Crystallography Open Database

Information card for entry 4104856

Preview

Coordinates	4104856.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H50 F6 N4 O6 S2 Sn2
Calculated formula	C49 H50 F6 N4 O6 S2 Sn2
Title of publication	Synthesis and Reversible Control of the Fluorescent Properties of a Divalent Tin Dipyrromethene
Authors of publication	Junji Kobayashi; Tomokatsu Kushida; Takayuki Kawashima
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	10836 - 10837
a	11.3006 ± 0.0005 Å
b	14.5461 ± 0.0001 Å
c	16.9925 ± 0.0001 Å
α	67.311 ± 0.009°
β	80.428 ± 0.011°
γ	81.174 ± 0.011°
Cell volume	2528.9 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0412
Residual factor for significantly intense reflections	0.0369
Weighted residual factors for significantly intense reflections	0.0991
Weighted residual factors for all reflections included in the refinement	0.1027
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.7107 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/4104856.html