Crystallography Open Database

Information card for entry 7201333

7201332 << 7201333 >> 7201334

Preview

Coordinates	7201333.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H24.5 Cl3 Cu N4 O4.75
Calculated formula	C20 H21 Cl3 Cu N4 O4.75
Title of publication	Structural diversity in the reactions of 4′-(pyridyl)-2,2′:6′,2″-terpyridine ligands and bis{4′-(4-pyridyl)-2,2′:6′,2″-terpyridine}iron(II) with copper(II) salts
Authors of publication	Beves, Jonathon E.; Constable, Edwin C.; Decurtins, Silvio; Dunphy, Emma L.; Housecroft, Catherine E.; Keene, Tony D.; Neuburger, Markus; Schaffner, Silvia; Zampese, Jennifer A.
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	11
Pages of publication	2406
a	7.747 ± 0.005 Å
b	11.305 ± 0.005 Å
c	14.063 ± 0.005 Å
α	102.087 ± 0.005°
β	96.866 ± 0.005°
γ	91.748 ± 0.005°
Cell volume	1193.7 ± 1 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 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	0.0419
Residual factor for significantly intense reflections	0.0394
Weighted residual factors for significantly intense reflections	0.1064
Weighted residual factors for all reflections included in the refinement	0.1083
Goodness-of-fit parameter for all reflections included in the refinement	1.102
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7201333.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7201333.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7201333.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7201333.cif