Crystallography Open Database

Information card for entry 7018800

Preview

Coordinates	7018800.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H51 Cl2 N10 O2 P2 Ru
Calculated formula	C62 H50 Cl2 N10 O2 P2 Ru
Title of publication	A novel triazidoruthenium(iii) building block for the construction of polynuclear compounds
Authors of publication	Xiang, Jing; Jia, Li-Hui; Man, Wai-Lun; Qian, Kang; Lee, Gene-Hsiang; Peng, Shie-Ming; Yiu, Shek-Man; Gao, Song; Lau, Tai-Chu
Journal of publication	Dalton Transactions
Year of publication	2012
Journal volume	41
Journal issue	19
Pages of publication	5794
a	9.807 ± 0.0001 Å
b	24.4502 ± 0.0003 Å
c	12.8128 ± 0.0002 Å
α	90°
β	104.704 ± 0.002°
γ	90°
Cell volume	2971.68 ± 0.07 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0602
Residual factor for significantly intense reflections	0.0564
Weighted residual factors for significantly intense reflections	0.1711
Weighted residual factors for all reflections included in the refinement	0.1741
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179892 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/88.	7018800.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7018800.cif
55962	2012-05-08	cif/ Adding structures of 7018800, 7018801, 7018802 via cif-deposit CGI script.	7018800.cif