Crystallography Open Database

Information card for entry 7027584

Preview

Coordinates	7027584.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H59 Mo N3 O6 Si4
Calculated formula	C62 H59 Mo N3 O6 Si4
Title of publication	High oxidation state chromium, molybdenum and tungsten imido metallasiloxanes
Authors of publication	King, Lawrence; Motevalli, Majid; Sullivan, Alice C.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	18
Pages of publication	3225
a	13.655 ± 0.009 Å
b	14.524 ± 0.01 Å
c	16.072 ± 0.012 Å
α	102.67 ± 0.08°
β	87.75 ± 0.06°
γ	107.62 ± 0.06°
Cell volume	2963 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.2446
Residual factor for significantly intense reflections	0.113
Weighted residual factors for significantly intense reflections	0.2557
Weighted residual factors for all reflections included in the refinement	0.3015
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
179981 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/75.	7027584.cif
95506	2014-01-28	cif/ Adding structures of 7027583, 7027584, 7027585 via cif-deposit CGI script.	7027584.cif