Crystallography Open Database

Information card for entry 1570361

Preview

Coordinates	1570361.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H36 F6 N4 O Pt2 S
Calculated formula	C52 H36 F6 N4 O Pt2 S
Title of publication	Solution-state mechanochromic luminescence of Pt(ii)-complexes displayed within micellar aromatic capsules.
Authors of publication	Hashimoto, Yoshihisa; Katagiri, Yuri; Tanaka, Yuya; Yoshizawa, Michito
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	48
Pages of publication	14211 - 14216
a	8.8576 ± 0.0001 Å
b	32.2146 ± 0.0004 Å
c	31.0202 ± 0.0003 Å
α	90°
β	92.363 ± 0.001°
γ	90°
Cell volume	8843.9 ± 0.17 Å³
Cell temperature	93 ± 3 K
Ambient diffraction temperature	93 ± 3 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	0.047
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.1144
Weighted residual factors for all reflections included in the refinement	0.1162
Goodness-of-fit parameter for all reflections included in the refinement	1.126
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
288758 (current)	2024-01-06	cif/ Updating files of 1570361 Original log message: Adding full bibliography for 1570361.cif.	1570361.cif
287711	2023-11-22	cif/ Adding structures of 1570361 via cif-deposit CGI script.	1570361.cif