Crystallography Open Database

Information card for entry 4313440

Preview

Coordinates	4313440.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H41 Cl2 N12 Ni O15 Tb0.5
Calculated formula	C35 H41 Cl2 N12 Ni O15 Tb0.5
Title of publication	Lanthanide-Transition Heterometallic Extended Structures with Novel Orthogonal Metalloligand as Building Block
Authors of publication	Zheng He; Cheng He; En-Qing Gao; Zhe-Ming Wang; Xiao-Fan Yang; Chun-Sheng Liao; Chun-Hua Yan
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	2206 - 2208
a	13.7842 ± 0.0003 Å
b	12.4662 ± 0.0004 Å
c	30.2055 ± 0.0011 Å
α	90°
β	92.7503 ± 0.0018°
γ	90°
Cell volume	5184.4 ± 0.3 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	7
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1013
Residual factor for significantly intense reflections	0.0783
Weighted residual factors for significantly intense reflections	0.22
Weighted residual factors for all reflections included in the refinement	0.2376
Goodness-of-fit parameter for all reflections included in the refinement	1.096
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4313440.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4313440.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4313440.cif
6509	2011-01-11	../uploads/cif-deposit/cod/cif Adding structures of 4313440 via cif-deposit CGI script.	4313440.cif