Crystallography Open Database

Information card for entry 7048002

Preview

Coordinates	7048002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H49 N2 Ni O P
Calculated formula	C31 H49 N2 Ni O P
Title of publication	A comparative analysis of hydrosilative amide reduction catalyzed by first-row transition metal (Mn, Fe, Co, and Ni) N-phosphinoamidinate complexes.
Authors of publication	Macaulay, Casper M.; Ogawa, Takahiko; McDonald, Robert; Sydora, Orson L.; Stradiotto, Mark; Turculet, Laura
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	26
Pages of publication	9581 - 9587
a	10.4874 ± 0.0004 Å
b	10.8569 ± 0.0004 Å
c	14.6279 ± 0.0005 Å
α	70.005 ± 0.0004°
β	85.1598 ± 0.0005°
γ	87.5815 ± 0.0005°
Cell volume	1559.41 ± 0.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0368
Residual factor for significantly intense reflections	0.0327
Weighted residual factors for significantly intense reflections	0.087
Weighted residual factors for all reflections included in the refinement	0.0897
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
224061 (current)	2019-11-07	cif/ Updating files of 7048002, 7048003 Original log message: Adding full bibliography for 7048002--7048003.cif.	7048002.cif
211839	2018-11-08	cif/ Adding structures of 7048002, 7048003 via cif-deposit CGI script.	7048002.cif