Crystallography Open Database

Information card for entry 7017929

Preview

Coordinates	7017929.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	1,4-diphenylpiperazine
Formula	C16 H18 N2
Calculated formula	C16 H18 N2
SMILES	c1(ccccc1)N1CCN(c2ccccc2)CC1
Title of publication	1,4-Bis(4-nitrosophenyl)piperazine: novel bridging ligand in dinuclear complexes of rhodium(iii) and iridium(iii).
Authors of publication	Wirth, Stefan; Barth, Florian; Lorenz, Ingo-Peter
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	7
Pages of publication	2176 - 2186
a	8.6051 ± 0.0003 Å
b	8.4972 ± 0.0004 Å
c	17.8843 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	1307.69 ± 0.11 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	3
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	0.0704
Residual factor for significantly intense reflections	0.0425
Weighted residual factors for significantly intense reflections	0.1082
Weighted residual factors for all reflections included in the refinement	0.1259
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7017929.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7017929.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7017929.cif
33465	2012-02-12	../uploads/cif-deposit/cod/cif Adding structures of 7017929, 7017930, 7017931, 7017932, 7017933, 7017934, 7017935 via cif-deposit CGI script.	7017929.cif