Crystallography Open Database

Information card for entry 4068693

Preview

Coordinates	4068693.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H54 N2 O2 Si2 Sn
Calculated formula	C54 H54 N2 O2 Si2 Sn
Title of publication	Reactivity of a C,N-Chelated Stannoxane†
Authors of publication	Padělková, Zdeňka; Vaňkátová, Hana; Císařová, Ivana; Nechaev, Mikhail S.; Zevaco, Thomas A.; Walter, Olaf; Růžička, Aleš
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	8
Pages of publication	2629
a	10.686 ± 0.0013 Å
b	21.286 ± 0.002 Å
c	21.891 ± 0.002 Å
α	104.231 ± 0.006°
β	90.922 ± 0.008°
γ	95.977 ± 0.008°
Cell volume	4795.8 ± 0.9 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1046
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.1011
Weighted residual factors for all reflections included in the refinement	0.124
Goodness-of-fit parameter for all reflections included in the refinement	1.184
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
178576 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/86.	4068693.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4068693.cif
39931	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4068691, 4068692, 4068693, 4068694 via cif-deposit CGI script.	4068693.cif