Crystallography Open Database

Information card for entry 4347081

Preview

Coordinates	4347081.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H59 Cl4 N13 O16 Pt4
Calculated formula	C74 H59 Cl4 N13 O16 Pt4
Title of publication	Solid-State and Solution Metallophilic Aggregation of a Cationic [Pt(NCN)L](+) Cyclometalated Complex.
Authors of publication	Sivchik, Vasily V.; Grachova, Elena V.; Melnikov, Alexei S.; Smirnov, Sergey N.; Ivanov, Alexander Yu; Hirva, Pipsa; Tunik, Sergey P.; Koshevoy, Igor O.
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	7
Pages of publication	3351 - 3363
a	13.003 ± 0.01 Å
b	21.611 ± 0.016 Å
c	6.702 ± 0.005 Å
α	90°
β	102.685 ± 0.016°
γ	90°
Cell volume	1837 ± 2 Å³
Cell temperature	270 ± 2 K
Ambient diffraction temperature	270 ± 2 K
Number of distinct elements	6
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	0.0801
Residual factor for significantly intense reflections	0.0405
Weighted residual factors for significantly intense reflections	0.083
Weighted residual factors for all reflections included in the refinement	0.0956
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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
232160 (current)	2019-11-23	cif/ Adding structures of 4347079, 4347080, 4347081, 4347082, 4347083, 4347084, 4347085, 4347086, 4347087, 4347088 via cif-deposit CGI script.	4347081.cif