Crystallography Open Database

Information card for entry 1543962

Preview

Coordinates	1543962.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H23 N4 O6 P
Calculated formula	C17 H23 N4 O6 P
Title of publication	Asymmetric Mannich Reaction of Isatin-Based Ketimines with α-Diazomethylphosphonates Catalyzed by Chiral Silver Phosphate.
Authors of publication	Chen, Jing; Wen, Xiaojing; Wang, Yan; Du, Fei; Cai, Liu; Peng, Yungui
Journal of publication	Organic letters
Year of publication	2016
Journal volume	18
Journal issue	17
Pages of publication	4336 - 4339
a	9.73106 ± 0.00013 Å
b	10.22183 ± 0.00014 Å
c	19.6704 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	1956.6 ± 0.04 Å³
Cell temperature	279.66 ± 0.1 K
Ambient diffraction temperature	279.66 ± 0.1 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0648
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.158
Weighted residual factors for all reflections included in the refinement	0.1605
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
187982 (current)	2016-11-06	cif/ Updating files of 1543962 Original log message: Adding full bibliography for 1543962.cif.	1543962.cif
185966	2016-08-24	cif/ Adding structures of 1543962 via cif-deposit CGI script.	1543962.cif