Crystallography Open Database

Information card for entry 4330224

Preview

Coordinates	4330224.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C89 H110 N4 P2 Sn2
Calculated formula	C89 H110 N4 P2 Sn2
Title of publication	Group 14 Metal Terminal Phosphides: Correlating Structure with \|JMP\|
Authors of publication	Eric C. Y. Tam; Nicola A. Maynard; David C. Apperley; J. David Smith; Martyn P. Coles; J. Robin Fulton
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	9403 - 9415
a	12.6382 ± 0.0003 Å
b	17.6553 ± 0.0004 Å
c	19.5975 ± 0.0004 Å
α	69.422 ± 0.001°
β	84.81 ± 0.001°
γ	74.862 ± 0.001°
Cell volume	3951.74 ± 0.16 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0994
Residual factor for significantly intense reflections	0.0553
Weighted residual factors for significantly intense reflections	0.1229
Weighted residual factors for all reflections included in the refinement	0.1391
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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