Crystallography Open Database

Information card for entry 7707480

Preview

Coordinates	7707480.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C98 H128 Ga2 N4 Na2 O16
Calculated formula	C98 H128 Ga2 N4 Na2 O16
Title of publication	Activation and modification of carbon dioxide by redox-active low-valent gallium species.
Authors of publication	Dodonov, Vladimir A.; Kushnerova, Olga A.; Baranov, Evgeny V.; Novikov, Alexander S.; Fedushkin, Igor L.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	25
Pages of publication	8899 - 8906
a	13.9328 ± 0.0008 Å
b	14.1924 ± 0.0008 Å
c	15.9393 ± 0.0009 Å
α	93.983 ± 0.002°
β	113.353 ± 0.002°
γ	113.78 ± 0.002°
Cell volume	2547.4 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.1548
Residual factor for significantly intense reflections	0.083
Weighted residual factors for significantly intense reflections	0.163
Weighted residual factors for all reflections included in the refinement	0.1811
Goodness-of-fit parameter for all reflections included in the refinement	1.003
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
267183 (current)	2021-07-05	cif/ Updating files of 7707480, 7707481, 7707482, 7707483, 7707484, 7707485, 7707486, 7707487, 7707488, 7707489 Original log message: Adding full bibliography for 7707480--7707489.cif.	7707480.cif
265520	2021-05-27	cif/ Adding structures of 7707480, 7707481, 7707482, 7707483, 7707484, 7707485, 7707486, 7707487, 7707488, 7707489 via cif-deposit CGI script.	7707480.cif