included in the refinement	1.019
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4120106.html