Crystallography Open Database

Information card for entry 4082157

Preview

Coordinates	4082157.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H25 As F4 Pt
Calculated formula	C27 H25 As F4 Pt
SMILES	[Pt]123(c4c([As](c5ccccc5)c5ccccc5)c(F)c(F)c(F)c4F)([CH]4=[CH]3CC[CH]2=[CH]1CC4)C
Title of publication	Divalent Platinum Complexes of the Carbanion 2-C6F4AsPh2: Monodentate or Bidentate Coordination?
Authors of publication	Mirzadeh, Nedaossadat; Privér, Steven H.; Bennett, Martin A.; Wagler, Jörg; Bhargava, Suresh K.
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	24
Pages of publication	7451
a	10.8041 ± 0.0014 Å
b	20.606 ± 0.003 Å
c	10.8053 ± 0.0014 Å
α	90°
β	103.694 ± 0.003°
γ	90°
Cell volume	2337.2 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0294
Residual factor for significantly intense reflections	0.0204
Weighted residual factors for significantly intense reflections	0.0411
Weighted residual factors for all reflections included in the refinement	0.0426
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
178710 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/21.	4082157.cif
107967	2014-03-25	cif/4 Changing the entity to the proper non-English character for many entries in subdir 4	4082157.cif
92202	2014-01-12	cif/ Adding structures of 4082155, 4082156, 4082157, 4082158, 4082159, 4082160, 4082161 via cif-deposit CGI script.	4082157.cif