Crystallography Open Database

Information card for entry 7721090

Preview

Coordinates	7721090.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Acetamidinium lead bromide
Chemical name	Acetamidinium bromoplumbate
Formula	C6 H21 Br5 N6 Pb
Calculated formula	C6 H21 Br5 N6 Pb
Title of publication	Crystal structure and properties of acetamidinium lead bromide: a new member of the A<sub>3</sub>PbBr<sub>5</sub> halide family.
Authors of publication	Wang, Huanzhou; Petrov, Andrey A.; Petrov, Andrey V.; Li, Mingming; Fateev, Sergey A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2026
Journal volume	55
Journal issue	20
Pages of publication	7918 - 7925
a	18.55 ± 0.003 Å
b	9.2337 ± 0.0015 Å
c	11.9729 ± 0.0018 Å
α	90°
β	100.272 ± 0.006°
γ	90°
Cell volume	2017.9 ± 0.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0648
Residual factor for significantly intense reflections	0.0424
Weighted residual factors for significantly intense reflections	0.1116
Weighted residual factors for all reflections included in the refinement	0.1222
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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