Crystallography Open Database

Information card for entry 1564909

Preview

Coordinates	1564909.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H19 N O2
Calculated formula	C19 H19 N O2
SMILES	O=C1N(C(=O)[C@@H]2[C@H]1[C@@H]1C[C@H]2C=C1)[C@H]1CCCc2c1cccc2
Title of publication	Cocatalyst versus precatalyst impact on the vinyl-addition polymerization of norbornenes with polar groups: looking at the other side of the coin
Authors of publication	Bermesheva, Evgeniya V.; Nazarov, Ivan V.; Kataranova, Ksenia D.; Khrychikova, Anna P.; Zarezin, Danil P.; Melnikova, Elizaveta K.; Asachenko, Andrey F.; Topchiy, Maxim A.; Rzhevskiy, Sergey A.; Bermeshev, Maxim V.
Journal of publication	Polymer Chemistry
Year of publication	2021
Journal volume	12
Journal issue	43
Pages of publication	6355 - 6362
a	5.4891 ± 0.0001 Å
b	10.9586 ± 0.0003 Å
c	24.8426 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	1494.35 ± 0.06 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	4
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	0.0286
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0693
Weighted residual factors for all reflections included in the refinement	0.0699
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
271234 (current)	2021-12-07	cif/ Updating files of 1564908, 1564909 Original log message: Adding full bibliography for 1564908--1564909.cif.	1564909.cif
269931	2021-10-14	cif/ Adding structures of 1564908, 1564909 via cif-deposit CGI script.	1564909.cif