Crystallography Open Database

Information card for entry 7134795

Preview

Coordinates	7134795.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C160 H160 N16
Calculated formula	C160 H160 N16
Title of publication	Introducing the substituted azobispyrrole framework: synthesis and properties.
Authors of publication	Alkaş, Adil; Diaz-Rodriguez, Roberto M; Sequeira, Steve O.; Hilborn, James W.; Atansi, Mmasinachi; Sullivan, Em C.; Brown, Emily B.; Gapare, Rosinah Liandrah; Mutus, Bulent; Robertson, Katherine N.; Thompson, Alison
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
a	19.232 ± 0.0008 Å
b	19.9165 ± 0.0007 Å
c	19.9108 ± 0.0008 Å
α	68.127 ± 0.0014°
β	74.0072 ± 0.0015°
γ	73.9936 ± 0.0014°
Cell volume	6674.3 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0781
Residual factor for significantly intense reflections	0.0495
Weighted residual factors for significantly intense reflections	0.1199
Weighted residual factors for all reflections included in the refinement	0.1519
Goodness-of-fit parameter for all reflections included in the refinement	1.159
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
300309 (current)	2025-07-04	cif/ Adding structures of 7134793, 7134794, 7134795 via cif-deposit CGI script.	7134795.cif