Crystallography Open Database

Information card for entry 7036068

Preview

Coordinates	7036068.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 D6 N6 Zn2
Calculated formula	C20 H16 D6 N6 Zn2
Title of publication	(Me)L2Zn2(μ-1,6-Ph2-N6) - a building block for new hexazene complexes.
Authors of publication	Gondzik, S.; Wölper, C; Haack, R.; Jansen, G.; Schulz, S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	35
Pages of publication	15703 - 15711
a	21.0073 ± 0.0016 Å
b	12.6894 ± 0.001 Å
c	7.7367 ± 0.0006 Å
α	90°
β	99.501 ± 0.004°
γ	90°
Cell volume	2034.1 ± 0.3 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 ± 1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0482
Residual factor for significantly intense reflections	0.0381
Weighted residual factors for significantly intense reflections	0.0922
Weighted residual factors for all reflections included in the refinement	0.0985
Goodness-of-fit parameter for all reflections included in the refinement	1.141
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
161279 (current)	2015-10-09	cif/ Updating files of 7036068, 7036069 Original log message: Adding full bibliography for 7036068--7036069.cif.	7036068.cif
152950	2015-08-06	cif/ Adding structures of 7036068, 7036069 via cif-deposit CGI script.	7036068.cif