Crystallography Open Database

Information card for entry 4506446

Preview

Coordinates	4506446.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H28 Co N12 O20 Sm2
Calculated formula	C40 H28 Co N12 O20 Sm2
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	9.1722 ± 0.0007 Å
b	10.6883 ± 0.0008 Å
c	12.6395 ± 0.001 Å
α	84.691 ± 0.002°
β	84.866 ± 0.002°
γ	63.115 ± 0.002°
Cell volume	1098.86 ± 0.15 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	0.0345
Residual factor for significantly intense reflections	0.0316
Weighted residual factors for significantly intense reflections	0.0645
Weighted residual factors for all reflections included in the refinement	0.0656
Goodness-of-fit parameter for all reflections included in the refinement	1.175
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.	4506446.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4506446.cif
66170	2012-09-09	cif/ Adding structures of 4506446 via cif-deposit CGI script.	4506446.cif