Crystallography Open Database

Information card for entry 7248417

Preview

Coordinates	7248417.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H34 N2 O2
Calculated formula	C26 H34 N2 O2
SMILES	O(c1c(cc2N3CCC[C@@H]3[C@H]3[C@H](N(CC3)c3cc(c(OC)c(c3)C)C)c2c1C)C)C.O(c1c(cc2N3CCC[C@H]3[C@@H]3[C@@H](N(CC3)c3cc(c(OC)c(c3)C)C)c2c1C)C)C
Title of publication	Redox-neutral α-functionalization of pyrrolidines: facile access to α-aryl-substituted pyrrolidines
Authors of publication	Tian, Feng-Xian; Liu, Fan-Fan; Wei, Jian; Xiao, Jia-Xi; Qu, Jin
Journal of publication	RSC Advances
Year of publication	2024
Journal volume	14
Journal issue	17
Pages of publication	11986 - 11991
a	10.168 ± 0.002 Å
b	10.859 ± 0.002 Å
c	11.191 ± 0.002 Å
α	82.43 ± 0.03°
β	64.17 ± 0.03°
γ	76.64 ± 0.03°
Cell volume	1081.4 ± 0.5 Å³
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	0.058
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
291220 (current)	2024-04-16	cif/ Adding structures of 7248417 via cif-deposit CGI script.	7248417.cif