Crystallography Open Database

Information card for entry 4330273

Preview

Coordinates	4330273.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H93 N3 O Os2 P4
Calculated formula	C40 H93 N3 O Os2 P4
Title of publication	Reactions of an Osmium-Hexahydride Complex with Cytosine, Deoxycytidine, and Cytidine: The Importance of the Minor Tautomers
Authors of publication	Miguel A. Esteruelas; Jorge García-Raboso; Montserrat Oliván
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	9522 - 9528
a	14.1939 ± 0.0009 Å
b	15.7893 ± 0.0011 Å
c	21.4859 ± 0.0013 Å
α	90°
β	96.021 ± 0.006°
γ	90°
Cell volume	4788.7 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1429
Residual factor for significantly intense reflections	0.0715
Weighted residual factors for significantly intense reflections	0.0812
Weighted residual factors for all reflections included in the refinement	0.1051
Goodness-of-fit parameter for all reflections included in the refinement	0.984
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179405 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/02.	4330273.cif
79524	2013-04-05	cif/ Adding structures of 4330273 via cif-deposit CGI script.	4330273.cif