Crystallography Open Database

Information card for entry 4080913

Preview

Coordinates	4080913.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H26 B F24 N O Si
Calculated formula	C38 H26 B F24 N O Si
Title of publication	Synthesis of Silaoxazolinium Salts Bearing Weakly Coordinating Anions: Structures and Catalytic Activities in the Aldol Reaction
Authors of publication	Chandra Sheker Reddy, Anugu; Chen, Zhang; Hatanaka, Tohru; Minami, Tatsuya; Hatanaka, Yasuo
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	13
Pages of publication	3575
a	16.569 ± 0.006 Å
b	31.944 ± 0.005 Å
c	15.811 ± 0.002 Å
α	90°
β	90.34 ± 0.02°
γ	90°
Cell volume	8368 ± 3 Å³
Cell temperature	203.2 K
Ambient diffraction temperature	203.2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for significantly intense reflections	0.0768
Weighted residual factors for all reflections included in the refinement	0.249
Goodness-of-fit parameter for all reflections included in the refinement	1.631
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4080913.cif
87948	2013-08-27	cif/ Adding structures of 4080913, 4080914, 4080915, 4080916 via cif-deposit CGI script.	4080913.cif