Crystallography Open Database

Information card for entry 7160604

Preview

Coordinates	7160604.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H30 N2 O2
Calculated formula	C21 H30 N2 O2
Title of publication	Suppression of Rapid Deactivation of Catalytic Tetrapeptides in the Asymmetric Michael Addition of Aldehydes to Nitroolefins by Supporting Them on Polymers
Authors of publication	Yuan, Meng; Liu, Yang-Xin; Ding, Tie-Ying; Zhang, Ze-Xuan; Lian, Tian-Rui; Zhao, Peng-Fei; Du, Zhi-Hong; Da, Chao-Shan
Journal of publication	Organic & Biomolecular Chemistry
Year of publication	2025
a	7.8751 ± 0.0002 Å
b	9.2837 ± 0.0002 Å
c	14.3774 ± 0.0004 Å
α	73.689 ± 0.002°
β	78.406 ± 0.003°
γ	84.583 ± 0.002°
Cell volume	987.44 ± 0.05 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0733
Residual factor for significantly intense reflections	0.0679
Weighted residual factors for significantly intense reflections	0.1848
Weighted residual factors for all reflections included in the refinement	0.1881
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation probe	x-ray
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
300180 (current)	2025-06-25	cif/ Adding structures of 7160604, 7160605 via cif-deposit CGI script.	7160604.cif