Crystallography Open Database

Information card for entry 4083646

Preview

Coordinates	4083646.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H61 F6 Mo N O3
Calculated formula	C48 H61 F6 Mo N O3
Title of publication	Molybdenum Imido Alkylidene Metathesis Catalysts that Contain Electron Withdrawing Biphenolates or Binaphtholates.
Authors of publication	Singh, Rojendra; Czekelius, Constantin; Schrock, Richard R.; Müller, Peter; Hoveyda, Amir H.
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	10
Pages of publication	2528 - 2539
a	12.7386 ± 0.0014 Å
b	12.9783 ± 0.0016 Å
c	15.7794 ± 0.0019 Å
α	76.012 ± 0.004°
β	80.948 ± 0.003°
γ	61.683 ± 0.003°
Cell volume	2225.7 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0505
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.0906
Weighted residual factors for all reflections included in the refinement	0.0942
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
178725 (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 4/08/36.	4083646.cif
117701	2014-06-15	cif/ Adding structures of 4083645, 4083646 via cif-deposit CGI script.	4083646.cif