Crystallography Open Database

Information card for entry 7027583

Preview

Coordinates	7027583.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H66 N2 O6 Si4 W
Calculated formula	C63 H58 N2 O6 Si4 W
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	10.333 ± 0.004 Å
b	10.733 ± 0.008 Å
c	14.149 ± 0.007 Å
α	110.88 ± 0.06°
β	90.08 ± 0.04°
γ	99.91 ± 0.04°
Cell volume	1440.9 ± 1.5 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	0.0696
Residual factor for significantly intense reflections	0.0638
Weighted residual factors for significantly intense reflections	0.1566
Weighted residual factors for all reflections included in the refinement	0.1619
Goodness-of-fit parameter for all reflections included in the refinement	1.258
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
209360 (current)	2018-08-02	cif/7/02/75/ Updating space group information in entry 7027583.	7027583.cif
176432	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7027583.cif
95506	2014-01-28	cif/ Adding structures of 7027583, 7027584, 7027585 via cif-deposit CGI script.	7027583.cif