Crystallography Open Database

Information card for entry 1545183

Preview

Coordinates	1545183.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H15 Np
Calculated formula	C15 H15 Np
Title of publication	Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
Authors of publication	Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
Journal of publication	Chem. Sci.
Year of publication	2017
Journal volume	8
Journal issue	4
Pages of publication	2553
a	14.1208 ± 0.0006 Å
b	8.7037 ± 0.0006 Å
c	9.5917 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1178.85 ± 0.11 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	3
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.0145
Residual factor for significantly intense reflections	0.0141
Weighted residual factors for significantly intense reflections	0.0355
Weighted residual factors for all reflections included in the refinement	0.0359
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
195014 (current)	2017-04-05	cif/ Updating files of 1545181, 1545182, 1545183, 1545184, 1545185 Original log message: Adding full bibliography for 1545181--1545185.cif.	1545183.cif
191146	2017-01-31	cif/ Adding structures of 1545181, 1545182, 1545183, 1545184, 1545185 via cif-deposit CGI script.	1545183.cif