Crystallography Open Database

Information card for entry 7236293

Preview

Coordinates	7236293.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	SFX-TCz
Chemical name	2, 2?, 7, 7?-Tetrakis (N, N- carbazolo) - spiro (fluorene-9, 9?-xanthene)
Formula	C73 H44 N4 O
Calculated formula	C73 H44 N4 O
Title of publication	SFX as a low-cost ‘Spiro’ hole-transport material for efficient perovskite solar cells
Authors of publication	Maciejczyk, Michal; Ivaturi, Aruna; Robertson, Neil
Journal of publication	Journal of Materials Chemistry A
Year of publication	2016
Journal volume	4
Journal issue	13
Pages of publication	4855
a	9.5612 ± 0.0002 Å
b	23.4614 ± 0.0004 Å
c	46.6024 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	10453.8 ± 0.4 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1404
Residual factor for significantly intense reflections	0.0916
Weighted residual factors for significantly intense reflections	0.2309
Weighted residual factors for all reflections included in the refinement	0.2673
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7236293.html