Crystallography Open Database

Information card for entry 4328905

Preview

Coordinates	4328905.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H28 B Cl F4 N4 Pt
Calculated formula	C26 H28 B Cl F4 N4 Pt
SMILES	[Pt]1([n]2c3c4[n]1cccc4ccc3ccc2)(Cl)c1ccccc1C[NH+]1CCCCC1.[B](F)(F)(F)[F-].N#CC
Title of publication	Platinum(II) Diimine Complexes with Halide/Pseudohalide Ligands and Dangling Trialkylamine or Ammonium Groups
Authors of publication	Sayandev Chatterjee; Jeanette A. Krause; Kumudu Madduma-Liyanage; William B. Connick
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	4572 - 4587
a	9.3658 ± 0.0007 Å
b	26.227 ± 0.002 Å
c	11.0318 ± 0.0009 Å
α	90°
β	104.003 ± 0.002°
γ	90°
Cell volume	2629.3 ± 0.4 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0303
Residual factor for significantly intense reflections	0.0246
Weighted residual factors for significantly intense reflections	0.0621
Weighted residual factors for all reflections included in the refinement	0.0642
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.775 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179392 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/89.	4328905.cif
77944	2013-04-01	cif/ Adding structures of 4328905 via cif-deposit CGI script.	4328905.cif