Crystallography Open Database

Information card for entry 4327291

Preview

Coordinates	4327291.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H25 Mo N3 O2 S
Calculated formula	C28 H25 Mo N3 O2 S
Title of publication	Synthesis, Structure, and Characterization of Molybdenum(VI) Imido Complexes with N-Salicylidene-2-aminophenol
Authors of publication	Martin Minelli; Frances Namuswe; Daniel Jeffrey; Amy L. Morrow; Ilia A. Guzei; Dale Swenson; Eberhard Bothe; Thomas Weyhermüller
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Pages of publication	5455 - 5464
a	8.2851 ± 0.0002 Å
b	17.1205 ± 0.0005 Å
c	17.5495 ± 0.0005 Å
α	90°
β	99.822 ± 0.005°
γ	90°
Cell volume	2452.82 ± 0.12 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0496
Residual factor for significantly intense reflections	0.0383
Weighted residual factors for significantly intense reflections	0.0836
Weighted residual factors for all reflections included in the refinement	0.089
Goodness-of-fit parameter for all reflections included in the refinement	1.057
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
179375 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/72.	4327291.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4327291.cif
61007	2012-06-20	cif/ Adding structures of 4327291 via cif-deposit CGI script.	4327291.cif