Crystallography Open Database

Information card for entry 7702491

Preview

Coordinates	7702491.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Complex 9
Formula	C36 H32 B2 Cu F8 N8 O2
Calculated formula	C36 H32 B2 Cu F8.04 N8 O2
Title of publication	Copper complexes of the functionalised tripodal ligand tris(2-pyridyl)methylamine and its derivatives †
Authors of publication	Arnold, Phillip J.; Davies, Sian C.; Dilworth, Jonathan R.; Durrant, Marcus C.; Griffiths, D. Vaughan; Hughes, David L.; Richards, Raymond L.; Sharpe, Philip C.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	5
Pages of publication	736
a	11.714 ± 0.002 Å
b	13.828 ± 0.002 Å
c	23.072 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3737.2 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1437
Residual factor for significantly intense reflections	0.0536
Weighted residual factors for all reflections	0.1592
Weighted residual factors for significantly intense reflections	0.1104
Goodness-of-fit parameter for all reflections	0.962
Goodness-of-fit parameter for significantly intense reflections	1.143
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	Mo-Kα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243881 (current)	2019-11-28	cif/ Adding structures of 7702488, 7702489, 7702490, 7702491, 7702492, 7702493, 7702494 via cif-deposit CGI script.	7702491.cif