Crystallography Open Database

Information card for entry 1556616

Preview

Coordinates	1556616.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H116 Si16
Calculated formula	C48 H116 Si16
SMILES	C1(CCC([Si]1=[Si]1[Si]2(C(C)(C)C)[Si]3(C(C)(C)C)[Si]1(C(C)(C)C)[Si]2(C(C)(C)C)[Si]3=[Si]1C(CCC1([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
Title of publication	Transformative Si8R8 Siliconoids
Authors of publication	Akasaka, N.; Ishida, S.; Iwamoto, T.
Journal of publication	Inorganics
Year of publication	2018
Journal volume	6
Pages of publication	107
a	21.538 ± 0.002 Å
b	17.9167 ± 0.0019 Å
c	20.793 ± 0.003 Å
α	90°
β	118.875 ± 0.001°
γ	90°
Cell volume	7026.3 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	3
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0617
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.0769
Weighted residual factors for all reflections included in the refinement	0.091
Goodness-of-fit parameter for all reflections included in the refinement	1.077
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
245253 (current)	2019-12-17	cif/ Adding structures of 1556616 via cif-deposit CGI script.	1556616.cif