Crystallography Open Database

Information card for entry 7002440

Preview

Coordinates	7002440.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[tris(tert-butylimido)tetraselane)dichlorido- palladium-benzonitrile(1/1)
Formula	C19 H32 Cl2 N4 Pd Se4
Calculated formula	C19 H32 Cl2 N4 Pd Se4
SMILES	[Pd]1([Se]2N([Se]1N([Se][Se]N2C(C)(C)C)C(C)(C)C)C(C)(C)C)(Cl)Cl.N#Cc1ccccc1
Title of publication	Palladium complexes containing novel cyclic selenium imides
Authors of publication	Risto, Maarit; Eironen, Aino; Männistö, Elisa; Oilunkaniemi, Raija; Laitinen, Risto S.; Chivers, Tristram
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	40
Pages of publication	8473 - 8475
a	10.174 ± 0.002 Å
b	11.088 ± 0.002 Å
c	12.827 ± 0.003 Å
α	71.65 ± 0.03°
β	86.4 ± 0.03°
γ	75.21 ± 0.03°
Cell volume	1327.7 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0611
Residual factor for significantly intense reflections	0.0446
Weighted residual factors for significantly intense reflections	0.099
Weighted residual factors for all reflections included in the refinement	0.1076
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
179724 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/24.	7002440.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7002440.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7002440.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7002440.cif