Crystallography Open Database

Information card for entry 7125690

Preview

Coordinates	7125690.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H24 N3 O2 P
Calculated formula	C28 H24 N3 O2 P
Title of publication	Cobaltaelectro-catalyzed oxidative allene annulation by electro-removable hydrazides.
Authors of publication	Mei, Ruhuai; Fang, Xinyue; He, Liang; Sun, Junmei; Zou, Liang; Ma, Wenbo; Ackermann, Lutz
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	9
Pages of publication	1393 - 1396
a	9.7656 ± 0.0003 Å
b	22.5128 ± 0.0005 Å
c	11.5704 ± 0.0003 Å
α	90°
β	110.736 ± 0.003°
γ	90°
Cell volume	2378.98 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.071
Residual factor for significantly intense reflections	0.0618
Weighted residual factors for significantly intense reflections	0.1683
Weighted residual factors for all reflections included in the refinement	0.1834
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
247619 (current)	2020-02-04	cif/ Updating files of 7125690, 7125691 Original log message: Adding full bibliography for 7125690--7125691.cif.	7125690.cif
245548	2019-12-24	cif/ Adding structures of 7125690, 7125691 via cif-deposit CGI script.	7125690.cif