Crystallography Open Database

Information card for entry 7700498

Preview

Coordinates	7700498.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H38 B2 Cl2 F8 Mo2 N2 O4 S2
Calculated formula	C45 H38 B2 Cl2 F8 Mo2 N2 O4 S2
Title of publication	Propene complexes of molybdenum and tungsten stabilized by intramolecular coordination of the 1-(quinol-8-yl)indenyl ligand.
Authors of publication	Mrózek, Ondřej; Dostál, Libor; Císařová, Ivana; Honzíček, Jan; Vinklárek, Jaromír
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	32
Pages of publication	12210 - 12218
a	14.5014 ± 0.0007 Å
b	11.0265 ± 0.0006 Å
c	14.7195 ± 0.0007 Å
α	90°
β	106.503 ± 0.002°
γ	90°
Cell volume	2256.7 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	9
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0333
Residual factor for significantly intense reflections	0.0267
Weighted residual factors for significantly intense reflections	0.0637
Weighted residual factors for all reflections included in the refinement	0.0674
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
223912 (current)	2019-11-07	cif/ Updating files of 7700495, 7700496, 7700497, 7700498, 7700499 Original log message: Adding full bibliography for 7700495--7700499.cif.	7700498.cif
216944	2019-07-11	cif/ Adding structures of 7700495, 7700496, 7700497, 7700498, 7700499 via cif-deposit CGI script.	7700498.cif