Crystallography Open Database

Information card for entry 4071532

Preview

Coordinates	4071532.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H68 B F30 Mo N O4
Calculated formula	C70 H68 B F30 Mo N O4
Title of publication	Cationic Molybdenum Imido Alkylidene Complexes
Authors of publication	Jiang, Annie J.; Schrock, Richard R.; Müller, Peter
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	17
Pages of publication	4428
a	16.2 ± 0.002 Å
b	22.5 ± 0.003 Å
c	20.048 ± 0.003 Å
α	90°
β	96.045 ± 0.002°
γ	90°
Cell volume	7266.9 ± 1.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0482
Residual factor for significantly intense reflections	0.0354
Weighted residual factors for significantly intense reflections	0.0874
Weighted residual factors for all reflections included in the refinement	0.097
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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
178604 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/15.	4071532.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071532.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071532.cif
43896	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071529, 4071530, 4071531, 4071532, 4071533 via cif-deposit CGI script.	4071532.cif