Crystallography Open Database

Information card for entry 7160204

Preview

Coordinates	7160204.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H23 Cl3 N2 O7
Calculated formula	C34 H23 Cl3 N2 O7
Title of publication	Iridium-catalyzed tandem olefination/aza-Michael reaction: rapid access to N-N functionalized hydrazides.
Authors of publication	Zhang, Chao; Dong, Lin
Journal of publication	Organic & biomolecular chemistry
Year of publication	2025
Journal volume	23
Journal issue	3
Pages of publication	673 - 678
a	11.4075 ± 0.0001 Å
b	12.0938 ± 0.0001 Å
c	13.1116 ± 0.0001 Å
α	81.557 ± 0.001°
β	67.569 ± 0.001°
γ	73.629 ± 0.001°
Cell volume	1602.65 ± 0.03 Å³
Cell temperature	300.57 ± 0.1 K
Ambient diffraction temperature	300.57 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0544
Residual factor for significantly intense reflections	0.0515
Weighted residual factors for significantly intense reflections	0.1424
Weighted residual factors for all reflections included in the refinement	0.145
Goodness-of-fit parameter for all reflections included in the refinement	1.106
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

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7160204.html