Crystallography Open Database

Information card for entry 7702426

Preview

Coordinates	7702426.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29.5 H69 Li3 N12 Si6
Calculated formula	C29.5 H63 Li3 N12 Si6
Title of publication	Reactions of 1,3,5-triazine with organolithium compounds containing trimethylsilyl substituents; X-ray structures of 1,3,5-triaza- and 1,3,5,7-tetraaza-heptatrienyllithium compounds †
Authors of publication	Boesveld, W. Marco; Hitchcock, Peter B.; Lappert, Michael F.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	22
Pages of publication	4041
a	18.869 ± 0.007 Å
b	14.603 ± 0.004 Å
c	19.523 ± 0.004 Å
α	90°
β	112.1 ± 0.02°
γ	90°
Cell volume	4984 ± 3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1186
Residual factor for significantly intense reflections	0.061
Weighted residual factors for all reflections	0.1608
Weighted residual factors for significantly intense reflections	0.1316
Goodness-of-fit parameter for all reflections	1.02
Goodness-of-fit parameter for significantly intense reflections	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243861 (current)	2019-11-28	cif/ Adding structures of 7702426, 7702427, 7702428, 7702429 via cif-deposit CGI script.	7702426.cif