Crystallography Open Database

Information card for entry 7040208

Preview

Coordinates	7040208.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H40 Cl5 N11 O11 S3 Zn
Calculated formula	C45 H40 Cl5 N11 O11 S3 Zn
Title of publication	Co-ordination behaviour of a novel tristhiourea tripodal ligand; structural variations in a series of transition metal complexes.
Authors of publication	Saad, Fawaz A.; Knight, James C.; Kariuki, Benson M.; Amoroso, Angelo J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	25
Pages of publication	10280 - 10288
a	30.591 ± 0.0003 Å
b	19.795 ± 0.0003 Å
c	17.537 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	10619.5 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.131
Residual factor for significantly intense reflections	0.0853
Weighted residual factors for significantly intense reflections	0.2035
Weighted residual factors for all reflections included in the refinement	0.2283
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7040208.html