Crystallography Open Database

Information card for entry 7000390

Preview

Coordinates	7000390.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(2,2'-dipyridylamine)(eta4-1,5-cyclooctadiene)copper(i) tetrafluoroborate
Chemical name	(2,2'-dipyridylamine)(η4-1,5-cyclooctadiene)copper(I) tetrafluoroborate
Formula	C18 H21 B Cu F4 N3
Calculated formula	C18 H21 B Cu F4 N3
Title of publication	Olefin coordination in copper(I) complexes of bis(2-pyridyl)amine
Authors of publication	Allen, John J.; Barron, Andrew R.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	5
Pages of publication	878 - 890
a	7.2165 ± 0.0014 Å
b	11.797 ± 0.002 Å
c	10.771 ± 0.002 Å
α	90°
β	95.3 ± 0.03°
γ	90°
Cell volume	913 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Ambient diffracton pressure	101.33 kPa
Number of distinct elements	6
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	0.0882
Residual factor for significantly intense reflections	0.0656
Weighted residual factors for significantly intense reflections	0.1796
Weighted residual factors for all reflections included in the refinement	0.199
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation probe	x-ray
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
179681 (current)	2016-03-24	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/03.	7000390.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7000390.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7000390.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7000390.cif