Crystallography Open Database

Information card for entry 1543187

Preview

Coordinates	1543187.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H130 B40 N4 O Pt2
Calculated formula	C64 H130 B40 N4 O Pt2
Title of publication	Luminescent metal complexes featuring photophysically innocent boron cluster ligands
Authors of publication	Kirlikovali, Kent O.; Axtell, Jonathan C.; Gonzalez, Alejandra; Phung, Alice C.; Khan, Saeed I.; Spokoyny, Alexander M.
Journal of publication	Chem. Sci.
Year of publication	2016
Journal volume	7
Journal issue	8
Pages of publication	5132
a	10.8488 ± 0.0011 Å
b	13.1236 ± 0.0014 Å
c	16.511 ± 0.0017 Å
α	112.701 ± 0.001°
β	97.749 ± 0.001°
γ	94.541 ± 0.001°
Cell volume	2126.6 ± 0.4 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	0.0636
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.0899
Weighted residual factors for all reflections included in the refinement	0.1023
Goodness-of-fit parameter for all reflections included in the refinement	1.123
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
185151 (current)	2016-08-07	cif/ Updating files of 1543183, 1543184, 1543185, 1543186, 1543187, 1543188 Original log message: Adding full bibliography for 1543183--1543188.cif.	1543187.cif
182323	2016-04-28	cif/ Adding structures of 1543183, 1543184, 1543185, 1543186, 1543187, 1543188 via cif-deposit CGI script.	1543187.cif