Crystallography Open Database

Information card for entry 7112020

7112019 << 7112020 >> 7112021

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Coordinates	7112020.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47.5 H56 Br N Si Sn
Calculated formula	C47.5 H56 Br N Si Sn
Title of publication	A singly bonded amido-distannyne: H2 activation and isocyanide coordination
Authors of publication	Terrance J. Hadlington; Cameron Jones
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	2321
a	9.9346 ± 0.0004 Å
b	13.1778 ± 0.0005 Å
c	17.8089 ± 0.0008 Å
α	72.26 ± 0.002°
β	74.655 ± 0.002°
γ	71.45 ± 0.002°
Cell volume	2068.62 ± 0.15 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0439
Residual factor for significantly intense reflections	0.0409
Weighted residual factors for significantly intense reflections	0.1071
Weighted residual factors for all reflections included in the refinement	0.1082
Goodness-of-fit parameter for all reflections included in the refinement	1.183
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7112020.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7112020.cif
103343	2014-02-28	cif/ Adding structures of 7112016, 7112017, 7112018, 7112019, 7112020 via cif-deposit CGI script.	7112020.cif