Crystallography Open Database

Information card for entry 4348479

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Coordinates	4348479.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H18 Cl N Pd Se2
Calculated formula	C16 H18 Cl N Pd Se2
SMILES	c12ccc(cc1[Se](C)[Pd]1(N2c2ccc(cc2[Se]1C)C)Cl)C
Title of publication	A Selenium-Containing Diarylamido Pincer Ligand: Synthesis and Coordination Chemistry with Group 10 Metals.
Authors of publication	Charette, Bronte J.; Ritch, Jamie S.
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	12
Pages of publication	6344 - 6350
a	15.1538 ± 0.0005 Å
b	9.5448 ± 0.0003 Å
c	12.7299 ± 0.0004 Å
α	90°
β	111.159 ± 0.001°
γ	90°
Cell volume	1717.12 ± 0.1 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295.09 K
Number of distinct elements	6
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	0.0362
Residual factor for significantly intense reflections	0.0232
Weighted residual factors for significantly intense reflections	0.0509
Weighted residual factors for all reflections included in the refinement	0.0605
Goodness-of-fit parameter for all reflections included in the refinement	1.2
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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