Crystallography Open Database

Information card for entry 7718566

Preview

Coordinates	7718566.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H7 F2 I N2 O2
Calculated formula	C5 H7 F2 I N2 O2
Title of publication	(C<sub>5</sub>N<sub>2</sub>H<sub>7</sub>)IO<sub>2</sub>F<sub>2</sub> and (C<sub>3</sub>N<sub>6</sub>H<sub>8</sub>)(IO<sub>2</sub>F<sub>2</sub>)<sub>2</sub>: two new organic-inorganic hybrid fluoroiodate birefringent crystals.
Authors of publication	Yuan, Si; Hu, Chun-Li; Mao, Jiang-Gao
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	21
Pages of publication	8667 - 8672
a	7.4919 ± 0.0003 Å
b	17.699 ± 0.0006 Å
c	6.305 ± 0.0002 Å
α	90°
β	98.893 ± 0.003°
γ	90°
Cell volume	825.99 ± 0.05 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0174
Residual factor for significantly intense reflections	0.0169
Weighted residual factors for significantly intense reflections	0.0413
Weighted residual factors for all reflections included in the refinement	0.0415
Goodness-of-fit parameter for all reflections included in the refinement	1.175
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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