Crystallography Open Database

Information card for entry 7125626

Preview

Coordinates	7125626.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C98 H126 Li2 O17.5 Sn7
Calculated formula	C94 H118 Li2 O16.5 Sn7
Title of publication	Reductive dehydrocoupling of diphenyltin dihydride with LiAlH<sub>4</sub>: selective synthesis and structures of the first bicyclo[2.2.1]heptastannane-1,4-diide and bicyclo[2.2.2]octastannane-1,4-diide.
Authors of publication	Steller, Beate G.; Fischer, Roland C.; Flock, Michaela; Hill, Michael S.; Liptrot, David J.; McMullin, Claire L.; Rajabi, Nasir A.; Tiefling, Kathrin; Wilson, Andrew S. S.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	3
Pages of publication	336 - 339
a	14.3301 ± 0.0009 Å
b	15.1075 ± 0.001 Å
c	26.1181 ± 0.0019 Å
α	82.634 ± 0.002°
β	76.623 ± 0.003°
γ	70.379 ± 0.002°
Cell volume	5173.7 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.01 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	0.0568
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0912
Weighted residual factors for all reflections included in the refinement	0.1067
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
247621 (current)	2020-02-04	cif/ Updating files of 7125626, 7125627, 7125628, 7125629, 7125630 Original log message: Adding full bibliography for 7125626--7125630.cif.	7125626.cif
244815	2019-11-30	cif/ Adding structures of 7125626, 7125627, 7125628, 7125629, 7125630 via cif-deposit CGI script.	7125626.cif