Crystallography Open Database

Information card for entry 7121880

Preview

Coordinates	7121880.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C135 H202 Si6
Calculated formula	C135 H190 Si6
Title of publication	Phenylene-bridged cross-conjugated 1,2,3-trisilacyclopentadienes.
Authors of publication	Zhao, Hui; Klemmer, Lukas; Cowley, Michael J.; Majumdar, Moumita; Huch, Volker; Zimmer, Michael; Scheschkewitz, David
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	60
Pages of publication	8399 - 8402
a	40.86 ± 0.03 Å
b	14.207 ± 0.009 Å
c	23.479 ± 0.016 Å
α	90°
β	96.47 ± 0.03°
γ	90°
Cell volume	13543 ± 16 Å³
Cell temperature	224 ± 2 K
Ambient diffraction temperature	224 ± 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	0.1178
Residual factor for significantly intense reflections	0.0819
Weighted residual factors for significantly intense reflections	0.2357
Weighted residual factors for all reflections included in the refinement	0.2478
Goodness-of-fit parameter for all reflections included in the refinement	1.739
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
228545 (current)	2019-11-17	cif/ Updating files of 7121879, 7121880, 7121881 Original log message: Adding full bibliography for 7121879--7121881.cif.	7121880.cif
208638	2018-06-26	cif/ Adding structures of 7121879, 7121880, 7121881 via cif-deposit CGI script.	7121880.cif