Crystallography Open Database

Information card for entry 7040011

Preview

Coordinates	7040011.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H17 Cl F6 N5 P Pd
Calculated formula	C16 H17 Cl F6 N5 P Pd
Title of publication	New N^C^N-coordinated Pd(ii) and Pt(ii) complexes of a tridentate N-heterocyclic carbene ligand featuring a 6-membered central ring: synthesis, structures and luminescence.
Authors of publication	Moussa, Jamal; Haddouche, Kamel; Chamoreau, Lise-Marie; Amouri, Hani; Gareth Williams, J. A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	32
Pages of publication	12644 - 12648
a	26.847 ± 0.003 Å
b	6.6403 ± 0.0007 Å
c	11.0216 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	1964.8 ± 0.4 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	7
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0964
Residual factor for significantly intense reflections	0.0747
Weighted residual factors for significantly intense reflections	0.1381
Weighted residual factors for all reflections included in the refinement	0.1438
Goodness-of-fit parameter for all reflections included in the refinement	1.39
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
186437 (current)	2016-09-10	cif/ Updating files of 7040011, 7040012 Original log message: Adding full bibliography for 7040011--7040012.cif.	7040011.cif
184602	2016-07-22	cif/ Adding structures of 7040011, 7040012 via cif-deposit CGI script.	7040011.cif