Crystallography Open Database

Information card for entry 7721163

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Coordinates	7721163.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cd11 Cl In9 Rb4 Se26
Calculated formula	Cd11 Cl In9 Rb4 Se26
Title of publication	[Rb<sub>4</sub>Cl][Cd<sub>11</sub>In<sub>9</sub>Se<sub>26</sub>]: a salt inclusion chalcogenide with a diamond-like framework for infrared nonlinear optics.
Authors of publication	Xie, Pengzhi; Ren, Qixian; Feng, Junwei; Du, Hong; Mi, Shuyi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2026
a	20.7867 ± 0.0013 Å
b	21.5042 ± 0.0011 Å
c	13.5456 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	6054.9 ± 0.6 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.0229
Residual factor for significantly intense reflections	0.0216
Weighted residual factors for significantly intense reflections	0.044
Weighted residual factors for all reflections included in the refinement	0.0443
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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