Crystallography Open Database

Information card for entry 3000576

Preview

No preview available: structure is on hold until 2025-06-19

Coordinates	Coordinates are not available: structure is on hold until 2025-06-19

Structure parameters

Chemical name	6-((4'-nitro-[1,1' biphenyl]-4-yl)oxy)hexanoic acid (NO2-Bi-5-S)
Formula	C36 H38 N2 O10
Authors of publication	Zugenmaier
Journal of publication	To be published in Crystals
a	8.407 ± 0.005 Å
b	12.1 ± 0.006 Å
c	17.651 ± 0.009 Å
α	77.36 ± 0.04°
β	79.82 ± 0.04°
γ	74.59 ± 0.04°
Cell volume	1675.6 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1094
Residual factor for significantly intense reflections	0.0647
Weighted residual factors for significantly intense reflections	0.1626
Weighted residual factors for all reflections included in the refinement	0.191
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	No
Has disorder	No
Has F_obs	No

Version history

Not available for prepublication material.