Crystallography Open Database

Information card for entry 4032011

4032010 << 4032011 >> 4032012

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Coordinates	4032011.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H21 B2 F8 N3
Calculated formula	C24 H21 B2 F8 N3
Title of publication	Synthesis, Structure, and Photochemical Behavior of [5]Heli-viologen Isomers.
Authors of publication	Zhang, Xiaoping; Clennan, Edward L.; Arulsamy, Navamoney; Weber, Rachael; Weber, Jacob
Journal of publication	The Journal of organic chemistry
Year of publication	2016
Journal volume	81
Journal issue	13
Pages of publication	5474 - 5486
a	22.7449 ± 0.0006 Å
b	19.7482 ± 0.0006 Å
c	11.4956 ± 0.0003 Å
α	90°
β	115.335 ± 0.001°
γ	90°
Cell volume	4666.9 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0989
Residual factor for significantly intense reflections	0.0745
Weighted residual factors for significantly intense reflections	0.2156
Weighted residual factors for all reflections included in the refinement	0.2443
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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