Crystallography Open Database

Information card for entry 4085595

Preview

Coordinates	4085595.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H32 Mo O2 Si
Calculated formula	C33 H32 Mo O2 Si
Title of publication	η3-Silaallyl/Alkenylsilyl Molybdenum Complex: Synthesis, Structure, and Reactivity toward Primary Amines To Form Mo‒N‒Si Three-Membered Cyclic Complexes
Authors of publication	Sakaba, Hiroyuki; Tonosaki, Hiroki; Isozaki, Kazuyoshi; Kwon, Eunsang
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	6
Pages of publication	1029
a	8.887 ± 0.002 Å
b	17.682 ± 0.004 Å
c	17.762 ± 0.004 Å
α	90°
β	98.998 ± 0.003°
γ	90°
Cell volume	2756.8 ± 1.1 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0439
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.103
Weighted residual factors for all reflections included in the refinement	0.1049
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
178744 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/55.	4085595.cif
134855	2015-04-04	cif/ Updating files of 4085595, 4085596, 4085597 Original log message: Adding full bibliography for 4085595--4085597.cif.	4085595.cif
133738	2015-03-10	cif/ Adding structures of 4085595, 4085596, 4085597 via cif-deposit CGI script.	4085595.cif