Crystallography Open Database

Information card for entry 7132443

Preview

Coordinates	7132443.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	HOF_2
Formula	C27 H29 N6 O11
Calculated formula	C27 H29 N6 O11
Title of publication	Photoinduced radical formation in hydrogen-bonded organic frameworks.
Authors of publication	Almuhana, Asia R. Y.; Orton, Georgia R. F.; Rosenberg, Callum; Champness, Neil R.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	4
Pages of publication	452 - 455
a	7.1361 ± 0.0001 Å
b	9.0655 ± 0.0001 Å
c	20.9919 ± 0.0003 Å
α	88.41 ± 0.001°
β	87.473 ± 0.001°
γ	83.432 ± 0.001°
Cell volume	1347.44 ± 0.03 Å³
Cell temperature	99.98 ± 0.1 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0399
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.1038
Weighted residual factors for all reflections included in the refinement	0.1048
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
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/7132443.html