Crystallography Open Database

Information card for entry 4348009

Preview

Coordinates	4348009.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H44 Cs N2 Na Si4
Calculated formula	C19 H44 Cs0.989 N2 Na Si4
SMILES	C[Si](C)(C)[N]1([Cs][N]([Si](C)(C)C)([Si](C)(C)C)[Na]1)[Si](C)(C)C.c1(ccccc1)C
Title of publication	Structural Studies of Cesium, Lithium/Cesium, and Sodium/Cesium Bis(trimethylsilyl)amide (HMDS) Complexes.
Authors of publication	Ojeda-Amador, Ana I; Martínez-Martínez, Antonio J; Kennedy, Alan R.; O'Hara, Charles T
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	11
Pages of publication	5719 - 5728
a	11.4391 ± 0.0006 Å
b	11.6765 ± 0.0006 Å
c	12.9108 ± 0.0005 Å
α	106.202 ± 0.004°
β	93.447 ± 0.004°
γ	114.11 ± 0.005°
Cell volume	1481.41 ± 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	0.0437
Residual factor for significantly intense reflections	0.0378
Weighted residual factors for significantly intense reflections	0.0962
Weighted residual factors for all reflections included in the refinement	0.1
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
286259 (current)	2023-09-07	cif/4 Fixing Z values and formulae	4348009.cif
232638	2019-11-23	cif/ Adding structures of 4348008, 4348009, 4348010, 4348011, 4348012, 4348013, 4348014 via cif-deposit CGI script.	4348009.cif