Crystallography Open Database

Information card for entry 4029224

Preview

Coordinates	4029224.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H22 N2 O5
Calculated formula	C28 H22 N2 O5
Title of publication	Furanodendralenes.
Authors of publication	Fallon, Thomas; Willis, Anthony C; Paddon-Row, Michael N; Sherburn, Michael S
Journal of publication	The Journal of organic chemistry
Year of publication	2014
Journal volume	79
Journal issue	7
Pages of publication	3185 - 3193
a	12.2122 ± 0.0004 Å
b	9.272 ± 0.0002 Å
c	19.8137 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	2243.54 ± 0.13 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 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	0.1065
Residual factor for significantly intense reflections	0.0755
Weighted residual factors for all reflections	0.1627
Weighted residual factors for significantly intense reflections	0.1504
Weighted residual factors for all reflections included in the refinement	0.1627
Goodness-of-fit parameter for all reflections included in the refinement	1.0193
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4029224.html