Crystallography Open Database

Information card for entry 4326002

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Coordinates	4326002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As2 Ca2 Cd
Calculated formula	As2 Ca2 Cd
Title of publication	Synthesis, Crystal and Electronic Structures, and Properties of the New Pnictide Semiconductors A2CdPn2 (A= Ca, Sr, Ba, Eu;Pn= P, As)
Authors of publication	Jian Wang; Min Yang; Ming-Yan Pan; Sheng-Qing Xia; Xu-Tang Tao; Hua He; Gregory Darone; Svilen Bobev
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	8020 - 8027
a	4.3163 ± 0.0005 Å
b	16.5063 ± 0.0019 Å
c	7.1418 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	508.83 ± 0.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
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	0.0175
Residual factor for significantly intense reflections	0.0165
Weighted residual factors for significantly intense reflections	0.029
Weighted residual factors for all reflections included in the refinement	0.0292
Goodness-of-fit parameter for all reflections included in the refinement	0.993
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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