Crystallography Open Database

Information card for entry 7134521

Preview

Coordinates	7134521.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34.5 H37 F6 N4 P Sb
Calculated formula	C34.5 H37 F6 N4 P Sb
Title of publication	A dicationic distibine stabilized by intramolecular π–π interaction and second-sphere coordination
Authors of publication	Zhang, Lingjie; Huang, Minghao; Zhou, Jiliang
Journal of publication	Chemical Communications
Year of publication	2025
Journal volume	61
Journal issue	47
Pages of publication	8592 - 8595
a	19.8847 ± 0.0005 Å
b	14.7666 ± 0.0004 Å
c	23.377 ± 0.0006 Å
α	90°
β	96.49 ± 0.001°
γ	90°
Cell volume	6820.2 ± 0.3 Å³
Cell temperature	153 K
Ambient diffraction temperature	153 K
Number of distinct elements	6
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	0.0252
Residual factor for significantly intense reflections	0.0238
Weighted residual factors for significantly intense reflections	0.0598
Weighted residual factors for all reflections included in the refinement	0.0606
Goodness-of-fit parameter for all reflections included in the refinement	1.125
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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