Crystallography Open Database

Information card for entry 4506449

Preview

Coordinates	4506449.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H28 Co N12 O20 Tb2
Calculated formula	C40 H28 Co N12 O20 Tb2
Title of publication	Series of Novel 3D Heterometallic Frameworks Based on the Co(II) Coordination Chains and Ln(III) Coordination Layers
Authors of publication	Liao, Sheng-Yun; Gu, Wen; Yang, Lin-Yan; Li, Tian-Hao; Tian, Jin-Lei; Wang, Li; Zhang, Ming; Liu, Xin
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	8
Pages of publication	3927
a	9.188 ± 0.0009 Å
b	10.6721 ± 0.001 Å
c	12.6208 ± 0.0012 Å
α	84.041 ± 0.002°
β	84.911 ± 0.002°
γ	62.58 ± 0.002°
Cell volume	1091.4 ± 0.18 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	0.0471
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.0929
Weighted residual factors for all reflections included in the refinement	0.104
Goodness-of-fit parameter for all reflections included in the refinement	1.152
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179600 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/64.	4506449.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4506449.cif
66173	2012-09-09	cif/ Adding structures of 4506449 via cif-deposit CGI script.	4506449.cif