Crystallography Open Database

Information card for entry 7056732

Preview

Coordinates	7056732.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H18 N2 Pt
Calculated formula	C20 H18 N2 Pt
SMILES	[Pt]1(c2ccccc2c2[n]1cccc2)(C)C#[N]Cc1ccccc1
Title of publication	A New Approach to the Effects of Isocyanide (CN-R) Ligands on the Luminescence Properties of Cycloplatinated(II) Complexes
Authors of publication	Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Hossein-Abadi, Mojdeh; Golbon Haghighi, Mohsen; Notash, Behrouz; fereidoonnezhad, Masood
Journal of publication	New Journal of Chemistry
Year of publication	2017
Journal volume	41
Journal issue	24
Pages of publication	15347 - 15356
a	21.311 ± 0.004 Å
b	12.257 ± 0.003 Å
c	16.659 ± 0.003 Å
α	90°
β	128.4 ± 0.03°
γ	90°
Cell volume	3410.2 ± 1.9 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
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	0.0736
Residual factor for significantly intense reflections	0.0375
Weighted residual factors for significantly intense reflections	0.0616
Weighted residual factors for all reflections included in the refinement	0.0678
Goodness-of-fit parameter for all reflections included in the refinement	0.878
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
301442 (current)	2025-08-04	Updating journal pages, volumes and years from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	7056732.cif
202885	2017-11-07	cif/ Adding structures of 7056732, 7056733 via cif-deposit CGI script.	7056732.cif